Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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M06-2X/3-21G
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1.60 | 1.65 | 1.70 | 1.75 | 1.80 | 1.85 | 1.90 | 1.95 | ||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.667 | 0.048 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SF+ | sulfur monofluoride cation | 1.610 |
Highest value | SF2- | sulfur difluoride anion | 1.866 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SF | Monosulfur monofluoride | 1.680 | 1 | 2 |
SF+ | sulfur monofluoride cation | 1.610 | 1 | 2 |
SF2- | sulfur difluoride anion | 1.866 | 1 | 2 |
1.866 | 1 | 3 | ||
SF2 | sulfur difluoride | 1.677 | 1 | 2 |
1.677 | 1 | 3 | ||
FSN | Thiazyl fluoride | 1.718 | 1 | 3 |
SFCl | Sulfur chloride fluoride | 1.682 | 1 | 2 |
F2SO | Thionyl Fluoride | 1.672 | 1 | 3 |
1.672 | 1 | 4 | ||
SF3 | Sulfur trifluoride | 1.663 | 1 | 2 |
1.731 | 1 | 3 | ||
1.731 | 1 | 4 | ||
SO2F2 | Sulfuryl fluoride | 1.642 | 1 | 4 |
1.642 | 1 | 5 | ||
SF4 | Sulfur tetrafluoride | 1.700 | 1 | 2 |
1.700 | 1 | 3 | ||
1.651 | 1 | 4 | ||
1.651 | 1 | 5 | ||
SF5 | Sulfur pentafluoride | 1.627 | 1 | 2 |
1.691 | 1 | 3 | ||
1.691 | 1 | 4 | ||
1.691 | 1 | 5 | ||
1.691 | 1 | 6 | ||
SF5+ | pentafluoro sulfur cation | 1.632 | 1 | 2 |
1.614 | 1 | 3 | ||
1.614 | 1 | 4 | ||
1.614 | 1 | 5 | ||
1.632 | 1 | 6 | ||
SOF4 | Sulfur tetrafluoride oxide | 1.666 | 1 | 3 |
1.666 | 1 | 4 | ||
1.642 | 1 | 5 | ||
1.642 | 1 | 6 | ||
SF6 | Sulfur Hexafluoride | 1.639 | 1 | 2 |
1.639 | 1 | 3 | ||
1.639 | 1 | 4 | ||
1.639 | 1 | 5 | ||
1.639 | 1 | 6 | ||
1.639 | 1 | 7 | ||
SF5Cl | sulfur chloropentafluoride | 1.654 | 1 | 3 |
1.654 | 1 | 4 | ||
1.654 | 1 | 5 | ||
1.654 | 1 | 6 | ||
1.637 | 1 | 7 | ||
S2F10 | disulphur decafluoride | 1.663 | 1 | 3 |
1.663 | 1 | 4 | ||
1.663 | 1 | 5 | ||
1.663 | 1 | 6 | ||
1.631 | 1 | 7 | ||
1.663 | 2 | 8 | ||
1.663 | 2 | 9 | ||
1.663 | 2 | 10 | ||
1.663 | 2 | 11 | ||
1.631 | 2 | 12 |