Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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MP2/cc-pV(T+d)Z
10 | ||||||||||||||||||||||||||||||||||||||||
8 | ||||||||||||||||||||||||||||||||||||||||
6 | ||||||||||||||||||||||||||||||||||||||||
4 | ||||||||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
1.68 | 1.70 | 1.72 | 1.74 | 1.76 | 1.78 | 1.80 | 1.82 | 1.84 | 1.86 | 1.88 | 1.90 | 1.92 | ||||||||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.864 | 0.053 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | SiC | silicon monocarbide | 1.690 |
Highest value | SiH3CCl3 | (trichloromethyl)silane | 1.913 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
SiC | silicon monocarbide | 1.690 | 1 | 2 |
CH3SiH3 | methyl silane | 1.874 | 1 | 2 |
SiH2(CH3)2 | dimethylsilane | 1.875 | 1 | 4 |
1.875 | 1 | 5 | ||
SiH(CH3)3 | trimethylsilane | 1.877 | 1 | 3 |
1.877 | 1 | 4 | ||
1.877 | 1 | 5 | ||
SiH3CCl3 | (trichloromethyl)silane | 1.913 | 1 | 2 |
Si(CH3)4 | tetramethylsilane | 1.879 | 1 | 2 |
1.879 | 1 | 3 | ||
1.879 | 1 | 4 | ||
1.879 | 1 | 5 |