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Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
| You are here: Calculated > Geometry > Calculated geometry > One type of bond | |
B1B95/6-31+G**
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| 1.34 | 1.36 | 1.38 | 1.40 | 1.42 | 1.44 | 1.46 | 1.48 | 1.50 | 1.52 | 1.54 | ||||||||||||||||||||||||
| bond lengths (Å) | ||||||||||||||||||||||||||||||||||
| Average bond length | Standard deviation |
|---|---|
| 1.429 | 0.044 |
| Species | Name | Bond Length (Å) | |
|---|---|---|---|
| Lowest value | FO | Oxygen monofluoride | 1.346 |
| Highest value | FO- | flourine oxide anion | 1.504 |
| Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
|---|---|---|---|---|
| FO- | flourine oxide anion | 1.504 | 1 | 2 |
| FO | Oxygen monofluoride | 1.346 | 1 | 2 |
| HOF | Hypofluorous acid | 1.419 | 1 | 3 |
| F2O | Difluorine monoxide | 1.397 | 1 | 2 |
| 1.397 | 1 | 3 | ||
| FOO+ | Fluorine dioxide cation | 1.437 | 2 | 3 |
| ClOF | Chlorine hypofluorite | 1.424 | 2 | 3 |
| FOOF | Perfluoroperoxide | 1.489 | 3 | 4 |
| 1.489 | 1 | 2 | ||
| FONO | Nitrosyl hypofluorite | 1.434 | 1 | 2 |
| FNO3 | Fluorine nitrate | 1.398 | 2 | 5 |
| CF3OF | Trifluoromethylhypofluorite | 1.412 | 2 | 3 |