Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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10 | ||||||||||||||||||||||||||||||||||||||||
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4 | ||||||||||||||||||||||||||||||||||||||||
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0 | ||||||||||||||||||||||||||||||||||||||||
-0.060 | -0.055 | -0.050 | -0.045 | -0.040 | -0.035 | -0.030 | -0.025 | -0.020 | -0.015 | -0.010 | -0.005 | 0.000 | ||||||||||||||||||||||||||||
bond length difference calc. - exp. (Å) |
Species | Name | Difference (Å) | |
---|---|---|---|
Most negative difference | BrF5 | bromine pentafluoride | -0.060 |
Most positive difference | BrF5 | bromine pentafluoride | -0.035 |
Bond lengths
Click on entry for experimental details.
Species | Name | Experimental (Å) | Difference (Å) |
---|---|---|---|
BrF5 | bromine pentafluoride | 1.774 | -0.060 |
BrF3 | Bromine trifluoride | 1.721 | -0.050 |
BrF3 | Bromine trifluoride | 1.810 | -0.039 |
BrF | Bromine monofluoride | 1.759 | -0.038 |
BrF5 | bromine pentafluoride | 1.689 | -0.035 |