Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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Bond type | Species | Name | Angle | Comment |
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aCSO | CH3SOCH3 | Dimethyl sulfoxide | 106.50 | |
aCS=O | C2H6O2S | Dimethyl sulfone | 107.80 | by symmetry |
Average | 107.15 | ±0.92 | ||
Min | 106.50 | |||
Max | 107.80 |