Species |
Name |
Bond type |
Bond Length (Å) |
Experimental |
Calculated |
Difference |
C4H6 |
1-Methylcyclopropene |
rCH |
1.085 |
4.247 |
3.162 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.087 |
3.481 |
2.394 |
Be2 |
Beryllium diatomic |
rBeBe |
2.460 |
4.817 |
2.357 |
Mg2 |
Magnesium diatomic |
rMgMg |
3.891 |
5.873 |
1.983 |
S4 |
Sulfur tetramer |
rSS |
2.155 |
3.216 |
1.061 |
C2H4O3 |
trioxolane124 |
rCN |
1.303 |
2.300 |
0.997 |
HSSSH |
trisulfane |
rHS |
1.344 |
2.290 |
0.946 |
HSSSH |
trisulfane |
rHS |
1.344 |
2.290 |
0.946 |
HSSSH |
trisulfane |
rHS |
1.344 |
2.290 |
0.946 |
HSSSH |
trisulfane |
rHS |
1.344 |
2.290 |
0.946 |
CH3CH2SH |
ethanethiol |
rCH |
1.095 |
1.919 |
0.824 |
CH3CH2SH |
ethanethiol |
rCH |
1.095 |
1.916 |
0.821 |
C4H6 |
1-Methylcyclopropene |
rCC |
1.476 |
2.296 |
0.820 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.087 |
1.836 |
0.749 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.098 |
1.790 |
0.692 |
Ar2 |
Argon diatomic |
rArAr |
3.758 |
4.445 |
0.687 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.098 |
1.780 |
0.682 |
S4 |
Sulfur tetramer |
rSS |
2.155 |
2.793 |
0.638 |
S4 |
Sulfur tetramer |
rSS |
2.155 |
2.792 |
0.637 |
CH3SO2NH2 |
methanesulfonamide |
rCN |
1.207 |
1.797 |
0.590 |
Al2 |
Aluminum diatomic |
rAlAl |
2.701 |
3.270 |
0.569 |
S4 |
Sulfur tetramer |
rSS |
1.898 |
2.377 |
0.479 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.070 |
1.544 |
0.474 |
CH3CH2SH |
ethanethiol |
rCH |
1.089 |
1.539 |
0.450 |
CH3CH2SH |
ethanethiol |
rCH |
1.089 |
1.538 |
0.449 |
CH3CH2SH |
ethanethiol |
rCH |
1.092 |
1.539 |
0.447 |
CH3CH2SH |
ethanethiol |
rCH |
1.092 |
1.538 |
0.446 |
C2H4F2 |
1,2-difluoroethane |
rCH |
1.093 |
1.528 |
0.435 |
C2H4F2 |
1,2-difluoroethane |
rCH |
1.093 |
1.528 |
0.435 |
S3 |
Sulfur trimer |
rSS |
1.917 |
2.350 |
0.433 |
C4H10O |
Methyl propyl ether |
rCC |
1.530 |
1.104 |
-0.426 |
C2H4F2 |
1,2-difluoroethane |
rCH |
1.093 |
1.517 |
0.424 |
C2H4F2 |
1,2-difluoroethane |
rCH |
1.093 |
1.517 |
0.424 |
C4H6 |
1-Methylcyclopropene |
rCC |
1.515 |
1.096 |
-0.419 |
Be2 |
Beryllium diatomic |
rBeBe |
2.460 |
2.052 |
-0.408 |
CaS |
Calcium sulfide |
rSCa |
2.318 |
2.713 |
0.395 |
CH3CH2SH |
ethanethiol |
rCC |
1.528 |
1.919 |
0.391 |
CH3CH2SH |
ethanethiol |
rCC |
1.528 |
1.916 |
0.388 |
Al2Cl6 |
Aluminum, di-μ-chlorotetrachlorodi- |
rAlCl |
2.040 |
2.427 |
0.387 |
CH2CHCH2F |
Allyl Fluoride |
rHC |
1.130 |
1.514 |
0.384 |
CH2CHCH2F |
Allyl Fluoride |
rHC |
1.130 |
1.510 |
0.380 |
C3H3NO |
Isoxazole |
rCH |
1.075 |
1.451 |
0.376 |
C4H10O |
Methyl propyl ether |
rCH |
1.099 |
1.460 |
0.361 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.137 |
-0.313 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.137 |
-0.313 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.137 |
-0.313 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.137 |
-0.313 |
HClO4 |
perchloric acid |
rOCl |
1.404 |
1.717 |
0.313 |
FSSF |
Difluorodisulfane |
rSS |
1.890 |
2.201 |
0.311 |
SOCl2 |
thionyl chloride |
rSCl |
2.076 |
2.379 |
0.303 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.899 |
0.302 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.899 |
0.302 |
Ar2+ |
Argon diatomic cation |
rArAr |
2.320 |
2.621 |
0.301 |
HClO4 |
perchloric acid |
rOCl |
1.414 |
1.712 |
0.298 |
K2 |
Potassium diatomic |
rKK |
3.905 |
4.200 |
0.295 |
SF5Cl |
sulfur chloropentafluoride |
rSCl |
2.030 |
2.322 |
0.292 |
ClSSCl |
Disulfur dichloride |
rSS |
1.931 |
2.219 |
0.288 |
CH3CH2SH |
ethanethiol |
rCS |
1.820 |
1.538 |
-0.282 |
CH3CH2SH |
ethanethiol |
rCS |
1.820 |
1.539 |
-0.281 |
C2H2+ |
acetylene cation |
rCH |
1.077 |
1.354 |
0.278 |
CaCl |
calcium monochloride |
rClCa |
2.437 |
2.713 |
0.276 |
Cl2+ |
chlorine diatomic cation |
rClCl |
1.892 |
2.167 |
0.275 |
Cl2+ |
chlorine diatomic cation |
rClCl |
1.892 |
2.167 |
0.275 |
CaO |
Calcium monoxide |
rOCa |
1.822 |
2.093 |
0.271 |
CaO |
Calcium monoxide |
rOCa |
1.822 |
2.093 |
0.271 |
Cl2 |
Chlorine diatomic |
rClCl |
1.988 |
2.252 |
0.264 |
SFCl |
Sulfur chloride fluoride |
rSCl |
1.994 |
2.254 |
0.260 |
SCl2 |
Sulfur dichloride |
rSCl |
2.013 |
2.264 |
0.251 |
SCl2 |
Sulfur dichloride |
rSCl |
2.013 |
2.264 |
0.251 |
OClO |
Chlorine dioxide |
rClO |
1.470 |
1.721 |
0.251 |
CH3SSH |
Hydrogen methyl disulfide |
rSS |
2.038 |
2.289 |
0.251 |
C4H6 |
1-Methylcyclopropene |
rCC |
1.300 |
1.548 |
0.248 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.152 |
-0.248 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.152 |
-0.248 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.152 |
-0.248 |
CaBr |
Calcium monobromide |
rCaBr |
2.594 |
2.840 |
0.246 |
H2S2 |
Disulfane |
rSS |
2.056 |
2.299 |
0.242 |
BrCl |
Bromine monochloride |
rClBr |
2.136 |
2.377 |
0.241 |
BrCl |
Bromine monochloride |
rClBr |
2.136 |
2.377 |
0.241 |
CH3SSCH3 |
Disulfide, dimethyl |
rSS |
2.038 |
2.279 |
0.241 |
ClOF3 |
Chlorine trifluoride oxide |
rFCl |
1.603 |
1.841 |
0.238 |
ONNO |
NO dimer |
rNN |
2.236 |
1.998 |
-0.238 |
HClO4 |
perchloric acid |
rOCl |
1.641 |
1.878 |
0.237 |
HSSSH |
trisulfane |
rSS |
2.053 |
2.290 |
0.237 |
HSSSH |
trisulfane |
rSS |
2.053 |
2.290 |
0.237 |
HSSSH |
trisulfane |
rSS |
2.053 |
2.290 |
0.237 |
HSSSH |
trisulfane |
rSS |
2.053 |
2.290 |
0.237 |
HSSSH |
trisulfane |
rSS |
2.054 |
2.290 |
0.236 |
HSSSH |
trisulfane |
rSS |
2.054 |
2.290 |
0.236 |
HSSSH |
trisulfane |
rSS |
2.054 |
2.290 |
0.236 |
HSSSH |
trisulfane |
rSS |
2.054 |
2.290 |
0.236 |
ClOF3 |
Chlorine trifluoride oxide |
rOCl |
1.405 |
1.639 |
0.234 |
OPCl |
Phosphorus oxychloride |
rPCl |
2.059 |
2.291 |
0.233 |
ClSSCl |
Disulfur dichloride |
rSCl |
2.057 |
2.286 |
0.229 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
2.338 |
0.228 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
2.338 |
0.228 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
2.338 |
0.228 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
2.338 |
0.228 |
Br2 |
Bromine diatomic |
rBrBr |
2.281 |
2.507 |
0.226 |
Br2 |
Bromine diatomic |
rBrBr |
2.281 |
2.507 |
0.226 |
S2 |
Sulfur diatomic |
rSS |
1.889 |
2.114 |
0.224 |
S8 |
Octasulfur |
rSS |
2.059 |
2.282 |
0.223 |
C2H6O2S |
Dimethyl sulfone |
rSO |
1.431 |
1.652 |
0.221 |
NO3 |
Nitrogen trioxide |
rNO |
1.238 |
1.457 |
0.219 |
PCl |
phosphorus chloride |
rPCl |
2.018 |
2.227 |
0.210 |
SeCl2 |
Selenium Dichloride |
rClSe |
2.157 |
2.362 |
0.205 |
KrF2 |
Krypton difluoride |
rFKr |
1.875 |
2.077 |
0.202 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.899 |
0.202 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.899 |
0.202 |
SiCl |
Clorosilylidyne |
rSiCl |
2.061 |
2.263 |
0.202 |
LiK |
Lithium Potassium |
rLiK |
3.270 |
3.471 |
0.201 |
CaH |
Calcium monohydride |
rCaH |
2.003 |
2.203 |
0.200 |
CaH |
Calcium monohydride |
rCaH |
2.003 |
2.203 |
0.200 |
S3 |
Sulfur trimer |
rSS |
1.917 |
2.117 |
0.200 |
S3 |
Sulfur trimer |
rSS |
1.917 |
2.117 |
0.200 |
SO2F2 |
Sulfuryl fluoride |
rFS |
1.530 |
1.729 |
0.199 |
SCl |
sulfur monochloride |
rSCl |
1.975 |
2.174 |
0.199 |
SCl |
sulfur monochloride |
rSCl |
1.975 |
2.174 |
0.199 |
HSiCl |
Chlorosilylene |
rSiCl |
2.067 |
2.266 |
0.199 |
SSO |
Disulfur monoxide |
rSS |
1.884 |
2.082 |
0.198 |
SOF4 |
Sulfur tetrafluoride oxide |
rFS |
1.539 |
1.737 |
0.198 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.794 |
0.197 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.794 |
0.197 |
KCl |
Potassium Chloride |
rKCl |
2.667 |
2.863 |
0.196 |
S2 |
Sulfur diatomic |
rSS |
1.889 |
2.084 |
0.194 |
ClF5 |
chlorinepentafluoride |
rFCl |
1.650 |
1.843 |
0.193 |
CaC |
Calcium monocarbide |
rCCa |
2.302 |
2.492 |
0.190 |
S2+ |
sulfur diatomic cation |
rSS |
1.825 |
2.015 |
0.190 |
SO3 |
Sulfur trioxide |
rSO |
1.418 |
1.606 |
0.188 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.668 |
0.187 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.668 |
0.187 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.668 |
0.187 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.668 |
0.187 |
CH3OCl |
methyl hypochlorite |
rOCl |
1.674 |
1.859 |
0.185 |
S2N2 |
Disulfur dinitride |
rNS |
1.642 |
1.826 |
0.184 |
AlCl |
Aluminum monochloride |
rAlCl |
2.130 |
2.314 |
0.183 |
SF4 |
Sulfur tetrafluoride |
rSF |
1.545 |
1.727 |
0.182 |
SF4 |
Sulfur tetrafluoride |
rSF |
1.545 |
1.727 |
0.182 |
S4 |
Sulfur tetramer |
rSS |
1.898 |
2.079 |
0.181 |
S4 |
Sulfur tetramer |
rSS |
1.898 |
2.079 |
0.181 |
SO2F2 |
Sulfuryl fluoride |
rOS |
1.405 |
1.585 |
0.180 |
CFCl |
chlorofluoromethylene |
rCCl |
1.714 |
1.894 |
0.180 |
Si2H2 |
disilyne |
rSiH |
1.668 |
1.488 |
-0.180 |
FSN |
Thiazyl fluoride |
rFS |
1.643 |
1.823 |
0.180 |
ClOOCl |
Dichlorine dioxide |
rOCl |
1.704 |
1.883 |
0.179 |
As4 |
Arsenic tetramer |
rAsAs |
2.435 |
2.614 |
0.179 |
NCl |
nitrogen monochloride |
rNCl |
1.611 |
1.789 |
0.179 |
ClOF3 |
Chlorine trifluoride oxide |
rFCl |
1.713 |
1.892 |
0.179 |
SSO |
Disulfur monoxide |
rSO |
1.456 |
1.635 |
0.178 |
Se2 |
Selenium diatomic |
rSeSe |
2.166 |
2.344 |
0.178 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.873 |
0.177 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.873 |
0.177 |
SOF4 |
Sulfur tetrafluoride oxide |
rSO |
1.409 |
1.584 |
0.175 |
NCl3 |
nitrogen trichloride |
rNCl |
1.754 |
1.928 |
0.175 |
NCl3 |
nitrogen trichloride |
rNCl |
1.754 |
1.928 |
0.175 |
PBr3 |
Phosphorus tribromide |
rPBr |
2.220 |
2.395 |
0.175 |
B2 |
Boron diatomic |
rBB |
1.590 |
1.416 |
-0.174 |
BrF5 |
bromine pentafluoride |
rFBr |
1.689 |
1.862 |
0.173 |
SO2 |
Sulfur dioxide |
rSO |
1.432 |
1.605 |
0.172 |
F2SO |
Thionyl Fluoride |
rFS |
1.585 |
1.756 |
0.171 |
NCl |
nitrogen monochloride |
rNCl |
1.611 |
1.781 |
0.170 |
NCl |
nitrogen monochloride |
rNCl |
1.611 |
1.781 |
0.170 |
SiBr |
Silicon monobromide |
rSiBr |
2.209 |
2.379 |
0.170 |
SiH3Cl |
chlorosilane |
rSiCl |
2.051 |
2.220 |
0.170 |
CaBr2 |
Calcium dibromide |
rCaBr |
2.616 |
2.785 |
0.169 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.668 |
0.168 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.668 |
0.168 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.668 |
0.168 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.668 |
0.168 |
Si2H2 |
disilyne |
rSiSi |
2.215 |
2.049 |
-0.166 |
SF6 |
Sulfur Hexafluoride |
rSF |
1.561 |
1.726 |
0.166 |
SF6 |
Sulfur Hexafluoride |
rSF |
1.561 |
1.726 |
0.166 |
SiH2Cl2 |
dichlorosilane |
rSiCl |
2.033 |
2.198 |
0.165 |
SiH2Cl2 |
dichlorosilane |
rSiCl |
2.033 |
2.198 |
0.165 |
CrH |
Chromium hydride |
rHCr |
1.655 |
1.820 |
0.165 |
HOSH |
hydrogen thioperoxide |
rSO |
1.662 |
1.826 |
0.164 |
CHF2CHF2 |
1,1,2,2-tetrafluoroethane |
rCF |
1.359 |
1.523 |
0.164 |
SF5Cl |
sulfur chloropentafluoride |
rFS |
1.576 |
1.739 |
0.163 |
SiCl3CH3 |
methyltrichlorosilane |
rSiCl |
2.026 |
2.188 |
0.162 |
KBr |
Potassium Bromide |
rKBr |
2.821 |
2.981 |
0.160 |
HOCl |
hypochlorous acid |
rClO |
1.697 |
1.857 |
0.160 |
HCCl |
Chloromethylene |
rCCl |
1.696 |
1.854 |
0.158 |
ClF |
Chlorine monofluoride |
rFCl |
1.628 |
1.785 |
0.157 |
AsCl3 |
Arsenous trichloride |
rClAs |
2.166 |
2.321 |
0.155 |
SF2 |
sulfur difluoride |
rSF |
1.587 |
1.742 |
0.154 |
SF2 |
sulfur difluoride |
rSF |
1.587 |
1.742 |
0.154 |
GeCl |
Germanium monochloride |
rClGe |
2.164 |
2.317 |
0.154 |
KH |
Potassium hydride |
rKH |
2.243 |
2.396 |
0.153 |
KH |
Potassium hydride |
rKH |
2.243 |
2.396 |
0.153 |
CCl2 |
dichloromethylene |
rCCl |
1.711 |
1.864 |
0.153 |
F2SO |
Thionyl Fluoride |
rOS |
1.413 |
1.565 |
0.153 |
SOF4 |
Sulfur tetrafluoride oxide |
rFS |
1.596 |
1.748 |
0.152 |
SO+ |
sulfur monoxide cation |
rOS |
1.424 |
1.576 |
0.152 |
SO+ |
sulfur monoxide cation |
rOS |
1.424 |
1.576 |
0.152 |
PS |
phosphorus sulfide |
rPS |
1.900 |
2.050 |
0.150 |
SeS |
Selenium monosulfide |
rSSe |
2.037 |
2.187 |
0.150 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.247 |
0.149 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.247 |
0.149 |
PF+ |
phosphorus monofluoride cation |
rFP |
1.500 |
1.649 |
0.149 |
SFCl |
Sulfur chloride fluoride |
rFS |
1.606 |
1.753 |
0.147 |
NHCl2 |
dichloroamine |
rNCl |
1.760 |
1.907 |
0.147 |
P2+ |
phosphorus diatomic cation |
rPP |
1.986 |
2.133 |
0.147 |
CBr |
Carbon monobromide |
rCBr |
1.821 |
1.967 |
0.147 |
Si2H2 |
disilyne |
rSiH |
1.668 |
1.522 |
-0.146 |
HSiBr |
monobromosilylene |
rSiBr |
2.237 |
2.383 |
0.146 |
Si2 |
Silicon diatomic |
rSiSi |
2.246 |
2.390 |
0.144 |
CaF |
Calcium monofluoride |
rFCa |
1.967 |
2.111 |
0.144 |
BH3PH3 |
borane phosphine |
rBP |
1.937 |
2.080 |
0.143 |
PO- |
phosphorus monoxide anion |
rOP |
1.540 |
1.682 |
0.142 |
SiBr+ |
Silicon monobromide cation |
rSiBr |
2.095 |
2.238 |
0.142 |
Si2H2 |
disilyne |
rSiSi |
2.215 |
2.358 |
0.142 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.621 |
0.140 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.621 |
0.140 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.621 |
0.140 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.621 |
0.140 |
SF |
Monosulfur monofluoride |
rSF |
1.599 |
1.739 |
0.139 |
SOCl2 |
thionyl chloride |
rSO |
1.443 |
1.581 |
0.138 |
AlBr |
Aluminum monobromide |
rAlBr |
2.295 |
2.432 |
0.137 |
Se2 |
Selenium diatomic |
rSeSe |
2.166 |
2.303 |
0.137 |
Se2 |
Selenium diatomic |
rSeSe |
2.166 |
2.303 |
0.137 |
SiP |
Silicon monophosphide |
rSiP |
2.078 |
2.215 |
0.137 |
PO |
Phosphorus monoxide |
rPO |
1.476 |
1.611 |
0.136 |
NBr |
nitrogen monobromide |
rNBr |
1.765 |
1.900 |
0.135 |
PF2 |
Phosphorus difluoride |
rPF |
1.579 |
1.712 |
0.133 |
FSSF |
Difluorodisulfane |
rFS |
1.635 |
1.767 |
0.132 |
BrF3 |
Bromine trifluoride |
rFBr |
1.721 |
1.853 |
0.132 |
PF |
phosphorus monofluoride |
rFP |
1.593 |
1.725 |
0.132 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.351 |
0.131 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.351 |
0.131 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.351 |
0.131 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.351 |
0.131 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.351 |
0.131 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.351 |
0.131 |
C2Cl2 |
dichloroacetylene |
rCCl |
1.612 |
1.743 |
0.131 |
SF4 |
Sulfur tetrafluoride |
rSF |
1.646 |
1.776 |
0.130 |
SF4 |
Sulfur tetrafluoride |
rSF |
1.646 |
1.776 |
0.130 |
TiCl |
Titanium Monochloride |
rClTi |
2.265 |
2.394 |
0.130 |
CH2ClCCCl |
1,3-dichloropropyne |
rCCl |
1.779 |
1.908 |
0.129 |
PO2 |
Phosphorus dioxide |
rPO |
1.467 |
1.594 |
0.128 |
GaCl |
Gallium monochloride |
rClGa |
2.202 |
2.328 |
0.127 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.830 |
0.125 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.830 |
0.125 |
SiH3Br |
bromosilane |
rSiBr |
2.210 |
2.334 |
0.124 |
CaOH |
Calcium monohydroxide |
rOCa |
1.976 |
2.099 |
0.123 |
ClNO |
Nitrosyl chloride |
rNCl |
1.975 |
2.098 |
0.123 |
PO |
Phosphorus monoxide |
rPO |
1.476 |
1.598 |
0.122 |
HOBr |
Hypobromous acid |
rBrO |
1.834 |
1.956 |
0.122 |
HOBr |
Hypobromous acid |
rBrO |
1.834 |
1.956 |
0.122 |
C2H4S |
Thiirane |
rCS |
1.815 |
1.937 |
0.122 |
AlN |
Aluminum nitride |
rNAl |
1.786 |
1.908 |
0.122 |
AlN |
Aluminum nitride |
rNAl |
1.786 |
1.908 |
0.122 |
SeO |
Selenium monoxide |
rSeO |
1.639 |
1.761 |
0.121 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.621 |
0.121 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.621 |
0.121 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.621 |
0.121 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.621 |
0.121 |
CH3CHClCH3 |
Propane, 2-chloro- |
rCCl |
1.798 |
1.919 |
0.121 |
SiF+ |
silicon monofluoride cation |
rFSi |
1.527 |
1.647 |
0.120 |
SiF+ |
silicon monofluoride cation |
rFSi |
1.527 |
1.647 |
0.120 |
P2 |
Phosphorus diatomic |
rPP |
1.893 |
2.013 |
0.119 |
GeCl2 |
Germanium dichloride |
rClGe |
2.186 |
2.305 |
0.119 |
OPCl |
Phosphorus oxychloride |
rPO |
1.462 |
1.580 |
0.118 |
C6H5Cl |
chlorobenzene |
rCCl |
1.725 |
1.841 |
0.116 |
ClO |
Monochlorine monoxide |
rClO |
1.596 |
1.711 |
0.115 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.805 |
0.114 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.805 |
0.114 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.805 |
0.114 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.805 |
0.114 |
LiS |
Lithium monosulfide |
rLiS |
2.150 |
2.264 |
0.114 |
SiF3 |
Silicon trifluoride radical |
rFSi |
1.565 |
1.679 |
0.114 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.137 |
-0.113 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.137 |
-0.113 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.137 |
-0.113 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.137 |
-0.113 |
SiH3F |
monofluorosilane |
rSiF |
1.595 |
1.708 |
0.113 |
SiS |
silicon monosulfide |
rSiS |
1.929 |
2.042 |
0.113 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.803 |
0.112 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.803 |
0.112 |
CH2BrCl |
Methane, bromochloro- |
rCCl |
1.755 |
1.867 |
0.112 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.338 |
-0.112 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.338 |
-0.112 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.338 |
-0.112 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
2.338 |
-0.112 |
SiF |
silicon monofluoride |
rSiF |
1.604 |
1.716 |
0.112 |
BrF |
Bromine monofluoride |
rFBr |
1.759 |
1.870 |
0.112 |
BrF |
Bromine monofluoride |
rFBr |
1.759 |
1.870 |
0.112 |
SiH2F2 |
difluorosilane |
rSiF |
1.576 |
1.687 |
0.111 |
LiCl |
lithium chloride |
rLiCl |
2.021 |
2.132 |
0.111 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.830 |
0.111 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.830 |
0.111 |
CH2CClCHCH2 |
1,3-Butadiene, 2-chloro- |
rCCl |
1.742 |
1.853 |
0.111 |
CH2ClCHCHCH3 |
2-Butene, 1-chloro- |
rCCl |
1.807 |
1.916 |
0.109 |
SiF2 |
Silicon difluoride |
rFSi |
1.590 |
1.699 |
0.109 |
CH2ClCHCl2 |
1,1,2-trichloroethane |
rCCl |
1.776 |
1.885 |
0.109 |
HCCCl |
Chloroacetylene |
rCCl |
1.637 |
1.745 |
0.108 |
CHFClBr |
fluorochlorobromomethane |
rCCl |
1.745 |
1.853 |
0.108 |
C2H2ClF |
1-chloro-1-fluoroethylene |
rCCl |
1.704 |
1.812 |
0.108 |
C4H6S |
Thiophene, 2,5-dihydro- |
rCS |
1.816 |
1.924 |
0.108 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.152 |
-0.108 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.152 |
-0.108 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.152 |
-0.108 |
BrF5 |
bromine pentafluoride |
rFBr |
1.774 |
1.882 |
0.108 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.904 |
0.108 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.904 |
0.108 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.904 |
0.108 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.904 |
0.108 |
C3H5Cl |
1-chloro-1-propene(E) |
rCCl |
1.728 |
1.836 |
0.108 |
CH2ClCHO |
chloroacetaldehyde |
rCCl |
1.782 |
1.889 |
0.107 |
C6H4Cl2 |
1,4-dichlorobenzene |
rCCl |
1.729 |
1.836 |
0.107 |
CBrClF2 |
Methane, bromochlorodifluoro- |
rCCl |
1.736 |
1.843 |
0.107 |
CH2ClCCCl |
1,3-dichloropropyne |
rCCl |
1.638 |
1.745 |
0.107 |
CH2FCl |
fluorochloromethane |
rCCl |
1.762 |
1.869 |
0.107 |
F2+ |
flourine diatomic cation |
rFF |
1.322 |
1.427 |
0.105 |
F2+ |
flourine diatomic cation |
rFF |
1.322 |
1.427 |
0.105 |
SiHF3 |
trifluorosilane |
rSiF |
1.563 |
1.668 |
0.105 |
C3H5Cl |
1-chloro-1-propene(Z) |
rCCl |
1.735 |
1.839 |
0.104 |
SiBr4 |
Silicon tetrabromide |
rSiBr |
2.183 |
2.287 |
0.104 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.900 |
0.104 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.900 |
0.104 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.900 |
0.104 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
rCCl |
1.796 |
1.900 |
0.104 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.137 |
-0.103 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.137 |
-0.103 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.137 |
-0.103 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.137 |
-0.103 |
ClCOClCO |
Oxalyl chloride |
rCCl |
1.744 |
1.847 |
0.103 |
CHF2Cl |
difluorochloromethane |
rCCl |
1.747 |
1.849 |
0.102 |
CH3Cl |
Methyl chloride |
rCCl |
1.785 |
1.887 |
0.102 |
BrO |
Bromine monoxide |
rOBr |
1.718 |
1.818 |
0.101 |
C6H4Cl2 |
1,3-dichlorobenzene |
rCCl |
1.736 |
1.836 |
0.100 |
BrF3 |
Bromine trifluoride |
rFBr |
1.810 |
1.910 |
0.100 |
HNCS |
Isothiocyanic acid |
rCS |
1.567 |
1.666 |
0.099 |
CH3CCl2CH3 |
Propane, 2,2-dichloro- |
rCCl |
1.799 |
1.898 |
0.099 |
CH3CH2SH |
ethanethiol |
rCS |
1.820 |
1.919 |
0.099 |
CH2O2 |
Dioxirane |
rOO |
1.516 |
1.614 |
0.098 |
CH2ClCH2Cl |
Ethane, 1,2-dichloro- |
rCCl |
1.790 |
1.888 |
0.098 |
CH2ClCH2Cl |
Ethane, 1,2-dichloro- |
rCCl |
1.790 |
1.888 |
0.098 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.338 |
0.098 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.338 |
0.098 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.338 |
0.098 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
2.338 |
0.098 |
KF |
Potassium Fluoride |
rKF |
2.171 |
2.269 |
0.098 |
Na2 |
Sodium diatomic |
rNaNa |
3.079 |
3.176 |
0.097 |
CH2Cl2 |
Methylene chloride |
rCCl |
1.767 |
1.864 |
0.097 |
Na2 |
Sodium diatomic |
rNaNa |
3.079 |
3.176 |
0.097 |
ZnS |
Zinc sulfide |
rSZn |
2.046 |
2.143 |
0.097 |
NaS |
Sodium sulfide |
rNaS |
2.489 |
2.585 |
0.097 |
CH3SCH3 |
Dimethyl sulfide |
rCS |
1.802 |
1.899 |
0.097 |
CF3OF |
Trifluoromethylhypofluorite |
rOF |
1.421 |
1.517 |
0.096 |
CF3OF |
Trifluoromethylhypofluorite |
rOF |
1.421 |
1.517 |
0.096 |
CBrCl3 |
Methane, bromotrichloro- |
rCCl |
1.765 |
1.861 |
0.096 |
CH3CH2SH |
ethanethiol |
rCS |
1.820 |
1.916 |
0.096 |
C2 |
Carbon diatomic |
rCC |
1.243 |
1.338 |
0.096 |
C2 |
Carbon diatomic |
rCC |
1.243 |
1.338 |
0.096 |
C2H6O2S |
Dimethyl sulfone |
rCS |
1.777 |
1.873 |
0.096 |
CF2Cl2 |
difluorodichloromethane |
rCCl |
1.744 |
1.839 |
0.095 |
F2 |
Fluorine diatomic |
rFF |
1.412 |
1.507 |
0.095 |
CH3SSCH3 |
Disulfide, dimethyl |
rCS |
1.810 |
1.905 |
0.095 |
CF2CCl2 |
difluorodichloroethylene |
rCCl |
1.706 |
1.800 |
0.094 |
C3H6S3 |
1,3,5-Trithiane |
rCS |
1.801 |
1.895 |
0.094 |
HNCS |
Isothiocyanic acid |
rCS |
1.567 |
1.660 |
0.094 |
SeF4 |
Selenium tetrafluoride |
rFSe |
1.682 |
1.775 |
0.093 |
BeCl2 |
Beryllium chloride |
rBeCl |
1.750 |
1.843 |
0.093 |
BC |
boron monocarbide |
rBC |
1.491 |
1.399 |
-0.092 |
SiC2 |
Silicon dicarbide |
rCSi |
1.836 |
1.928 |
0.092 |
Si2H2 |
disilyne |
rSiH |
1.668 |
1.759 |
0.091 |
BrNO |
Nitrosyl bromide |
rNBr |
2.140 |
2.231 |
0.091 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.351 |
0.091 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.351 |
0.091 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.351 |
0.091 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.351 |
0.091 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.351 |
0.091 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.351 |
0.091 |
H2O3 |
Hydrogen trioxide |
rOO |
1.428 |
1.519 |
0.091 |
CH2ClCHO |
chloroacetaldehyde |
rCCl |
1.782 |
1.872 |
0.090 |
CH2ClCHCHCH3 |
2-Butene, 1-chloro- |
rCCl |
1.807 |
1.897 |
0.090 |
BC |
boron monocarbide |
rBC |
1.491 |
1.581 |
0.090 |
HCCl |
Chloromethylene |
rCCl |
1.696 |
1.786 |
0.090 |
NF3 |
Nitrogen trifluoride |
rNF |
1.365 |
1.454 |
0.089 |
CH3SH |
Methanethiol |
rCS |
1.818 |
1.907 |
0.089 |
Li2 |
Lithium diatomic |
rLiLi |
2.673 |
2.762 |
0.089 |
NaCl |
Sodium Chloride |
rNaCl |
2.361 |
2.450 |
0.089 |
AlC |
Aluminum carbide |
rCAl |
1.955 |
2.044 |
0.089 |
CH3OCl |
methyl hypochlorite |
rCO |
1.389 |
1.477 |
0.088 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.338 |
0.088 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.338 |
0.088 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.338 |
0.088 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
2.338 |
0.088 |
CH2BrF |
Methane, bromofluoro- |
rCBr |
1.915 |
2.003 |
0.088 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.370 |
1.458 |
0.088 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.370 |
1.458 |
0.088 |
AlH+ |
aluminum monohydride cation |
rAlH |
1.602 |
1.689 |
0.087 |
GaAs |
Gallium arsenide |
rGaAs |
2.530 |
2.617 |
0.087 |
N2 |
Nitrogen diatomic |
rNN |
1.213 |
1.126 |
-0.087 |
N2 |
Nitrogen diatomic |
rNN |
1.213 |
1.126 |
-0.087 |
N2 |
Nitrogen diatomic |
rNN |
1.213 |
1.126 |
-0.087 |
N2 |
Nitrogen diatomic |
rNN |
1.213 |
1.126 |
-0.087 |
Si2 |
Silicon diatomic |
rSiSi |
2.246 |
2.160 |
-0.086 |
BBr |
Boron monobromide |
rBBr |
1.888 |
1.974 |
0.086 |
LiCl- |
lithium chloride anion |
rLiCl |
2.180 |
2.265 |
0.085 |
NS+ |
nitrogen sulfide cation |
rNS |
1.440 |
1.525 |
0.085 |
FCO |
Carbonyl fluoride |
rCF |
1.326 |
1.410 |
0.084 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.789 |
0.084 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.789 |
0.084 |
NaK |
Sodium Potassium |
rNaK |
3.589 |
3.673 |
0.084 |
MgCl2 |
Magnesium dichloride |
rMgCl |
2.180 |
2.264 |
0.084 |
GaBr |
Gallium monobromide |
rGaBr |
2.352 |
2.436 |
0.084 |
TiH |
Titanium monohydride |
rHTi |
1.785 |
1.868 |
0.084 |
SiC |
silicon monocarbide |
rCSi |
1.722 |
1.805 |
0.083 |
SiC |
silicon monocarbide |
rCSi |
1.722 |
1.805 |
0.083 |
C2H2+ |
acetylene cation |
rCC |
1.253 |
1.335 |
0.083 |
CO |
Carbon monoxide |
rCO |
1.128 |
1.211 |
0.082 |
C4H8O2 |
Ethyl acetate |
rCO |
1.448 |
1.530 |
0.082 |
FSN |
Thiazyl fluoride |
rNS |
1.448 |
1.530 |
0.082 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.370 |
1.452 |
0.082 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.370 |
1.452 |
0.082 |
CF |
Fluoromethylidyne |
rCF |
1.276 |
1.358 |
0.082 |
SiO |
Silicon monoxide |
rSiO |
1.510 |
1.591 |
0.082 |
CH3SSH |
Hydrogen methyl disulfide |
rCS |
1.823 |
1.905 |
0.082 |
CH3Br |
methyl bromide |
rCBr |
1.934 |
2.015 |
0.081 |
CH3Br |
methyl bromide |
rCBr |
1.934 |
2.015 |
0.081 |
C2H4O |
Ethylene oxide |
rCO |
1.425 |
1.506 |
0.081 |
He2+ |
helium diatomic cation |
rHeHe |
1.081 |
1.162 |
0.081 |
He2+ |
helium diatomic cation |
rHeHe |
1.081 |
1.162 |
0.081 |
CF2 |
Difluoromethylene |
rCF |
1.297 |
1.378 |
0.081 |
PN |
Phosphorus mononitride |
rPN |
1.491 |
1.571 |
0.080 |
C2H2N2O |
Furazan |
rNO |
1.373 |
1.453 |
0.080 |
HCF |
Fluoromethylene |
rCF |
1.305 |
1.385 |
0.080 |
HCF |
Fluoromethylene |
rCF |
1.305 |
1.385 |
0.080 |
H2O2 |
Hydrogen peroxide |
rOO |
1.475 |
1.554 |
0.079 |
GeS |
Germanium monosulfide |
rSGe |
2.012 |
2.091 |
0.079 |
H2O2 |
Hydrogen peroxide |
rOO |
1.475 |
1.553 |
0.078 |
H2O2 |
Hydrogen peroxide |
rOO |
1.475 |
1.553 |
0.078 |
NaLi |
lithium sodium |
rLiNa |
2.889 |
2.967 |
0.078 |
NaLi |
lithium sodium |
rLiNa |
2.889 |
2.967 |
0.078 |
SeO2 |
Selenium dioxide |
rSeO |
1.607 |
1.685 |
0.078 |
SeO2 |
Selenium dioxide |
rSeO |
1.607 |
1.685 |
0.078 |
CF3Cl |
Methane, chlorotrifluoro- |
rCCl |
1.752 |
1.830 |
0.078 |
O2- |
oxygen diatomic anion |
rOO |
1.350 |
1.427 |
0.077 |
O2- |
oxygen diatomic anion |
rOO |
1.350 |
1.427 |
0.077 |
HOF |
Hypofluorous acid |
rFO |
1.442 |
1.519 |
0.077 |
CHSNH2 |
thioformamide |
rCS |
1.626 |
1.702 |
0.076 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.382 |
1.458 |
0.076 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.382 |
1.458 |
0.076 |
Si2H6 |
disilane |
rSiSi |
2.320 |
2.395 |
0.075 |
Li2+ |
lithium diatomic cation |
rLiLi |
3.112 |
3.187 |
0.075 |
SiSe |
Silicon Monoselenide |
rSiSe |
2.058 |
2.133 |
0.075 |
GeF+ |
Germanium monofluoride cation |
rFGe |
1.665 |
1.740 |
0.075 |
CH3CHNOH |
Acetaldoxime |
rNO |
1.408 |
1.483 |
0.075 |
CF2 |
Difluoromethylene |
rCF |
1.297 |
1.372 |
0.075 |
CH3CHNOH |
Acetaldoxime |
rNO |
1.408 |
1.483 |
0.075 |
CF2 |
Difluoromethylene |
rCF |
1.297 |
1.372 |
0.075 |
BF |
Boron monofluoride |
rBF |
1.267 |
1.341 |
0.074 |
O2 |
Oxygen diatomic |
rOO |
1.208 |
1.282 |
0.074 |
AlF |
Aluminum monofluoride |
rAlF |
1.654 |
1.728 |
0.074 |
C2H3Br |
vinyl bromide |
rCBr |
1.884 |
1.958 |
0.074 |
C2H5Br |
Ethyl bromide |
rCBr |
1.950 |
2.024 |
0.074 |
C2H5Br |
Ethyl bromide |
rCBr |
1.950 |
2.024 |
0.074 |
CH2CS |
Thioketene |
rCS |
1.554 |
1.626 |
0.072 |
LiH |
Lithium Hydride |
rLiH |
1.595 |
1.667 |
0.072 |
OCS |
Carbonyl sulfide |
rCS |
1.560 |
1.632 |
0.072 |
AsF5 |
Arsenic pentafluoride |
rAsF |
1.656 |
1.728 |
0.072 |
GaO |
Gallium monoxide |
rOGa |
1.743 |
1.814 |
0.071 |
FCN |
Cyanogen fluoride |
rCF |
1.262 |
1.333 |
0.071 |
CH2NOH |
formaldoxime |
rNO |
1.408 |
1.479 |
0.071 |
C3F8 |
perfluoropropane |
rCF |
1.330 |
1.401 |
0.071 |
NHF2 |
difluoramine |
rNF |
1.400 |
1.471 |
0.071 |
NSe |
Nitrogen monoselenide |
rNSe |
1.652 |
1.722 |
0.070 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.789 |
0.070 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.789 |
0.070 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.382 |
1.452 |
0.070 |
CH2CHCH2F |
Allyl Fluoride |
rCF |
1.382 |
1.452 |
0.070 |
CH2Br2 |
dibromomethane |
rCBr |
1.925 |
1.995 |
0.070 |
CH2Br2 |
dibromomethane |
rCBr |
1.925 |
1.995 |
0.070 |
VO |
Vanadium monoxide |
rVO |
1.589 |
1.520 |
-0.070 |
SiH2(CH3)2 |
dimethylsilane |
rSiC |
1.868 |
1.938 |
0.070 |
CH3CSNH2 |
Ethanethioamide |
rCS |
1.647 |
1.716 |
0.069 |
HCCBr |
bromoacetylene |
rCBr |
1.792 |
1.861 |
0.069 |
NF |
nitrogen fluoride |
rNF |
1.317 |
1.386 |
0.069 |
CH2O2 |
Dioxirane |
rCO |
1.388 |
1.456 |
0.069 |
COBr2 |
Carbonic dibromide |
rCBr |
1.917 |
1.985 |
0.069 |
C4H4Se |
selenophene |
rCSe |
1.855 |
1.923 |
0.069 |
MgH+ |
magnesium monohydride cation |
rMgH |
1.652 |
1.720 |
0.068 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.152 |
-0.068 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.152 |
-0.068 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.152 |
-0.068 |
C3H8O2 |
1,3-Propanediol |
rCO |
1.410 |
1.478 |
0.068 |
HFCO |
formyl fluoride |
rCF |
1.338 |
1.406 |
0.068 |
CH3CH2O |
Ethoxy radical |
rCO |
1.388 |
1.455 |
0.067 |
C2H5NO3 |
Nitric acid, ethyl ester |
rCO |
1.430 |
1.497 |
0.067 |
HCCF |
Fluoroacetylene |
rCF |
1.279 |
1.346 |
0.067 |
HCCF |
Fluoroacetylene |
rCF |
1.279 |
1.346 |
0.067 |
SeO |
Selenium monoxide |
rSeO |
1.639 |
1.706 |
0.067 |
SeO |
Selenium monoxide |
rSeO |
1.639 |
1.706 |
0.067 |
GeF |
Germanium monofluoride |
rFGe |
1.745 |
1.811 |
0.066 |
GeF |
Germanium monofluoride |
rFGe |
1.745 |
1.811 |
0.066 |
GeH3F |
monofluorogermane |
rGeF |
1.731 |
1.797 |
0.066 |
C2H2F2 |
Ethene, 1,2-difluoro-, (Z)- |
rCF |
1.335 |
1.401 |
0.066 |
CH3CHS |
Thioacetaldehyde |
rCS |
1.610 |
1.676 |
0.066 |
CuCl |
Copper monochloride |
rCuCl |
2.051 |
2.117 |
0.066 |
NeH+ |
neon hydrogen cation |
rNeH |
0.991 |
1.057 |
0.066 |
SiH |
Silylidyne |
rSiH |
1.520 |
1.586 |
0.066 |
SiH |
Silylidyne |
rSiH |
1.520 |
1.586 |
0.066 |
C5H6 |
Propellane |
rCC |
1.596 |
1.662 |
0.066 |
CH2BrCl |
Methane, bromochloro- |
rCBr |
1.928 |
1.994 |
0.066 |
CHBr3 |
bromoform |
rCBr |
1.924 |
1.990 |
0.066 |
CF2O |
Carbonic difluoride |
rCF |
1.312 |
1.377 |
0.065 |
CH2CHF |
Ethene, fluoro- |
rCF |
1.347 |
1.412 |
0.065 |
CH3CH2SH |
ethanethiol |
rSH |
1.322 |
1.387 |
0.065 |
CH3CH2SH |
ethanethiol |
rSH |
1.322 |
1.387 |
0.065 |
CH2F2 |
Methane, difluoro- |
rCF |
1.351 |
1.415 |
0.065 |
CH3F |
Methyl fluoride |
rCF |
1.383 |
1.448 |
0.065 |
B2 |
Boron diatomic |
rBB |
1.590 |
1.654 |
0.064 |
CHF2CHF2 |
1,1,2,2-tetrafluoroethane |
rCF |
1.348 |
1.412 |
0.064 |
CHF2CHF2 |
1,1,2,2-tetrafluoroethane |
rCF |
1.348 |
1.412 |
0.064 |
GaAs |
Gallium arsenide |
rGaAs |
2.530 |
2.594 |
0.064 |
CH3CH2SH |
ethanethiol |
rSH |
1.322 |
1.386 |
0.064 |
CH3CH2SH |
ethanethiol |
rSH |
1.322 |
1.386 |
0.064 |
Si(CH3)4 |
tetramethylsilane |
rSiC |
1.875 |
1.939 |
0.064 |
KOH |
Potassium hydroxide |
rOK |
2.212 |
2.275 |
0.064 |
CS |
carbon monosulfide |
rCS |
1.535 |
1.598 |
0.064 |
BrCN |
Cyanogen bromide |
rCBr |
1.789 |
1.852 |
0.063 |
BrCN |
Cyanogen bromide |
rCBr |
1.789 |
1.852 |
0.063 |
MgH |
magnesium monohydride |
rMgH |
1.730 |
1.793 |
0.063 |
AsF |
Arsenic monofluoride |
rFAs |
1.736 |
1.799 |
0.063 |
AsF |
Arsenic monofluoride |
rFAs |
1.736 |
1.799 |
0.063 |
HS- |
mercapto anion |
rSH |
1.343 |
1.406 |
0.063 |
HS- |
mercapto anion |
rSH |
1.343 |
1.406 |
0.063 |
C2H2F2 |
Ethene, 1,2-difluoro-, (E)- |
rCF |
1.344 |
1.406 |
0.062 |
GeF4 |
Germanium tetrafluoride |
rFGe |
1.670 |
1.732 |
0.062 |
CHF3 |
Methane, trifluoro- |
rCF |
1.328 |
1.390 |
0.062 |
KOH |
Potassium hydroxide |
rOH |
0.912 |
0.974 |
0.062 |
H2CS |
Thioformaldehyde |
rCS |
1.611 |
1.673 |
0.062 |
SiH+ |
silicon monohydride cation |
rSiH |
1.504 |
1.566 |
0.062 |
SiH+ |
silicon monohydride cation |
rSiH |
1.504 |
1.566 |
0.062 |
LiBr |
Lithium Bromide |
rLiBr |
2.170 |
2.232 |
0.062 |
LiBr |
Lithium Bromide |
rLiBr |
2.170 |
2.232 |
0.062 |
PH |
phosphorus monohydride |
rPH |
1.418 |
1.480 |
0.062 |
BClF2 |
Chlorodifluoroborane |
rBCl |
1.728 |
1.790 |
0.062 |
AsF |
Arsenic monofluoride |
rFAs |
1.736 |
1.797 |
0.061 |
As2 |
Arsenic diatomic |
rAsAs |
2.103 |
2.164 |
0.061 |
HCNO |
fulminic acid |
rNO |
1.199 |
1.260 |
0.061 |
HCNO |
fulminic acid |
rNO |
1.199 |
1.260 |
0.061 |
HCNO |
fulminic acid |
rNO |
1.199 |
1.260 |
0.061 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.451 |
0.061 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.451 |
0.061 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.451 |
0.061 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.451 |
0.061 |
CH3CHF2 |
Ethane, 1,1-difluoro- |
rCF |
1.364 |
1.424 |
0.060 |
NaH |
sodium hydride |
rNaH |
1.887 |
1.947 |
0.060 |
NH2F |
monofluoroamine |
rNF |
1.433 |
1.493 |
0.060 |
Si2H2 |
disilyne |
rSiSi |
2.215 |
2.155 |
-0.060 |
CH2ClCHCl2 |
1,1,2-trichloroethane |
rCC |
1.580 |
1.520 |
-0.060 |
HO2 |
Hydroperoxy radical |
rOO |
1.331 |
1.390 |
0.060 |
PH |
phosphorus monohydride |
rPH |
1.420 |
1.480 |
0.060 |
CH3SeCH3 |
dimethylselenide |
rCSe |
1.943 |
2.003 |
0.060 |
CF2CCl2 |
difluorodichloroethylene |
rCF |
1.315 |
1.374 |
0.059 |
F2CCCF2 |
tetrafluoroallene |
rCF |
1.320 |
1.379 |
0.059 |
PH |
phosphorus monohydride |
rPH |
1.418 |
1.477 |
0.059 |
BH3NH3 |
borane ammonia |
rBN |
1.645 |
1.705 |
0.059 |
CF3COOH |
trifluoroacetic acid |
rCF |
1.325 |
1.384 |
0.059 |
AlNC |
Aluminum isocyanide |
rAlN |
1.855 |
1.914 |
0.059 |
NH2SH |
Thiohydroxylamine |
rSH |
1.344 |
1.403 |
0.059 |
NH2SH |
Thiohydroxylamine |
rSH |
1.344 |
1.403 |
0.059 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.448 |
0.058 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.448 |
0.058 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.448 |
0.058 |
C2H4F2 |
1,2-difluoroethane |
rCF |
1.390 |
1.448 |
0.058 |
SiH2 |
silicon dihydride |
rSiH |
1.514 |
1.573 |
0.058 |
BH3NH3 |
borane ammonia |
rBN |
1.645 |
1.703 |
0.058 |
C2HF3 |
Trifluoroethylene |
rCF |
1.316 |
1.374 |
0.058 |
CF3OF |
Trifluoromethylhypofluorite |
rCF |
1.319 |
1.377 |
0.058 |
CF3OF |
Trifluoromethylhypofluorite |
rCF |
1.319 |
1.377 |
0.058 |
C4H8O2 |
1,3-Dioxane |
rCO |
1.393 |
1.451 |
0.058 |
C2H5F |
fluoroethane |
rCF |
1.398 |
1.456 |
0.058 |
CH3OC2H5 |
Ethane, methoxy- |
rCO |
1.407 |
1.465 |
0.058 |
PH |
phosphorus monohydride |
rPH |
1.422 |
1.480 |
0.057 |
PH |
phosphorus monohydride |
rPH |
1.420 |
1.477 |
0.057 |
C2HF3 |
Trifluoroethylene |
rCF |
1.342 |
1.399 |
0.057 |
CF3Br |
Bromotrifluoromethane |
rCF |
1.327 |
1.383 |
0.057 |
CF3Br |
Bromotrifluoromethane |
rCF |
1.327 |
1.383 |
0.057 |
CH3SH |
Methanethiol |
rSH |
1.329 |
1.386 |
0.057 |
CH2FCH2CH3 |
1-Fluoropropane |
rCF |
1.401 |
1.458 |
0.057 |
HNO2 |
Nitrous acid |
rNO |
1.442 |
1.498 |
0.056 |
HN3 |
hydrogen azide |
rNH |
0.975 |
1.031 |
0.056 |
HN3 |
hydrogen azide |
rNH |
0.975 |
1.031 |
0.056 |
O2 |
Oxygen diatomic |
rOO |
1.208 |
1.264 |
0.056 |
C6H5F |
Fluorobenzene |
rCF |
1.354 |
1.410 |
0.056 |
GeF2 |
Germanium difluoride |
rGeCl |
1.732 |
1.788 |
0.056 |
CF3Cl |
Methane, chlorotrifluoro- |
rCF |
1.325 |
1.380 |
0.055 |
CHFClBr |
fluorochlorobromomethane |
rCBr |
1.928 |
1.983 |
0.055 |
PH |
phosphorus monohydride |
rPH |
1.422 |
1.477 |
0.055 |
CS2 |
Carbon disulfide |
rCS |
1.554 |
1.609 |
0.055 |
B2Cl4 |
Diboron tetrachloride |
rBCl |
1.750 |
1.805 |
0.055 |
CH2PH |
Phosphaethene |
rCP |
1.673 |
1.728 |
0.055 |
CH2PH |
Phosphaethene |
rCP |
1.673 |
1.728 |
0.055 |
NO- |
nitric oxide anion |
rNO |
1.258 |
1.313 |
0.055 |
SiCl3CH3 |
methyltrichlorosilane |
rCSi |
1.848 |
1.902 |
0.054 |
B4H10 |
Tetraborane(10) |
rHB |
1.315 |
1.261 |
-0.054 |
NO- |
nitric oxide anion |
rNO |
1.258 |
1.312 |
0.054 |
NO- |
nitric oxide anion |
rNO |
1.258 |
1.312 |
0.054 |
CH2N2 |
diazirine |
rCN |
1.482 |
1.536 |
0.054 |
BrO+ |
Bromine monoxide cation |
rOBr |
1.635 |
1.689 |
0.054 |
HSiBr |
monobromosilylene |
rSiH |
1.518 |
1.572 |
0.054 |
ScF |
Scandium monofluoride |
rFSc |
1.788 |
1.842 |
0.054 |
SCSe |
Carbon sulfide selenide |
rCS |
1.553 |
1.607 |
0.054 |
CBr4 |
Carbon tetrabromide |
rCBr |
1.942 |
1.996 |
0.054 |
CBr4 |
Carbon tetrabromide |
rCBr |
1.942 |
1.996 |
0.054 |
CHFClBr |
fluorochlorobromomethane |
rCF |
1.356 |
1.409 |
0.054 |
HCS+ |
Thioformyl cation |
rCS |
1.478 |
1.532 |
0.054 |
BCl3 |
Borane, trichloro- |
rBCl |
1.742 |
1.796 |
0.053 |
FNO |
Nitrosyl fluoride |
rNF |
1.512 |
1.565 |
0.053 |
AlF3 |
Aluminum trifluoride |
rAlF |
1.630 |
1.683 |
0.053 |
CH2FCH2CH3 |
1-Fluoropropane |
rCF |
1.401 |
1.454 |
0.053 |
N2O |
Nitrous oxide |
rNO |
1.184 |
1.237 |
0.053 |
AsF3 |
Arsenic trifluoride |
rAsF |
1.706 |
1.759 |
0.053 |
CHF2CHF2 |
1,1,2,2-tetrafluoroethane |
rCF |
1.359 |
1.412 |
0.053 |
CHF2CHF2 |
1,1,2,2-tetrafluoroethane |
rCF |
1.359 |
1.412 |
0.053 |
CHF2CHF2 |
1,1,2,2-tetrafluoroethane |
rCF |
1.359 |
1.412 |
0.053 |
HS |
Mercapto radical |
rSH |
1.341 |
1.394 |
0.053 |
SeF4 |
Selenium tetrafluoride |
rFSe |
1.771 |
1.824 |
0.053 |
C5H8 |
Bicyclo[2.1.0]pentane |
rCC |
1.507 |
1.560 |
0.053 |
C3H2O3 |
vinylene carbonate |
rCO |
1.364 |
1.416 |
0.052 |
BF3 |
Borane, trifluoro- |
rBF |
1.307 |
1.359 |
0.052 |
C2H2ClF |
1-chloro-1-fluoroethylene |
rCF |
1.341 |
1.393 |
0.052 |
NH2SH |
Thiohydroxylamine |
rHS |
1.351 |
1.403 |
0.052 |
NH2SH |
Thiohydroxylamine |
rHS |
1.351 |
1.403 |
0.052 |
CH3SeH |
Methane selenol |
rCSe |
1.959 |
2.010 |
0.051 |
ClOOCl |
Dichlorine dioxide |
rOO |
1.426 |
1.477 |
0.051 |
CBrClF2 |
Methane, bromochlorodifluoro- |
rCF |
1.340 |
1.391 |
0.051 |
FNO2 |
Nitryl fluoride |
rNF |
1.467 |
1.518 |
0.051 |
CH3CH2SH |
ethanethiol |
rSH |
1.336 |
1.387 |
0.051 |
CH3CH2SH |
ethanethiol |
rSH |
1.336 |
1.387 |
0.051 |
CuF |
Copper monofluoride |
rCuF |
1.745 |
1.694 |
-0.050 |
AsN |
Arsenic mononitride |
rNAs |
1.618 |
1.668 |
0.050 |
HCl |
Hydrogen chloride |
rHCl |
1.275 |
1.325 |
0.050 |
636 molecules.