Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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B1B95/cc-pV(T+d)Z
5 | |||||||||||||||||||||||||||||||
4 | |||||||||||||||||||||||||||||||
3 | |||||||||||||||||||||||||||||||
2 | |||||||||||||||||||||||||||||||
1 | |||||||||||||||||||||||||||||||
0 | |||||||||||||||||||||||||||||||
1.52 | 1.54 | 1.56 | 1.58 | 1.60 | 1.62 | 1.64 | 1.66 | 1.68 | 1.70 | ||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.621 | 0.040 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SiF+ | silicon monofluoride cation | 1.535 |
Highest value | SiF5- | silicon pentafluoride anion | 1.662 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SiF | silicon monofluoride | 1.609 | 1 | 2 |
SiF+ | silicon monofluoride cation | 1.535 | 1 | 2 |
SiF5- | silicon pentafluoride anion | 1.662 | 1 | 2 |
1.625 | 1 | 3 | ||
1.625 | 1 | 4 | ||
1.625 | 1 | 5 | ||
1.662 | 1 | 6 |