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 | ||||||||||||||||||||||||||||||||||||||||
-0.015 | -0.010 | -0.005 | 0.000 | 0.005 | 0.010 | 0.015 | 0.020 | 0.025 | 0.030 | 0.035 | 0.040 | 0.045 | ||||||||||||||||||||||||||||
bond length difference calc. - exp. (Å) |
Species | Name | Difference (Å) | |
---|---|---|---|
Most negative difference | NO | Nitric oxide | -0.012 |
Most positive difference | HNO | Nitrosyl hydride | 0.023 |
Bond lengths
Click on entry for experimental details.
Species | Name | Experimental (Å) | Difference (Å) |
---|---|---|---|
NO | Nitric oxide | 1.154 | -0.012 |
C2H2N2O | Furazan | 1.373 | 0.001 |
NH2OH | hydroxylamine | 1.453 | 0.002 |
FNO | Nitrosyl fluoride | 1.136 | 0.005 |
N2O | Nitrous oxide | 1.184 | 0.007 |
HCNO | fulminic acid | 1.199 | 0.007 |
ClNO | Nitrosyl chloride | 1.139 | 0.007 |
HNO3 | Nitric acid | 1.406 | 0.010 |
HNO3 | Nitric acid | 1.211 | 0.011 |
HNO3 | Nitric acid | 1.199 | 0.013 |
NO2 | Nitrogen dioxide | 1.193 | 0.018 |
NO- | nitric oxide anion | 1.258 | 0.018 |
HNO | Nitrosyl hydride | 1.209 | 0.023 |