species |
name |
calculated |
experimental |
difference |
C4H8O2 |
Butanoic acid |
6.752 |
|
|
C60 |
Buckminsterfullerene |
67.263 |
79.000 |
-11.737 |
C16H10 |
Pyrene |
24.398 |
29.720 |
-5.322 |
C6H5Br |
bromobenzene |
9.648 |
14.700 |
-5.052 |
CH3CHClCH2CH3 |
Butane, 2-chloro- |
7.532 |
12.499 |
-4.967 |
CHBr3 |
bromoform |
7.113 |
11.840 |
-4.727 |
SiH3Cl |
chlorosilane |
4.461 |
9.113 |
-4.652 |
C14H10 |
Anthracene |
22.084 |
26.700 |
-4.616 |
ClF3 |
Chlorine trifluoride |
3.180 |
7.483 |
-4.304 |
CSe2 |
Carbon diselenide |
7.033 |
11.269 |
-4.237 |
ClF3 |
Chlorine trifluoride |
3.308 |
7.483 |
-4.176 |
TiCl4 |
Titanium tetrachloride |
10.885 |
15.001 |
-4.115 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
5.918 |
10.000 |
-4.082 |
BBr3 |
Boron tribromide |
7.302 |
11.351 |
-4.049 |
C24H12 |
Coronene |
38.513 |
42.499 |
-3.986 |
CH2ClCH2CH3 |
Propane, 1-chloro- |
6.032 |
10.000 |
-3.968 |
C14H10 |
Phenanthrene |
20.857 |
24.779 |
-3.923 |
CH2Br2 |
dibromomethane |
4.912 |
8.680 |
-3.768 |
CH2ClCH2CH2CH3 |
Butane, 1-chloro- |
7.641 |
11.301 |
-3.659 |
(CH3)3CC(CH3)3 |
tetramethylbutane |
12.008 |
15.610 |
-3.602 |
(CH3)3CC(CH3)3 |
tetramethylbutane |
12.031 |
15.610 |
-3.579 |
PBr3 |
Phosphorus tribromide |
10.811 |
14.380 |
-3.569 |
HI |
Hydrogen iodide |
1.923 |
5.453 |
-3.530 |
Xe |
Xenon atom |
0.543 |
4.005 |
-3.463 |
C10H8 |
naphthalene |
13.954 |
17.400 |
-3.445 |
CH3I |
methyl iodide |
3.938 |
7.325 |
-3.387 |
Al2Cl6 |
Aluminum, di-μ-chlorotetrachlorodi- |
14.525 |
17.886 |
-3.361 |
Br2 |
Bromine diatomic |
3.104 |
6.431 |
-3.328 |
CH3CHBrCH3 |
i-propyl bromide |
6.379 |
9.600 |
-3.221 |
BCl3 |
Borane, trichloro- |
5.481 |
8.700 |
-3.219 |
C5H12O |
1-Pentanol |
8.386 |
11.581 |
-3.195 |
C2H3Br |
vinyl bromide |
4.401 |
7.590 |
-3.189 |
CH2CHCHCH2 |
1,3-Butadiene |
5.740 |
8.881 |
-3.141 |
CS2 |
Carbon disulfide |
5.689 |
8.749 |
-3.060 |
GeCl4 |
Germanium Tetrachloride |
9.484 |
12.490 |
-3.007 |
CH3C6H4CH3 |
paraxylene |
11.261 |
14.260 |
-2.999 |
CH2ClCHCl2 |
1,1,2-trichloroethane |
7.294 |
10.260 |
-2.967 |
C6H5CHCH2 |
Styrene |
11.446 |
14.409 |
-2.963 |
C6H5CHO |
benzaldehyde |
9.848 |
12.800 |
-2.952 |
C6H5OCH3 |
Anisole |
10.172 |
13.100 |
-2.927 |
C6H4Cl2 |
1,3-dichlorobenzene |
10.861 |
13.729 |
-2.869 |
HCCCl |
Chloroacetylene |
3.228 |
6.070 |
-2.842 |
C6H15N |
triethylamine |
10.543 |
13.380 |
-2.837 |
Cl2CS |
Thiophosgene |
6.784 |
9.573 |
-2.789 |
CHClCCl2 |
Trichloroethylene |
6.977 |
9.751 |
-2.774 |
CHClCHCl |
Ethene, 1,2-dichloro-, (Z)- |
5.267 |
8.030 |
-2.763 |
CH3CCl3 |
Ethane, 1,1,1-trichloro- |
7.363 |
10.120 |
-2.756 |
CCl3CHO |
trichloroacetaldehyde |
7.758 |
10.500 |
-2.742 |
C5H11Cl |
Pentane, 1-chloro- |
9.276 |
12.000 |
-2.724 |
C6H5Cl |
chlorobenzene |
9.151 |
11.861 |
-2.709 |
CH2CHCHCH2 |
1,3-Butadiene |
6.172 |
8.881 |
-2.708 |
CH3CH2CH2Br |
n-propyl bromide |
6.385 |
9.070 |
-2.685 |
C6H5NH2 |
aniline |
8.910 |
11.581 |
-2.670 |
BrCN |
Cyanogen bromide |
3.157 |
5.824 |
-2.667 |
C12H10 |
biphenyl |
16.976 |
19.640 |
-2.664 |
CCl4 |
Carbon tetrachloride |
7.359 |
10.002 |
-2.643 |
C8H18 |
Octane |
12.617 |
15.239 |
-2.623 |
C6H5OH |
phenol |
8.293 |
10.909 |
-2.616 |
CH3Br |
methyl bromide |
3.033 |
5.610 |
-2.577 |
C6H5F |
Fluorobenzene |
7.626 |
10.200 |
-2.574 |
CHClCHCl |
Ethene, 1,2-dichloro-, (E)- |
5.600 |
8.150 |
-2.550 |
CH2Cl2 |
Methylene chloride |
4.110 |
6.659 |
-2.549 |
C2H5Br |
Ethyl bromide |
4.742 |
7.280 |
-2.538 |
C5H12 |
Propane, 2,2-dimethyl- |
7.709 |
10.240 |
-2.530 |
C6H4O2 |
parabenzoquinone |
8.724 |
11.229 |
-2.506 |
C5H5N |
Pyridine |
6.997 |
9.493 |
-2.496 |
SiCl4 |
Silane, tetrachloro- |
8.789 |
11.269 |
-2.481 |
C6H5CH3 |
toluene |
9.380 |
11.861 |
-2.481 |
C4H4N2O2 |
Uracil |
7.623 |
10.090 |
-2.467 |
CF3Br |
Bromotrifluoromethane |
3.185 |
5.650 |
-2.466 |
CH2ClCH2Cl |
Ethane, 1,2-dichloro- |
5.541 |
8.000 |
-2.460 |
HBr |
hydrogen bromide |
1.163 |
3.616 |
-2.453 |
C6H12 |
hex-1-ene |
9.198 |
11.650 |
-2.452 |
CHCl3 |
Chloroform |
5.689 |
8.129 |
-2.440 |
H2Se |
Hydrogen selenide |
2.351 |
4.770 |
-2.419 |
C2H3Cl |
Ethene, chloro- |
4.006 |
6.410 |
-2.405 |
CH2CCl2 |
Ethene, 1,1-dichloro- |
5.437 |
7.830 |
-2.393 |
C6H6 |
Benzene |
7.576 |
9.959 |
-2.384 |
C6H10 |
1-Hexyne |
8.530 |
10.900 |
-2.370 |
CFCl3 |
Trichloromonofluoromethane |
5.882 |
8.249 |
-2.367 |
C4H5N |
Pyrrole |
5.575 |
7.940 |
-2.364 |
C10H16 |
adamantane |
13.567 |
15.930 |
-2.363 |
C7H16 |
heptane |
11.018 |
13.371 |
-2.353 |
CH3CHCl2 |
Ethane, 1,1-dichloro- |
5.810 |
8.161 |
-2.351 |
CH3CCl(CH3)CH3 |
Propane, 2-chloro-2-methyl- |
7.548 |
9.879 |
-2.331 |
C6H12 |
Cyclohexane |
8.676 |
11.000 |
-2.323 |
CHFCl2 |
fluorodichloromethane |
4.321 |
6.611 |
-2.290 |
C6H5NO2 |
Nitrobenzene |
9.997 |
12.259 |
-2.262 |
C6H10O |
cyclohexanone |
8.841 |
11.061 |
-2.220 |
C6H12 |
Cyclohexane |
8.795 |
11.000 |
-2.205 |
C6H14 |
Hexane |
9.436 |
11.630 |
-2.194 |
CCl2O |
Phosgene |
4.602 |
6.790 |
-2.188 |
C5H10 |
2-Pentene, (E)- |
7.657 |
9.839 |
-2.183 |
CH3CH2Cl |
Ethyl chloride |
4.412 |
6.590 |
-2.178 |
CH2CHCH2CH2CH3 |
1-pentene |
7.473 |
9.650 |
-2.177 |
C3H7OC3H7 |
di-n-propyl ether |
10.044 |
12.219 |
-2.175 |
C5H10O |
3-Pentanone |
7.760 |
9.930 |
-2.170 |
C3F8 |
perfluoropropane |
4.358 |
6.525 |
-2.166 |
C3H4N2 |
1H-Pyrazole |
5.064 |
7.230 |
-2.166 |
Cl2 |
Chlorine diatomic |
2.450 |
4.610 |
-2.160 |
C4H4O |
Furan |
5.086 |
7.230 |
-2.144 |
C5H10O |
2-Pentanone |
7.815 |
9.930 |
-2.115 |
C5H10O |
2-Pentanone |
7.815 |
9.930 |
-2.114 |
CH3SCH3 |
Dimethyl sulfide |
5.438 |
7.550 |
-2.112 |
C2H8N2 |
Ethylenediamine |
5.091 |
7.200 |
-2.109 |
PCl3 |
Phosphorus trichloride |
8.530 |
10.634 |
-2.103 |
CH3CH2CH2CN |
Butanenitrile |
6.298 |
8.400 |
-2.102 |
CHCCH2CH3 |
1-Butyne |
5.314 |
7.410 |
-2.096 |
C6H5CN |
phenyl cyanide |
9.889 |
11.981 |
-2.092 |
C5H12O |
Propane, 1-ethoxy- |
8.605 |
10.680 |
-2.074 |
CH3CH2SH |
ethanethiol |
5.324 |
7.380 |
-2.055 |
CH2CHCH2CH2CH3 |
1-pentene |
7.599 |
9.650 |
-2.051 |
N2O4 |
Dinitrogen tetroxide |
4.447 |
6.495 |
-2.048 |
C4H4S |
Thiophene |
6.970 |
9.010 |
-2.039 |
CH3CH2SH |
ethanethiol |
5.341 |
7.380 |
-2.039 |
C5H11N |
Piperidine |
8.283 |
10.320 |
-2.037 |
C3H7OC3H7 |
di-n-propyl ether |
10.183 |
12.219 |
-2.036 |
C2H4S |
Thiirane |
4.878 |
6.910 |
-2.032 |
CH3CH(NH2)CH3 |
2-Propanamine |
5.740 |
7.769 |
-2.029 |
P |
Phosphorus atom |
1.604 |
3.630 |
-2.026 |
C3H4N2 |
1H-Imidazole |
5.066 |
7.090 |
-2.024 |
C5H12 |
Pentane |
7.860 |
9.879 |
-2.020 |
CH2ClCH2Cl |
Ethane, 1,2-dichloro- |
5.985 |
8.000 |
-2.015 |
CF2Cl2 |
difluorodichloromethane |
4.355 |
6.370 |
-2.015 |
C5H8O |
Cyclopentanone |
7.264 |
9.250 |
-1.986 |
NH2CH2CH2CH3 |
1-Propanamine |
5.719 |
7.700 |
-1.980 |
C5H11N |
Piperidine |
8.354 |
10.320 |
-1.966 |
C4H6O2 |
2,3-Butanedione |
6.246 |
8.201 |
-1.954 |
C4H6O2 |
2,3-Butanedione |
6.247 |
8.201 |
-1.954 |
C4H6O2 |
2,3-Butanedione |
6.247 |
8.201 |
-1.954 |
C5H10 |
Cyclopentane |
7.231 |
9.170 |
-1.939 |
C4H2 |
Diacetylene |
4.874 |
6.811 |
-1.937 |
C3H8O2 |
Methane, dimethoxy- |
5.765 |
7.700 |
-1.934 |
CH3COCH2CH3 |
2-Butanone |
6.257 |
8.190 |
-1.933 |
CH3COCH2CH3 |
2-Butanone |
6.258 |
8.190 |
-1.932 |
CHOCHCHCH3 |
2-Butenal |
6.570 |
8.500 |
-1.930 |
BeH2 |
beryllium dihydride |
2.418 |
4.340 |
-1.922 |
AsH3 |
Arsine |
3.548 |
5.468 |
-1.920 |
Si2H6 |
disilane |
7.495 |
9.410 |
-1.915 |
C4H10O |
Methyl propyl ether |
6.958 |
8.860 |
-1.902 |
C3H5Cl |
1-Propene, 3-chloro- |
5.501 |
7.400 |
-1.899 |
C3H7NO |
dimethylformamide |
5.925 |
7.809 |
-1.884 |
C3H7NO |
dimethylformamide |
5.925 |
7.809 |
-1.884 |
CH2CHCHO |
Acrolein |
4.496 |
6.379 |
-1.883 |
CHOCH2CH2CH3 |
Butanal |
6.300 |
8.180 |
-1.880 |
CH2C(CH3)CH3 |
1-Propene, 2-methyl- |
6.001 |
7.880 |
-1.879 |
C5H9N |
Propanenitrile, 2,2-dimethyl- |
7.718 |
9.591 |
-1.872 |
CH3CCH |
propyne |
3.705 |
5.550 |
-1.845 |
OCS |
Carbonyl sulfide |
3.246 |
5.090 |
-1.844 |
CH2CHCH2CH3 |
1-Butene |
6.001 |
7.830 |
-1.829 |
CH3CCCH3 |
2-Butyne |
5.655 |
7.480 |
-1.825 |
C4H10O |
2-Butanol, (.+/-.)- |
6.746 |
8.570 |
-1.823 |
CH3CH(CH3)CN |
Propanenitrile, 2-methyl- |
6.230 |
8.049 |
-1.819 |
CH3CH2COOH |
Propanoic Acid |
5.149 |
6.960 |
-1.811 |
CF3Cl |
Methane, chlorotrifluoro- |
2.872 |
4.650 |
-1.778 |
CH3CH2CH2CH3 |
Butane |
6.254 |
8.020 |
-1.766 |
C4H10O |
1-Butanol |
6.805 |
8.570 |
-1.764 |
CH2CHCHO |
Acrolein |
4.624 |
6.379 |
-1.755 |
C4H10O |
1-Butanol |
6.820 |
8.570 |
-1.750 |
CH3CH(CH3)CH3 |
Isobutane |
6.260 |
8.009 |
-1.749 |
C3H8O3 |
1,2,3-Propanetriol |
6.110 |
7.860 |
-1.749 |
C4H4O2 |
2-Oxetanone, 4-methylene- |
6.255 |
8.000 |
-1.746 |
PF3 |
Phosphorus trifluoride |
2.678 |
4.414 |
-1.736 |
C2H5SC2H5 |
Diethyl sulfide |
8.816 |
10.549 |
-1.733 |
CH3CH2CH2CH3 |
Butane |
6.307 |
8.020 |
-1.713 |
C4H5N |
(E)-2-Butenenitrile |
6.491 |
8.201 |
-1.710 |
CH3CHCHCH3 |
2-Butene, (E)- |
6.172 |
7.880 |
-1.709 |
C2F6 |
hexafluoroethane |
2.965 |
4.668 |
-1.703 |
C3H8O2 |
Methane, dimethoxy- |
6.004 |
7.700 |
-1.696 |
C4H8O2 |
Ethyl acetate |
6.927 |
8.620 |
-1.693 |
C4H10O |
Ethoxy ethane |
7.040 |
8.730 |
-1.690 |
H2S |
Hydrogen sulfide |
1.947 |
3.631 |
-1.684 |
CH2CO |
Ketene |
2.725 |
4.400 |
-1.675 |
CH3Cl |
Methyl chloride |
2.747 |
4.416 |
-1.669 |
CH3CH2NH2 |
Ethylamine |
4.210 |
5.870 |
-1.660 |
CF3CHF2 |
pentafluoroethane |
3.022 |
4.623 |
-1.602 |
CH3CONH2 |
Acetamide |
4.071 |
5.670 |
-1.599 |
CH2FCl |
fluorochloromethane |
2.911 |
4.509 |
-1.598 |
SeF6 |
Selenium hexafluoride |
3.729 |
5.320 |
-1.591 |
CH3CH2CHO |
Propanal |
4.761 |
6.350 |
-1.588 |
C2H2 |
Acetylene |
1.901 |
3.487 |
-1.586 |
CH2CHCH3 |
Propene |
4.410 |
5.990 |
-1.580 |
HCl |
Hydrogen chloride |
0.938 |
2.515 |
-1.577 |
C3H7ONO |
Propyl nitrite |
6.944 |
8.500 |
-1.556 |
C4H8O2 |
1,4-Dioxane |
6.895 |
8.430 |
-1.535 |
HCOOC2H5 |
Ethyl formate |
5.347 |
6.880 |
-1.534 |
C2N2 |
Cyanogen |
3.482 |
5.015 |
-1.532 |
C2H5CN |
ethyl cyanide |
4.711 |
6.240 |
-1.529 |
CH3COOCH3 |
methyl acetate |
5.285 |
6.811 |
-1.525 |
C2H6O2 |
1,2-Ethanediol |
4.196 |
5.710 |
-1.514 |
CH3COCH3 |
Acetone |
4.776 |
6.270 |
-1.494 |
CH3COCH3 |
Acetone |
4.778 |
6.270 |
-1.492 |
CF3CH2F |
1,1,1,2-tetrafluoroethane |
3.060 |
4.549 |
-1.489 |
CH3COOH |
Acetic acid |
3.661 |
5.149 |
-1.488 |
CHF2Cl |
difluorochloromethane |
2.954 |
4.440 |
-1.485 |
CH3SH |
Methanethiol |
3.705 |
5.186 |
-1.482 |
GeF4 |
Germanium tetrafluoride |
2.574 |
4.050 |
-1.476 |
CH2CCH2 |
allene |
4.221 |
5.690 |
-1.469 |
C3H6 |
Cyclopropane |
4.178 |
5.640 |
-1.462 |
C3F6 |
hexafluoropropene |
4.381 |
5.838 |
-1.457 |
CHONH2 |
formamide |
2.627 |
4.080 |
-1.452 |
CHONH2 |
formamide |
2.628 |
4.080 |
-1.451 |
C2H4 |
Ethylene |
2.739 |
4.188 |
-1.449 |
As4 |
Arsenic tetramer |
15.857 |
17.293 |
-1.436 |
C3H6O3 |
1,3,5-Trioxane |
5.590 |
7.020 |
-1.430 |
CH3SOCH3 |
Dimethyl sulfoxide |
6.545 |
7.969 |
-1.425 |
N2H4 |
Hydrazine |
2.036 |
3.460 |
-1.424 |
SiH4 |
Silane |
3.354 |
4.777 |
-1.424 |
C3H7OH |
1-Propanol |
5.255 |
6.670 |
-1.415 |
O3 |
Ozone |
1.665 |
3.079 |
-1.414 |
CH3CHOHCH3 |
Isopropyl alcohol |
5.263 |
6.670 |
-1.407 |
C3H7OH |
1-Propanol |
5.272 |
6.670 |
-1.397 |
CH3NO2 |
Methane, nitro- |
3.409 |
4.800 |
-1.391 |
C3H7ONO |
Propyl nitrite |
7.135 |
8.500 |
-1.365 |
CH3OCH3 |
Dimethyl ether |
3.804 |
5.160 |
-1.355 |
C6F6 |
hexafluorobenzene |
8.225 |
9.580 |
-1.355 |
CH3CF3 |
Ethane, 1,1,1-trifluoro- |
3.048 |
4.400 |
-1.352 |
CH3CH2OH |
Ethanol |
3.766 |
5.112 |
-1.346 |
CH3OCHO |
methyl formate |
3.713 |
5.050 |
-1.337 |
C2H6O2S |
Dimethyl sulfone |
7.076 |
8.401 |
-1.325 |
CF4 |
Carbon tetrafluoride |
1.554 |
2.824 |
-1.270 |
NO2 |
Nitrogen dioxide |
1.640 |
2.910 |
-1.270 |
N(CH3)3 |
Trimethylamine |
5.832 |
7.076 |
-1.244 |
N2O |
Nitrous oxide |
1.779 |
2.998 |
-1.219 |
CH3COCH3 |
Acetone |
5.055 |
6.270 |
-1.214 |
C2H4O |
Ethylene oxide |
3.235 |
4.431 |
-1.195 |
PH3 |
Phosphine |
3.050 |
4.237 |
-1.186 |
SO2 |
Sulfur dioxide |
2.698 |
3.882 |
-1.185 |
CH3NHCH3 |
Dimethylamine |
4.266 |
5.447 |
-1.181 |
CHF3 |
Methane, trifluoro- |
1.629 |
2.801 |
-1.172 |
GeH4 |
Germane |
3.610 |
4.770 |
-1.160 |
HCOOH |
Formic acid |
2.164 |
3.319 |
-1.156 |
C3H8 |
Propane |
4.774 |
5.921 |
-1.147 |
C3H2N2 |
Malononitrile |
4.649 |
5.790 |
-1.140 |
C5H8 |
Spiropentane |
6.924 |
8.049 |
-1.125 |
CH3CN |
Acetonitrile |
3.161 |
4.280 |
-1.118 |
CH3NH2 |
methyl amine |
2.649 |
3.754 |
-1.105 |
HCOOH |
Formic acid |
2.225 |
3.319 |
-1.095 |
NH3 |
Ammonia |
1.008 |
2.103 |
-1.094 |
SiF4 |
Silicon tetrafluoride |
2.236 |
3.319 |
-1.084 |
CH2F2 |
Methane, difluoro- |
1.699 |
2.761 |
-1.062 |
HCN |
Hydrogen cyanide |
1.546 |
2.593 |
-1.047 |
C2H6 |
Ethane |
3.194 |
4.226 |
-1.032 |
H2CO |
Formaldehyde |
1.756 |
2.770 |
-1.014 |
C5H12 |
Butane, 2-methyl- |
7.762 |
8.770 |
-1.008 |
NF3 |
Nitrogen trifluoride |
1.808 |
2.810 |
-1.002 |
CH3OH |
Methyl alcohol |
2.209 |
3.210 |
-1.001 |
BF3 |
Borane, trifluoro- |
1.421 |
2.420 |
-0.999 |
B2H6 |
Diborane |
4.129 |
5.115 |
-0.986 |
F2SO |
Thionyl Fluoride |
2.941 |
3.927 |
-0.986 |
C2H6 |
Ethane |
3.260 |
4.226 |
-0.966 |
CH3CHO |
Acetaldehyde |
3.317 |
4.278 |
-0.962 |
CO2 |
Carbon dioxide |
1.576 |
2.507 |
-0.931 |
PF5 |
Phosphorus pentafluoride |
2.729 |
3.650 |
-0.921 |
C2H5F |
fluoroethane |
3.256 |
4.164 |
-0.908 |
SF6 |
Sulfur Hexafluoride |
3.587 |
4.490 |
-0.903 |
H2O |
Water |
0.639 |
1.501 |
-0.862 |
FCN |
Cyanogen fluoride |
1.724 |
2.550 |
-0.826 |
NO |
Nitric oxide |
0.895 |
1.698 |
-0.803 |
CH3F |
Methyl fluoride |
1.742 |
2.540 |
-0.798 |
O2 |
Oxygen diatomic |
0.799 |
1.562 |
-0.763 |
SO3 |
Sulfur trioxide |
3.564 |
4.297 |
-0.734 |
CH4 |
Methane |
1.735 |
2.448 |
-0.713 |
F2 |
Fluorine diatomic |
0.476 |
1.160 |
-0.685 |
CO |
Carbon monoxide |
1.269 |
1.953 |
-0.684 |
N2 |
Nitrogen diatomic |
1.037 |
1.710 |
-0.673 |
B3N3H6 |
borazine |
7.357 |
8.000 |
-0.643 |
HF |
Hydrogen fluoride |
0.260 |
0.800 |
-0.540 |
CO |
Carbon monoxide |
1.529 |
1.953 |
-0.424 |
P4 |
Phosphorus tetramer |
13.219 |
13.589 |
-0.370 |
C10H8 |
Azulene |
15.296 |
15.520 |
-0.224 |
C10H8 |
Azulene |
15.296 |
15.520 |
-0.224 |
N2 |
Nitrogen diatomic |
4.015 |
1.710 |
2.305 |
MgO |
magnesium oxide |
7.261 |
1.750 |
5.511 |
CaO |
Calcium monoxide |
13.285 |
2.841 |
10.444 |
K |
Potassium atom |
74.731 |
43.400 |
31.331 |