Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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MP4=FULL/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 |
---|---|
1.697 | 0.053 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SF5+ | pentafluoro sulfur cation | 1.641 |
Highest value | SF2- | sulfur difluoride anion | 1.883 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SF | Monosulfur monofluoride | 1.706 | 1 | 2 |
SF2- | sulfur difluoride anion | 1.883 | 1 | 2 |
1.883 | 1 | 3 | ||
SF2 | sulfur difluoride | 1.705 | 1 | 2 |
1.705 | 1 | 3 | ||
FSN | Thiazyl fluoride | 1.794 | 1 | 3 |
SFCl | Sulfur chloride fluoride | 1.713 | 1 | 2 |
F2SO | Thionyl Fluoride | 1.737 | 1 | 3 |
1.737 | 1 | 4 | ||
SF3 | Sulfur trifluoride | 1.681 | 1 | 2 |
1.723 | 1 | 3 | ||
1.723 | 1 | 4 | ||
SF4 | Sulfur tetrafluoride | 1.729 | 1 | 2 |
1.729 | 1 | 3 | ||
1.672 | 1 | 4 | ||
1.672 | 1 | 5 | ||
SF5 | Sulfur pentafluoride | 1.644 | 1 | 2 |
1.708 | 1 | 3 | ||
1.708 | 1 | 4 | ||
1.708 | 1 | 5 | ||
1.708 | 1 | 6 | ||
SF5+ | pentafluoro sulfur cation | 1.658 | 1 | 2 |
1.641 | 1 | 3 | ||
1.641 | 1 | 4 | ||
1.641 | 1 | 5 | ||
1.658 | 1 | 6 | ||
SOF4 | Sulfur tetrafluoride oxide | 1.696 | 1 | 3 |
1.696 | 1 | 4 | ||
1.672 | 1 | 5 | ||
1.672 | 1 | 6 | ||
SF6 | Sulfur Hexafluoride | 1.659 | 1 | 2 |
1.659 | 1 | 3 | ||
1.659 | 1 | 4 | ||
1.659 | 1 | 5 | ||
1.659 | 1 | 6 | ||
1.659 | 1 | 7 | ||
SF5Cl | sulfur chloropentafluoride | 1.680 | 1 | 3 |
1.680 | 1 | 4 | ||
1.680 | 1 | 5 | ||
1.680 | 1 | 6 | ||
1.655 | 1 | 7 |