Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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TPSSh/aug-cc-pV(T+d)Z
5 | ||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||
3 | ||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||
1 | ||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||
1.58 | 1.58 | 1.59 | 1.59 | 1.60 | 1.60 | 1.61 | 1.61 | 1.62 | ||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.594 | 0.010 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SF5Cl | sulfur chloropentafluoride | 1.581 |
Highest value | SF | Monosulfur monofluoride | 1.610 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SF | Monosulfur monofluoride | 1.610 | 1 | 2 |
SF2 | sulfur difluoride | 1.605 | 1 | 2 |
1.605 | 1 | 3 | ||
SF5Cl | sulfur chloropentafluoride | 1.587 | 1 | 3 |
1.587 | 1 | 4 | ||
1.587 | 1 | 5 | ||
1.587 | 1 | 6 | ||
1.581 | 1 | 7 |