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/6-311+G(3df,2p)
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0 | ||||||||||||||||||||||||||||||||||
1.53 | 1.54 | 1.55 | 1.56 | 1.57 | 1.58 | 1.59 | 1.60 | 1.61 | 1.62 | 1.63 | ||||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.580 | 0.026 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SiF2+ | Silicon difluoride cation | 1.533 |
Highest value | HSiF | fluorosilylene | 1.616 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
HSiF | fluorosilylene | 1.616 | 1 | 2 |
SiH3F | monofluorosilane | 1.602 | 1 | 2 |
SiF2 | Silicon difluoride | 1.603 | 1 | 2 |
1.603 | 1 | 3 | ||
SiF2+ | Silicon difluoride cation | 1.533 | 1 | 2 |
1.533 | 1 | 3 | ||
SiH2F2 | difluorosilane | 1.587 | 1 | 2 |
1.587 | 1 | 3 | ||
SiHF3 | trifluorosilane | 1.573 | 1 | 3 |
1.573 | 1 | 4 | ||
1.573 | 1 | 5 |