Species |
Name |
Bond type |
Bond Length (Å) |
Experimental |
Calculated |
Difference |
XeF2 |
Xenon difluoride |
rFXe |
1.974 |
13.357 |
11.383 |
XeF4 |
Xenon tetrafluoride |
rFXe |
1.935 |
12.172 |
10.237 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.085 |
4.264 |
3.179 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.087 |
3.485 |
2.398 |
S4 |
Sulfur tetramer |
rSS |
2.155 |
2.965 |
0.810 |
C4H6 |
1-Methylcyclopropene |
rCC |
1.476 |
2.278 |
0.802 |
CH3SO2NH2 |
methanesulfonamide |
rCN |
1.207 |
1.994 |
0.787 |
HSSSH |
trisulfane |
rHS |
1.344 |
2.105 |
0.761 |
HSSSH |
trisulfane |
rHS |
1.344 |
2.105 |
0.761 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.087 |
1.836 |
0.749 |
CH3CH2SH |
ethanethiol |
rCH |
1.095 |
1.831 |
0.736 |
CH3CH2SH |
ethanethiol |
rCH |
1.095 |
1.827 |
0.732 |
Na2 |
Sodium diatomic |
rNaNa |
3.079 |
2.375 |
-0.704 |
Na2 |
Sodium diatomic |
rNaNa |
3.079 |
2.375 |
-0.704 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.098 |
1.791 |
0.693 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.098 |
1.782 |
0.684 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.831 |
-0.619 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.831 |
-0.619 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.831 |
-0.619 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.831 |
-0.619 |
C2H4F2 |
1,2-difluoroethane |
rCH |
1.093 |
1.588 |
0.495 |
C2H4F2 |
1,2-difluoroethane |
rCH |
1.093 |
1.585 |
0.492 |
S4 |
Sulfur tetramer |
rSS |
2.155 |
2.638 |
0.483 |
S4 |
Sulfur tetramer |
rSS |
2.155 |
2.638 |
0.483 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
1.921 |
-0.479 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
1.921 |
-0.479 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
1.921 |
-0.479 |
CH3CH2SH |
ethanethiol |
rCH |
1.089 |
1.558 |
0.469 |
GaAs |
Gallium arsenide |
rGaAs |
2.530 |
2.061 |
-0.469 |
GaAs |
Gallium arsenide |
rGaAs |
2.530 |
2.061 |
-0.469 |
CH3CH2SH |
ethanethiol |
rCH |
1.092 |
1.558 |
0.466 |
CH3CH2SH |
ethanethiol |
rCH |
1.089 |
1.555 |
0.466 |
CH3CH2SH |
ethanethiol |
rCH |
1.092 |
1.555 |
0.463 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.989 |
-0.461 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.989 |
-0.461 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.989 |
-0.461 |
GaP |
Gallium monophosphide |
rPGa |
2.450 |
1.989 |
-0.461 |
C4H6 |
1-Methylcyclopropene |
rCH |
1.070 |
1.524 |
0.454 |
NaLi |
lithium sodium |
rLiNa |
2.889 |
2.449 |
-0.440 |
GaAs |
Gallium arsenide |
rGaAs |
2.530 |
2.093 |
-0.437 |
GaAs |
Gallium arsenide |
rGaAs |
2.530 |
2.093 |
-0.437 |
ONNO |
NO dimer |
rNN |
2.236 |
1.800 |
-0.436 |
C4H10O |
Methyl propyl ether |
rCC |
1.530 |
1.100 |
-0.430 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.831 |
-0.419 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.831 |
-0.419 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.831 |
-0.419 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.831 |
-0.419 |
CH2CHCH2F |
Allyl Fluoride |
rHC |
1.130 |
1.549 |
0.419 |
CH2CHCH2F |
Allyl Fluoride |
rHC |
1.130 |
1.548 |
0.418 |
ClOF3 |
Chlorine trifluoride oxide |
rFCl |
1.603 |
2.020 |
0.417 |
C4H6 |
1-Methylcyclopropene |
rCC |
1.515 |
1.102 |
-0.413 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.831 |
-0.409 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.831 |
-0.409 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.831 |
-0.409 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.831 |
-0.409 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.974 |
0.377 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.974 |
0.377 |
NH3BF3 |
Amminetrifluoroboron |
rBN |
1.673 |
2.044 |
0.371 |
C4H10O |
Methyl propyl ether |
rCH |
1.099 |
1.463 |
0.364 |
C3H3NO |
Isoxazole |
rCH |
1.075 |
1.438 |
0.363 |
Si2H2 |
disilyne |
rSiSi |
2.215 |
1.871 |
-0.345 |
ClOF3 |
Chlorine trifluoride oxide |
rOCl |
1.405 |
1.749 |
0.344 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
1.921 |
-0.339 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
1.921 |
-0.339 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
1.921 |
-0.339 |
GaF |
Gallium monofluoride |
rFGa |
1.774 |
1.437 |
-0.337 |
OClO |
Chlorine dioxide |
rClO |
1.470 |
1.796 |
0.326 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.081 |
-0.319 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.081 |
-0.319 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.081 |
-0.319 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.081 |
-0.319 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.081 |
-0.319 |
AlP |
Aluminum monophosphide |
rAlP |
2.400 |
2.081 |
-0.319 |
C2H2+ |
acetylene cation |
rCH |
1.077 |
1.389 |
0.312 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.906 |
0.310 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.597 |
1.906 |
0.310 |
CH3CH2SH |
ethanethiol |
rCC |
1.528 |
1.831 |
0.303 |
GaO |
Gallium monoxide |
rOGa |
1.743 |
1.441 |
-0.302 |
CH3CH2SH |
ethanethiol |
rCC |
1.528 |
1.827 |
0.299 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
1.921 |
-0.299 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
1.921 |
-0.299 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
1.921 |
-0.299 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.392 |
0.294 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.392 |
0.294 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.831 |
-0.279 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.831 |
-0.279 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.831 |
-0.279 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.831 |
-0.279 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.974 |
0.277 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.974 |
0.277 |
CH3CH2SH |
ethanethiol |
rCS |
1.820 |
1.555 |
-0.265 |
SF5Cl |
sulfur chloropentafluoride |
rSCl |
2.030 |
2.294 |
0.264 |
CH3CH2SH |
ethanethiol |
rCS |
1.820 |
1.558 |
-0.262 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.989 |
-0.261 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.989 |
-0.261 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.989 |
-0.261 |
GaP |
Gallium monophosphide |
rPGa |
2.250 |
1.989 |
-0.261 |
NaS |
Sodium sulfide |
rNaS |
2.489 |
2.229 |
-0.260 |
S4 |
Sulfur tetramer |
rSS |
1.898 |
2.155 |
0.257 |
ClOF3 |
Chlorine trifluoride oxide |
rFCl |
1.713 |
1.966 |
0.253 |
GaBr |
Gallium monobromide |
rGaBr |
2.352 |
2.099 |
-0.253 |
CaO |
Calcium monoxide |
rOCa |
1.822 |
2.075 |
0.253 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.989 |
-0.251 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.989 |
-0.251 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.989 |
-0.251 |
GaP |
Gallium monophosphide |
rPGa |
2.240 |
1.989 |
-0.251 |
CaC |
Calcium monocarbide |
rCCa |
2.302 |
2.550 |
0.248 |
GaH |
Gallium monohydride |
rGaH |
1.663 |
1.416 |
-0.247 |
Si2H2 |
disilyne |
rSiH |
1.668 |
1.425 |
-0.243 |
GaCl |
Gallium monochloride |
rClGa |
2.202 |
1.963 |
-0.239 |
SO3 |
Sulfur trioxide |
rSO |
1.418 |
1.647 |
0.229 |
C4H6 |
1-Methylcyclopropene |
rCC |
1.300 |
1.519 |
0.219 |
SOF4 |
Sulfur tetrafluoride oxide |
rFS |
1.539 |
1.757 |
0.218 |
S3 |
Sulfur trimer |
rSS |
1.917 |
2.134 |
0.217 |
Si2H2 |
disilyne |
rSiH |
1.668 |
1.456 |
-0.212 |
Si2H2 |
disilyne |
rSiSi |
2.215 |
2.006 |
-0.210 |
Al2Cl6 |
Aluminum, di-μ-chlorotetrachlorodi- |
rAlCl |
2.040 |
2.249 |
0.209 |
SO2 |
Sulfur dioxide |
rSO |
1.432 |
1.639 |
0.207 |
ScO |
Scandium monoxide |
rOSc |
1.668 |
1.872 |
0.204 |
C2H6O2S |
Dimethyl sulfone |
rCS |
1.777 |
1.979 |
0.202 |
Cl2+ |
chlorine diatomic cation |
rClCl |
1.892 |
2.090 |
0.198 |
C2H6O2S |
Dimethyl sulfone |
rSO |
1.431 |
1.626 |
0.195 |
SOF4 |
Sulfur tetrafluoride oxide |
rSO |
1.409 |
1.602 |
0.193 |
Si2H2 |
disilyne |
rSiSi |
2.215 |
2.024 |
-0.191 |
SF4 |
Sulfur tetrafluoride |
rSF |
1.545 |
1.734 |
0.189 |
SSO |
Disulfur monoxide |
rSO |
1.456 |
1.644 |
0.188 |
CFCl |
chlorofluoromethylene |
rCCl |
1.714 |
1.901 |
0.187 |
NCl |
nitrogen monochloride |
rNCl |
1.611 |
1.794 |
0.184 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.081 |
-0.179 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.081 |
-0.179 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.081 |
-0.179 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.081 |
-0.179 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.081 |
-0.179 |
AlP |
Aluminum monophosphide |
rAlP |
2.260 |
2.081 |
-0.179 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.876 |
0.179 |
ClF3 |
Chlorine trifluoride |
rFCl |
1.697 |
1.876 |
0.179 |
N2 |
Nitrogen diatomic |
rNN |
1.213 |
1.392 |
0.179 |
N2 |
Nitrogen diatomic |
rNN |
1.213 |
1.392 |
0.179 |
IO |
Iodine monoxide |
rIO |
1.868 |
2.044 |
0.176 |
Al2Cl6 |
Aluminum, di-μ-chlorotetrachlorodi- |
rAlCl |
2.240 |
2.064 |
-0.176 |
O2+ |
diatomic oxygen cation |
rOO |
1.116 |
1.292 |
0.175 |
NaO |
sodium monoxide |
rONa |
2.052 |
1.878 |
-0.174 |
NaF |
sodium fluoride |
rNaF |
1.926 |
1.758 |
-0.168 |
NaI |
Sodium Iodide |
rNaI |
2.711 |
2.545 |
-0.166 |
Ne2+ |
Neon diatomic cation |
rNeNe |
1.765 |
1.600 |
-0.165 |
CF3Cl |
Methane, chlorotrifluoro- |
rCCl |
1.752 |
1.915 |
0.163 |
GeH |
germylidene |
rGeH |
1.588 |
1.427 |
-0.161 |
GeH |
germylidene |
rGeH |
1.588 |
1.427 |
-0.161 |
ClO |
Monochlorine monoxide |
rClO |
1.596 |
1.756 |
0.160 |
SF6 |
Sulfur Hexafluoride |
rSF |
1.561 |
1.721 |
0.160 |
NO+ |
nitric oxide cation |
rNO |
1.066 |
1.223 |
0.157 |
SeO2 |
Selenium dioxide |
rSeO |
1.607 |
1.764 |
0.157 |
SeF4 |
Selenium tetrafluoride |
rFSe |
1.682 |
1.835 |
0.153 |
SO+ |
sulfur monoxide cation |
rOS |
1.424 |
1.577 |
0.153 |
NaCl |
Sodium Chloride |
rNaCl |
2.361 |
2.210 |
-0.151 |
OPCl |
Phosphorus oxychloride |
rPCl |
2.059 |
2.209 |
0.150 |
SOF4 |
Sulfur tetrafluoride oxide |
rFS |
1.596 |
1.745 |
0.149 |
S2N2 |
Disulfur dinitride |
rNS |
1.642 |
1.791 |
0.149 |
GeO |
Germanium monoxide |
rOGe |
1.625 |
1.477 |
-0.147 |
GeO |
Germanium monoxide |
rOGe |
1.625 |
1.477 |
-0.147 |
HeH+ |
Helium hydride cation |
rHHe |
0.790 |
0.937 |
0.147 |
GaCl3 |
Gallium trichloride |
rClGa |
2.180 |
2.034 |
-0.146 |
ClOOCl |
Dichlorine dioxide |
rOCl |
1.704 |
1.851 |
0.146 |
SF5Cl |
sulfur chloropentafluoride |
rFS |
1.576 |
1.722 |
0.146 |
CF2Cl2 |
difluorodichloromethane |
rCCl |
1.744 |
1.888 |
0.144 |
FNO |
Nitrosyl fluoride |
rNO |
1.136 |
1.280 |
0.144 |
GeH2 |
germylene |
rGeH |
1.588 |
1.445 |
-0.143 |
GeH2 |
germylene |
rGeH |
1.588 |
1.445 |
-0.143 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.623 |
0.142 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.623 |
0.142 |
OH- |
hydroxide anion |
rOH |
0.964 |
1.105 |
0.141 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.081 |
-0.139 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.081 |
-0.139 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.081 |
-0.139 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.081 |
-0.139 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.081 |
-0.139 |
AlP |
Aluminum monophosphide |
rAlP |
2.220 |
2.081 |
-0.139 |
SFCl |
Sulfur chloride fluoride |
rSCl |
1.994 |
2.133 |
0.139 |
CaS |
Calcium sulfide |
rSCa |
2.318 |
2.456 |
0.138 |
N2O4 |
Dinitrogen tetroxide |
rNN |
1.782 |
1.920 |
0.138 |
KH |
Potassium hydride |
rKH |
2.243 |
2.105 |
-0.137 |
SSO |
Disulfur monoxide |
rSS |
1.884 |
2.021 |
0.137 |
CHFClBr |
fluorochlorobromomethane |
rCCl |
1.745 |
1.882 |
0.137 |
CHFClBr |
fluorochlorobromomethane |
rCCl |
1.745 |
1.882 |
0.137 |
C2H2+ |
acetylene cation |
rCC |
1.253 |
1.389 |
0.136 |
CH3SOCH3 |
Dimethyl sulfoxide |
rCS |
1.799 |
1.935 |
0.136 |
CH3SOCH3 |
Dimethyl sulfoxide |
rSO |
1.485 |
1.618 |
0.133 |
LiOH |
lithium hydroxide |
rLiO |
1.582 |
1.450 |
-0.131 |
FNO2 |
Nitryl fluoride |
rNO |
1.180 |
1.311 |
0.131 |
LiS |
Lithium monosulfide |
rLiS |
2.150 |
2.019 |
-0.131 |
BrO |
Bromine monoxide |
rOBr |
1.718 |
1.846 |
0.128 |
FSN |
Thiazyl fluoride |
rNS |
1.448 |
1.576 |
0.128 |
NCl3 |
nitrogen trichloride |
rNCl |
1.754 |
1.880 |
0.127 |
BrO |
Bromine monoxide |
rOBr |
1.718 |
1.844 |
0.127 |
PF5 |
Phosphorus pentafluoride |
rPF |
1.534 |
1.660 |
0.126 |
TeO2 |
Tellurium Dioxide |
rOTe |
1.830 |
1.955 |
0.125 |
C5H6 |
Propellane |
rCC |
1.596 |
1.721 |
0.125 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.606 |
0.124 |
SO |
Sulfur monoxide |
rSO |
1.481 |
1.606 |
0.124 |
LiBr |
Lithium Bromide |
rLiBr |
2.170 |
2.048 |
-0.123 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.623 |
0.123 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.623 |
0.123 |
LiF |
lithium fluoride |
rLiF |
1.564 |
1.442 |
-0.122 |
Ar2+ |
Argon diatomic cation |
rArAr |
2.320 |
2.442 |
0.122 |
GaF3 |
Gallium trifluoride |
rFGa |
1.725 |
1.604 |
-0.121 |
GeS |
Germanium monosulfide |
rSGe |
2.012 |
1.891 |
-0.121 |
CaBr |
Calcium monobromide |
rCaBr |
2.594 |
2.714 |
0.121 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.989 |
-0.121 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.989 |
-0.121 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.989 |
-0.121 |
GaP |
Gallium monophosphide |
rPGa |
2.110 |
1.989 |
-0.121 |
C2H5NO3 |
Nitric acid, ethyl ester |
rNO |
1.407 |
1.527 |
0.120 |
BrO+ |
Bromine monoxide cation |
rOBr |
1.635 |
1.754 |
0.119 |
N2O |
Nitrous oxide |
rNN |
1.128 |
1.247 |
0.119 |
N2O |
Nitrous oxide |
rNN |
1.128 |
1.247 |
0.119 |
GeF |
Germanium monofluoride |
rFGe |
1.745 |
1.626 |
-0.119 |
Cl2 |
Chlorine diatomic |
rClCl |
1.988 |
2.107 |
0.119 |
C2H2ClF |
1-chloro-1-fluoroethylene |
rCCl |
1.704 |
1.823 |
0.119 |
NO2 |
Nitrogen dioxide |
rNO |
1.193 |
1.312 |
0.119 |
NO2 |
Nitrogen dioxide |
rNO |
1.193 |
1.312 |
0.119 |
SiC |
silicon monocarbide |
rCSi |
1.722 |
1.605 |
-0.117 |
Si2H2 |
disilyne |
rSiH |
1.668 |
1.783 |
0.115 |
LiI |
Lithium Iodide |
rLiI |
2.392 |
2.277 |
-0.115 |
ClCOClCO |
Oxalyl chloride |
rCCl |
1.744 |
1.858 |
0.114 |
SCl |
sulfur monochloride |
rSCl |
1.975 |
2.089 |
0.114 |
ClNO |
Nitrosyl chloride |
rNO |
1.139 |
1.252 |
0.113 |
N2O4 |
Dinitrogen tetroxide |
rNO |
1.190 |
1.303 |
0.113 |
HNO3 |
Nitric acid |
rNO |
1.199 |
1.310 |
0.111 |
CF3OF |
Trifluoromethylhypofluorite |
rCO |
1.395 |
1.505 |
0.110 |
MgH |
magnesium monohydride |
rMgH |
1.730 |
1.620 |
-0.110 |
B2 |
Boron diatomic |
rBB |
1.590 |
1.481 |
-0.109 |
GeSe |
Germanium monoselenide |
rGeSe |
2.135 |
2.026 |
-0.108 |
ONNO |
NO dimer |
rNO |
1.161 |
1.268 |
0.107 |
TeO |
Tellurium monoxide |
rOTe |
1.825 |
1.931 |
0.106 |
HNO3 |
Nitric acid |
rNO |
1.211 |
1.317 |
0.106 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.606 |
0.105 |
SO |
Sulfur monoxide |
rOS |
1.500 |
1.606 |
0.105 |
C4H8O2 |
Ethyl acetate |
rCO |
1.448 |
1.553 |
0.105 |
HN3 |
hydrogen azide |
rNH |
0.975 |
1.080 |
0.105 |
HCl+ |
hydrogen chloride cation |
rHCl |
1.315 |
1.420 |
0.105 |
CH3NO |
nitrosomethane |
rCN |
1.482 |
1.587 |
0.105 |
CH3NO2 |
Methane, nitro- |
rNO |
1.224 |
1.328 |
0.104 |
CHONH2 |
formamide |
rCN |
1.350 |
1.453 |
0.103 |
HNO3 |
Nitric acid |
rNO |
1.406 |
1.509 |
0.103 |
ClF |
Chlorine monofluoride |
rFCl |
1.628 |
1.730 |
0.102 |
FSN |
Thiazyl fluoride |
rFS |
1.643 |
1.745 |
0.102 |
C2H3NO |
Nitrosoethylene |
rCN |
1.439 |
1.540 |
0.101 |
S3 |
Sulfur trimer |
rSS |
1.917 |
2.017 |
0.100 |
NHCl2 |
dichloroamine |
rNCl |
1.760 |
1.860 |
0.100 |
KOH |
Potassium hydroxide |
rOH |
0.912 |
1.012 |
0.100 |
C2 |
Carbon diatomic |
rCC |
1.243 |
1.342 |
0.099 |
ScH |
Scandium monohydride |
rScH |
1.775 |
1.874 |
0.099 |
C2H5NO3 |
Nitric acid, ethyl ester |
rNO |
1.215 |
1.314 |
0.099 |
PO |
Phosphorus monoxide |
rPO |
1.476 |
1.573 |
0.097 |
C2H5NO3 |
Nitric acid, ethyl ester |
rNO |
1.215 |
1.312 |
0.097 |
HOCl |
hypochlorous acid |
rClO |
1.697 |
1.794 |
0.097 |
HN3 |
hydrogen azide |
rNN |
1.133 |
1.229 |
0.096 |
SF2 |
sulfur difluoride |
rSF |
1.587 |
1.684 |
0.096 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.194 |
0.096 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.194 |
0.096 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.194 |
0.096 |
N2 |
Nitrogen diatomic |
rNN |
1.098 |
1.194 |
0.096 |
H2COO |
Dioxymethyl radical |
rCO |
1.272 |
1.367 |
0.095 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.493 |
1.588 |
0.095 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.493 |
1.588 |
0.095 |
GeH3F |
monofluorogermane |
rGeH |
1.515 |
1.421 |
-0.093 |
SeO |
Selenium monoxide |
rSeO |
1.639 |
1.732 |
0.093 |
GeF+ |
Germanium monofluoride cation |
rFGe |
1.665 |
1.573 |
-0.092 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.493 |
1.585 |
0.092 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.493 |
1.585 |
0.092 |
O3 |
Ozone |
rOO |
1.278 |
1.370 |
0.092 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.783 |
0.092 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.783 |
0.092 |
BClF2 |
Chlorodifluoroborane |
rBCl |
1.728 |
1.819 |
0.091 |
N2H4 |
Hydrazine |
rNN |
1.446 |
1.537 |
0.091 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.795 |
0.090 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.795 |
0.090 |
C3H2O3 |
vinylene carbonate |
rCO |
1.364 |
1.454 |
0.090 |
SiP |
Silicon monophosphide |
rSiP |
2.078 |
1.987 |
-0.090 |
N3 |
azide radical |
rNN |
1.181 |
1.271 |
0.090 |
CH2BrCl |
Methane, bromochloro- |
rCCl |
1.755 |
1.845 |
0.090 |
N2O |
Nitrous oxide |
rNO |
1.184 |
1.274 |
0.089 |
N2O |
Nitrous oxide |
rNO |
1.184 |
1.274 |
0.089 |
PF5 |
Phosphorus pentafluoride |
rFP |
1.577 |
1.666 |
0.089 |
LiCl |
lithium chloride |
rLiCl |
2.021 |
1.932 |
-0.089 |
HCCCl |
Chloroacetylene |
rCCl |
1.637 |
1.725 |
0.089 |
SF4 |
Sulfur tetrafluoride |
rSF |
1.646 |
1.734 |
0.088 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.501 |
1.588 |
0.087 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.501 |
1.588 |
0.087 |
CF2CCl2 |
difluorodichloroethylene |
rCCl |
1.706 |
1.793 |
0.087 |
HNO |
Nitrosyl hydride |
rNO |
1.209 |
1.296 |
0.087 |
CO+ |
carbon monoxide cation |
rCO |
1.115 |
1.202 |
0.087 |
HOI |
Hypoiodous acid |
rOI |
1.994 |
2.081 |
0.087 |
CH2ClCCCl |
1,3-dichloropropyne |
rCCl |
1.638 |
1.724 |
0.086 |
CH3CSNH2 |
Ethanethioamide |
rCN |
1.356 |
1.442 |
0.086 |
CF3COOH |
trifluoroacetic acid |
rCC |
1.546 |
1.631 |
0.085 |
LiNH2 |
lithium amide |
rLiN |
1.736 |
1.651 |
-0.085 |
HOSH |
hydrogen thioperoxide |
rSO |
1.662 |
1.746 |
0.084 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.501 |
1.585 |
0.084 |
C2H4F2 |
1,2-difluoroethane |
rCC |
1.501 |
1.585 |
0.084 |
O2 |
Oxygen diatomic |
rOO |
1.208 |
1.291 |
0.084 |
O2 |
Oxygen diatomic |
rOO |
1.208 |
1.291 |
0.084 |
C2H3NO |
Nitrosoethylene |
rNO |
1.220 |
1.302 |
0.082 |
CH3NO |
nitrosomethane |
rNO |
1.211 |
1.293 |
0.082 |
C3O2 |
Carbon suboxide |
rCO |
1.146 |
1.228 |
0.082 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.773 |
0.082 |
CH2Cl |
chloromethyl radical |
rCCl |
1.691 |
1.773 |
0.082 |
N2H2 |
(E)-diazene |
rNN |
1.252 |
1.333 |
0.082 |
CaBr2 |
Calcium dibromide |
rCaBr |
2.616 |
2.697 |
0.081 |
H2O2 |
Hydrogen peroxide |
rOH |
0.950 |
1.030 |
0.080 |
H2O2 |
Hydrogen peroxide |
rOH |
0.950 |
1.030 |
0.080 |
H2O2 |
Hydrogen peroxide |
rOH |
0.950 |
1.030 |
0.080 |
OPCl |
Phosphorus oxychloride |
rPO |
1.462 |
1.542 |
0.080 |
C4H8O2 |
Ethyl acetate |
rCO |
1.345 |
1.425 |
0.080 |
CH3CHF2 |
Ethane, 1,1-difluoro- |
rCC |
1.498 |
1.578 |
0.080 |
CCl4 |
Carbon tetrachloride |
rCCl |
1.767 |
1.847 |
0.080 |
HCNO |
fulminic acid |
rNO |
1.199 |
1.279 |
0.080 |
HCNO |
fulminic acid |
rNO |
1.199 |
1.279 |
0.080 |
CH3NO2 |
Methane, nitro- |
rCN |
1.489 |
1.568 |
0.079 |
CF3Br |
Bromotrifluoromethane |
rCBr |
1.923 |
2.002 |
0.079 |
OH+ |
hydoxyl cation |
rOH |
1.029 |
1.108 |
0.079 |
ScF |
Scandium monofluoride |
rFSc |
1.788 |
1.866 |
0.079 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.783 |
0.078 |
NH2SH |
Thiohydroxylamine |
rNS |
1.705 |
1.783 |
0.078 |
HOF |
Hypofluorous acid |
rOH |
0.960 |
1.038 |
0.078 |
HCOOH |
Formic acid |
rCO |
1.343 |
1.421 |
0.078 |
SiF3 |
Silicon trifluoride radical |
rFSi |
1.565 |
1.643 |
0.078 |
FNO |
Nitrosyl fluoride |
rNF |
1.512 |
1.435 |
-0.077 |
ArH+ |
Argon hydride cation |
rArH |
1.292 |
1.369 |
0.077 |
BrCl |
Bromine monochloride |
rClBr |
2.136 |
2.213 |
0.077 |
CBr |
Carbon monobromide |
rCBr |
1.821 |
1.897 |
0.076 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.795 |
0.076 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.795 |
0.076 |
HCNO |
fulminic acid |
rNO |
1.199 |
1.275 |
0.076 |
NHCl2 |
dichloroamine |
rHN |
1.014 |
1.089 |
0.075 |
CHOOCHO |
diformyl ether |
rCO |
1.364 |
1.439 |
0.075 |
Si2H2 |
disilyne |
rSiSi |
2.215 |
2.140 |
-0.075 |
PF2 |
Phosphorus difluoride |
rPF |
1.579 |
1.654 |
0.075 |
C3F6 |
hexafluoropropene |
rCC |
1.513 |
1.588 |
0.075 |
C5H8O |
Cyclopentanone |
rCC |
1.504 |
1.578 |
0.074 |
S4 |
Sulfur tetramer |
rSS |
1.898 |
1.972 |
0.074 |
HCNO |
fulminic acid |
rCN |
1.168 |
1.242 |
0.074 |
NHF2 |
difluoramine |
rHN |
1.026 |
1.100 |
0.074 |
C6H4Cl2 |
1,4-dichlorobenzene |
rCCl |
1.729 |
1.803 |
0.074 |
CHCl3 |
Chloroform |
rCCl |
1.762 |
1.836 |
0.074 |
S4 |
Sulfur tetramer |
rSS |
1.898 |
1.972 |
0.074 |
SeCl2 |
Selenium Dichloride |
rClSe |
2.157 |
2.231 |
0.074 |
NO |
Nitric oxide |
rNO |
1.154 |
1.227 |
0.073 |
NO |
Nitric oxide |
rNO |
1.154 |
1.227 |
0.073 |
CF2O |
Carbonic difluoride |
rCO |
1.174 |
1.246 |
0.072 |
OH |
Hydroxyl radical |
rOH |
0.970 |
1.042 |
0.072 |
HOBr |
Hypobromous acid |
rOH |
0.961 |
1.032 |
0.071 |
C2H2N2O |
Furazan |
rCN |
1.303 |
1.374 |
0.070 |
HCOOH |
Formic acid |
rCO |
1.343 |
1.413 |
0.070 |
HCOOH |
Formic acid |
rCO |
1.343 |
1.413 |
0.070 |
HO2 |
Hydroperoxy radical |
rOH |
0.971 |
1.041 |
0.070 |
HNO3 |
Nitric acid |
rOH |
0.964 |
1.034 |
0.070 |
CH2ClCCCl |
1,3-dichloropropyne |
rCCl |
1.779 |
1.849 |
0.070 |
CH2CClCHCH2 |
1,3-Butadiene, 2-chloro- |
rCCl |
1.742 |
1.812 |
0.070 |
CH2NOH |
formaldoxime |
rOH |
0.956 |
1.026 |
0.070 |
H2Cl+ |
dihydrogen monochloride cation |
rHCl |
1.321 |
1.390 |
0.070 |
CO2 |
Carbon dioxide |
rCO |
1.162 |
1.232 |
0.069 |
CH2FCH2CH3 |
1-Fluoropropane |
rCC |
1.501 |
1.570 |
0.069 |
CH2FCH2CH3 |
1-Fluoropropane |
rCC |
1.501 |
1.570 |
0.069 |
NF3 |
Nitrogen trifluoride |
rNF |
1.365 |
1.434 |
0.069 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.480 |
1.549 |
0.069 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.480 |
1.549 |
0.069 |
CHONH2 |
formamide |
rCN |
1.350 |
1.419 |
0.069 |
CH3CHNOH |
Acetaldoxime |
rOH |
0.956 |
1.025 |
0.069 |
CF3COOH |
trifluoroacetic acid |
rCF |
1.325 |
1.394 |
0.069 |
ZnCN |
Zinc monocyanide |
rCN |
1.142 |
1.210 |
0.068 |
HF |
Hydrogen fluoride |
rHF |
0.917 |
0.985 |
0.068 |
HF |
Hydrogen fluoride |
rHF |
0.917 |
0.985 |
0.068 |
Si2H6 |
disilane |
rSiSi |
2.320 |
2.252 |
-0.068 |
CH2ClI |
chloroiodomethane |
rCCl |
1.774 |
1.842 |
0.068 |
C6H4Cl2 |
1,3-dichlorobenzene |
rCCl |
1.736 |
1.803 |
0.068 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.480 |
1.548 |
0.068 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.480 |
1.548 |
0.068 |
CHF3 |
Methane, trifluoro- |
rCF |
1.328 |
1.396 |
0.068 |
HOSH |
hydrogen thioperoxide |
rOH |
0.961 |
1.028 |
0.068 |
SiCl |
Clorosilylidyne |
rSiCl |
2.061 |
2.129 |
0.067 |
CF3OF |
Trifluoromethylhypofluorite |
rCF |
1.319 |
1.386 |
0.067 |
NO- |
nitric oxide anion |
rNO |
1.258 |
1.324 |
0.066 |
C2H2N2O |
Furazan |
rNO |
1.373 |
1.439 |
0.066 |
SFCl |
Sulfur chloride fluoride |
rFS |
1.606 |
1.672 |
0.066 |
CH3OH |
Methyl alcohol |
rOH |
0.956 |
1.021 |
0.065 |
CH3OH |
Methyl alcohol |
rOH |
0.956 |
1.021 |
0.065 |
S2 |
Sulfur diatomic |
rSS |
1.889 |
1.955 |
0.065 |
OCS |
Carbonyl sulfide |
rCO |
1.160 |
1.225 |
0.065 |
HCNO |
fulminic acid |
rCH |
1.027 |
1.092 |
0.065 |
HOI |
Hypoiodous acid |
rOH |
0.967 |
1.032 |
0.065 |
SeF4 |
Selenium tetrafluoride |
rFSe |
1.771 |
1.835 |
0.064 |
CO |
Carbon monoxide |
rCO |
1.128 |
1.193 |
0.064 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.783 |
0.064 |
NH2SH |
Thiohydroxylamine |
rNS |
1.719 |
1.783 |
0.064 |
CF3COOH |
trifluoroacetic acid |
rOH |
0.960 |
1.024 |
0.064 |
FCO |
Carbonyl fluoride |
rCO |
1.180 |
1.244 |
0.064 |
CF2O |
Carbonic difluoride |
rCF |
1.312 |
1.376 |
0.064 |
NH2OH |
hydroxylamine |
rOH |
0.962 |
1.025 |
0.063 |
NH2OH |
hydroxylamine |
rOH |
0.962 |
1.025 |
0.063 |
ZnCN |
Zinc monocyanide |
rCZn |
1.950 |
1.886 |
-0.063 |
HSiCl |
Chlorosilylene |
rSiCl |
2.067 |
2.130 |
0.063 |
CH2Cl2 |
Methylene chloride |
rCCl |
1.767 |
1.830 |
0.063 |
N2H2 |
(E)-diazene |
rNH |
1.028 |
1.091 |
0.062 |
C3H6O |
2-Propen-1-ol |
rOH |
0.960 |
1.022 |
0.062 |
ClCOClCO |
Oxalyl chloride |
rCC |
1.534 |
1.596 |
0.062 |
BrF |
Bromine monofluoride |
rFBr |
1.759 |
1.821 |
0.062 |
CF3Br |
Bromotrifluoromethane |
rCF |
1.327 |
1.388 |
0.062 |
HNCS |
Isothiocyanic acid |
rHN |
0.993 |
1.055 |
0.062 |
B4H10 |
Tetraborane(10) |
rHB |
1.221 |
1.159 |
-0.062 |
H2O |
Water |
rOH |
0.958 |
1.019 |
0.061 |
H2O |
Water |
rOH |
0.958 |
1.019 |
0.061 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.488 |
1.549 |
0.061 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.488 |
1.549 |
0.061 |
CH3OC2H5 |
Ethane, methoxy- |
rCO |
1.407 |
1.468 |
0.061 |
SiH2Cl2 |
dichlorosilane |
rSiCl |
2.033 |
2.094 |
0.061 |
CF3COOH |
trifluoroacetic acid |
rCO |
1.353 |
1.414 |
0.061 |
CHOOCHO |
diformyl ether |
rCO |
1.184 |
1.245 |
0.061 |
CH3SSH |
Hydrogen methyl disulfide |
rSS |
2.038 |
2.099 |
0.061 |
BH |
Boron monohydride |
rBH |
1.232 |
1.172 |
-0.061 |
CI4 |
tetraiodomethane |
rCI |
2.157 |
2.218 |
0.061 |
C2N2 |
Cyanogen |
rCN |
1.154 |
1.215 |
0.061 |
LiO |
lithium oxide |
rLiO |
1.688 |
1.628 |
-0.061 |
HOCl |
hypochlorous acid |
rOH |
0.973 |
1.034 |
0.060 |
NH2 |
Amino radical |
rNH |
1.024 |
1.084 |
0.060 |
OCSe |
Carbonyl selenide |
rCO |
1.159 |
1.219 |
0.060 |
CF2 |
Difluoromethylene |
rCF |
1.297 |
1.357 |
0.060 |
HCl |
Hydrogen chloride |
rHCl |
1.275 |
1.335 |
0.060 |
H2O+ |
water cation |
rOH |
0.999 |
1.059 |
0.060 |
CF3COOH |
trifluoroacetic acid |
rCO |
1.192 |
1.252 |
0.060 |
KOH |
Potassium hydroxide |
rOK |
2.212 |
2.152 |
-0.060 |
CH2CHCHO |
Acrolein |
rCC |
1.468 |
1.528 |
0.060 |
CH2CHCHO |
Acrolein |
rCC |
1.468 |
1.528 |
0.060 |
CH2CO |
Ketene |
rCO |
1.162 |
1.222 |
0.060 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.488 |
1.548 |
0.060 |
CH2CHCH2F |
Allyl Fluoride |
rCC |
1.488 |
1.548 |
0.060 |
SiHF3 |
trifluorosilane |
rSiF |
1.563 |
1.622 |
0.060 |
B4H10 |
Tetraborane(10) |
rHB |
1.315 |
1.256 |
-0.059 |
VO |
Vanadium monoxide |
rVO |
1.589 |
1.530 |
-0.059 |
CH3CCl2CH3 |
Propane, 2,2-dichloro- |
rCCl |
1.799 |
1.858 |
0.059 |
TiH |
Titanium monohydride |
rHTi |
1.785 |
1.726 |
-0.059 |
AsH |
Arsenic monohydride |
rAsH |
1.535 |
1.476 |
-0.059 |
SiC |
silicon monocarbide |
rCSi |
1.722 |
1.663 |
-0.058 |
SF |
Monosulfur monofluoride |
rSF |
1.599 |
1.658 |
0.058 |
C2H2O4 |
Oxalic Acid |
rCO |
1.336 |
1.394 |
0.058 |
CH3CHClCH3 |
Propane, 2-chloro- |
rCCl |
1.798 |
1.856 |
0.058 |
HCONHCH3 |
N-methylformamide |
rCN |
1.366 |
1.424 |
0.058 |
HNCS |
Isothiocyanic acid |
rCN |
1.207 |
1.265 |
0.058 |
BH3CO |
Borane carbonyl |
rCO |
1.135 |
1.193 |
0.058 |
BH3CO |
Borane carbonyl |
rCO |
1.135 |
1.193 |
0.058 |
HCO |
Formyl radical |
rCH |
1.080 |
1.138 |
0.058 |
HCONHCH3 |
N-methylformamide |
rCN |
1.366 |
1.424 |
0.058 |
C3H3NO |
Oxazole |
rCN |
1.292 |
1.349 |
0.057 |
CH3CHNOH |
Acetaldoxime |
rCN |
1.276 |
1.333 |
0.057 |
CH3CHO |
Acetaldehyde |
rCC |
1.501 |
1.557 |
0.057 |
HNCNH |
diiminomethane |
rNH |
1.007 |
1.064 |
0.056 |
CH(CN)3 |
tricyanomethane |
rCC |
1.460 |
1.516 |
0.056 |
SiH2F2 |
difluorosilane |
rSiF |
1.576 |
1.632 |
0.056 |
C2H2O4 |
Oxalic Acid |
rCO |
1.205 |
1.261 |
0.056 |
NH2OH |
hydroxylamine |
rNH |
1.016 |
1.072 |
0.056 |
NH2OH |
hydroxylamine |
rNH |
1.016 |
1.072 |
0.056 |
CH2CHCHO |
Acrolein |
rCC |
1.468 |
1.524 |
0.056 |
CH2CHCHO |
Acrolein |
rCC |
1.468 |
1.524 |
0.056 |
CH3CH2CHO |
Propanal |
rCC |
1.509 |
1.564 |
0.055 |
NH2CONH2 |
Urea |
rCN |
1.378 |
1.433 |
0.055 |
HOBr |
Hypobromous acid |
rBrO |
1.834 |
1.889 |
0.055 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.062 |
0.054 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.062 |
0.054 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.062 |
0.054 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.062 |
0.054 |
C5H8O |
Methyl cyclopropyl ketone |
rCC |
1.510 |
1.564 |
0.054 |
AsCl3 |
Arsenous trichloride |
rClAs |
2.166 |
2.219 |
0.054 |
HNCNH |
diiminomethane |
rCN |
1.224 |
1.278 |
0.054 |
AlNC |
Aluminum isocyanide |
rNC |
1.163 |
1.216 |
0.053 |
ClCOClCO |
Oxalyl chloride |
rCO |
1.182 |
1.235 |
0.053 |
F2CCCF2 |
tetrafluoroallene |
rCF |
1.320 |
1.373 |
0.053 |
CF3Cl |
Methane, chlorotrifluoro- |
rCF |
1.325 |
1.378 |
0.053 |
C2H5NO3 |
Nitric acid, ethyl ester |
rCO |
1.430 |
1.483 |
0.053 |
CH2NOH |
formaldoxime |
rCN |
1.276 |
1.329 |
0.053 |
CH3OCH3 |
Dimethyl ether |
rCO |
1.411 |
1.464 |
0.053 |
C3 |
carbon trimer |
rCC |
1.277 |
1.330 |
0.053 |
C3 |
carbon trimer |
rCC |
1.277 |
1.330 |
0.053 |
PN |
Phosphorus mononitride |
rPN |
1.491 |
1.543 |
0.052 |
CH2NH |
Methanimine |
rNH |
1.023 |
1.075 |
0.052 |
BrCN |
Cyanogen bromide |
rCN |
1.158 |
1.210 |
0.052 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.060 |
0.052 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.060 |
0.052 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.060 |
0.052 |
NH2SH |
Thiohydroxylamine |
rHN |
1.008 |
1.060 |
0.052 |
HCOOH |
Formic acid |
rOH |
0.972 |
1.024 |
0.052 |
HSSSH |
trisulfane |
rSS |
2.053 |
2.105 |
0.052 |
HSSSH |
trisulfane |
rSS |
2.053 |
2.105 |
0.052 |
HCOOH |
Formic acid |
rOH |
0.972 |
1.024 |
0.052 |
N2H4 |
Hydrazine |
rNH |
1.016 |
1.068 |
0.052 |
C4H8O2 |
Ethyl acetate |
rCC |
1.508 |
1.560 |
0.052 |
C3H2O3 |
vinylene carbonate |
rCO |
1.191 |
1.242 |
0.051 |
NH2CN |
cyanamide |
rCN |
1.159 |
1.211 |
0.051 |
BH3PH3 |
borane phosphine |
rBP |
1.937 |
1.988 |
0.051 |
C2H5CN |
ethyl cyanide |
rCN |
1.153 |
1.204 |
0.051 |
HSSSH |
trisulfane |
rSS |
2.054 |
2.105 |
0.051 |
HSSSH |
trisulfane |
rSS |
2.054 |
2.105 |
0.051 |
SiI4 |
silicon tetraiodide |
rSiI |
2.432 |
2.483 |
0.051 |
SiH3Cl |
chlorosilane |
rSiCl |
2.051 |
2.101 |
0.051 |
CHOOCHO |
diformyl ether |
rCO |
1.389 |
1.439 |
0.051 |
CH3CH2OH |
Ethanol |
rOH |
0.971 |
1.021 |
0.050 |
Li2O |
dilithium oxide |
rLiO |
1.606 |
1.556 |
-0.050 |
F2 |
Fluorine diatomic |
rFF |
1.412 |
1.362 |
-0.050 |
KrH+ |
Protonated Krypton |
rHKr |
1.421 |
1.471 |
0.050 |
HCCF |
Fluoroacetylene |
rCF |
1.279 |
1.329 |
0.050 |
509 molecules.