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 | ||||||||||||||||||||||||||||||||||||||||
-0.025 | -0.020 | -0.015 | -0.010 | -0.005 | 0.000 | 0.005 | 0.010 | 0.015 | 0.020 | 0.025 | 0.030 | 0.035 | ||||||||||||||||||||||||||||
bond length difference calc. - exp. (Å) |
Species | Name | Difference (Å) | |
---|---|---|---|
Most negative difference | SO2Cl2 | Sulfuryl chloride | -0.024 |
Most positive difference | H2SO4 | Sulfuric acid | 0.011 |
Bond lengths
Click on entry for experimental details.
Species | Name | Experimental (Å) | Difference (Å) |
---|---|---|---|
SO2Cl2 | Sulfuryl chloride | 1.443 | -0.024 |
SOCl2 | thionyl chloride | 1.443 | -0.006 |
H2SO4 | Sulfuric acid | 1.422 | -0.002 |
CH3SOCH3 | Dimethyl sulfoxide | 1.485 | -0.002 |
HOSH | hydrogen thioperoxide | 1.662 | -0.002 |
SSO | Disulfur monoxide | 1.456 | 0.000 |
SO2 | Sulfur dioxide | 1.432 | 0.003 |
SO | Sulfur monoxide | 1.481 | 0.005 |
SOF4 | Sulfur tetrafluoride oxide | 1.409 | 0.005 |
SO3 | Sulfur trioxide | 1.418 | 0.007 |
C2H6O2S | Dimethyl sulfone | 1.431 | 0.009 |
H2SO4 | Sulfuric acid | 1.574 | 0.011 |