Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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0 | ||||||||||||||||||||||||||||||||||||||||
-0.012 | -0.010 | -0.008 | -0.006 | -0.004 | -0.002 | 0.000 | 0.002 | 0.004 | 0.006 | 0.008 | 0.010 | 0.012 | ||||||||||||||||||||||||||||
bond length difference calc. - exp. (Å) |
Species | Name | Difference (Å) | |
---|---|---|---|
Most negative difference | CF2Cl2 | difluorodichloromethane | -0.012 |
Most positive difference | CH2F2 | Methane, difluoro- | 0.010 |
Bond lengths
Click on entry for experimental details.
Species | Name | Experimental (Å) | Difference (Å) |
---|---|---|---|
CF2Cl2 | difluorodichloromethane | 1.345 | -0.012 |
CH2FCl | fluorochloromethane | 1.370 | -0.008 |
CHF2Cl | difluorochloromethane | 1.350 | -0.008 |
CFCl3 | Trichloromonofluoromethane | 1.345 | -0.007 |
CF3Cl | Methane, chlorotrifluoro- | 1.325 | 0.004 |
CH2F2 | Methane, difluoro- | 1.351 | 0.010 |