Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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MP3=FULL/3-21G
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0 | ||||||||||||||||||||||||||||||||||||||||
1.62 | 1.63 | 1.64 | 1.65 | 1.66 | 1.67 | 1.68 | 1.69 | 1.70 | 1.71 | 1.72 | 1.73 | 1.74 | ||||||||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.664 | 0.026 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SF5+ | pentafluoro sulfur cation | 1.626 |
Highest value | FSN | Thiazyl fluoride | 1.735 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SF2 | sulfur difluoride | 1.691 | 1 | 2 |
1.691 | 1 | 3 | ||
FSN | Thiazyl fluoride | 1.735 | 1 | 3 |
SFCl | Sulfur chloride fluoride | 1.701 | 1 | 2 |
SF4 | Sulfur tetrafluoride | 1.708 | 1 | 2 |
1.708 | 1 | 3 | ||
1.658 | 1 | 4 | ||
1.658 | 1 | 5 | ||
SF5+ | pentafluoro sulfur cation | 1.643 | 1 | 2 |
1.626 | 1 | 3 | ||
1.626 | 1 | 4 | ||
1.626 | 1 | 5 | ||
1.643 | 1 | 6 | ||
SOF4 | Sulfur tetrafluoride oxide | 1.672 | 1 | 3 |
1.672 | 1 | 4 | ||
1.650 | 1 | 5 | ||
1.650 | 1 | 6 | ||
SF6 | Sulfur Hexafluoride | 1.646 | 1 | 2 |
1.646 | 1 | 3 | ||
1.646 | 1 | 4 | ||
1.646 | 1 | 5 | ||
1.646 | 1 | 6 | ||
1.646 | 1 | 7 | ||
S2F10 | disulphur decafluoride | 1.675 | 1 | 3 |
1.675 | 1 | 4 | ||
1.675 | 1 | 5 | ||
1.675 | 1 | 6 | ||
1.637 | 1 | 7 | ||
1.675 | 2 | 8 | ||
1.675 | 2 | 9 | ||
1.675 | 2 | 10 | ||
1.675 | 2 | 11 | ||
1.637 | 2 | 12 |