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 |
---|---|---|---|---|
aON=O | FNO3 | Fluorine nitrate | 108.40 | |
aON=O | HNO2 | Nitrous acid | 110.60 | |
aONO | C2H5NO3 | Nitric acid, ethyl ester | 111.00 | |
aON=O | CH3CH(CH3)ONO | Isopropyl nitrite | 111.20 | |
aON=O | CH3NO3 | Methyl nitrate | 112.38 | |
aON=O | HNO3 | Nitric acid | 113.85 | |
aON=O | CH3ONO | Methyl nitrite | 114.80 | cis structure |
aON=O | HNO3 | Nitric acid | 115.09 | |
aON=O | FNO3 | Fluorine nitrate | 117.10 | |
aONO | C2H5NO3 | Nitric acid, ethyl ester | 118.00 | |
aON=O | CH3NO3 | Methyl nitrate | 118.10 | |
aONO | NO3 | Nitrogen trioxide | 120.00 | |
aO=N=O | CH3NO2 | Methane, nitro- | 125.30 | |
aO=N=O | C6H5NO2 | Nitrobenzene | 125.30 | |
aO=N=O | CH3NO3 | Methyl nitrate | 129.52 | |
aO=N=O | N2O3 | Dinitrogen trioxide | 129.82 | |
aO=N=O | HNO3 | Nitric acid | 130.27 | |
aO=N=O | C2H6N2O2 | Dimethylnitroamine | 130.40 | |
aO=N=O | ClNO2 | Nitryl chloride | 130.60 | |
aO=N=O | NO2 | Nitrogen dioxide | 134.10 | |
aO=N=O | FNO3 | Fluorine nitrate | 134.50 | |
aO=N=O | N2O4 | Dinitrogen tetroxide | 135.40 | |
aON=O | FNO2 | Nitryl fluoride | 136.00 | |
Average | 122.25 | ±9.29 | ||
Min | 108.40 | |||
Max | 136.00 |