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/6-311G**
5 | |||||||||||||||||||||||||||||||
4 | |||||||||||||||||||||||||||||||
3 | |||||||||||||||||||||||||||||||
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1 | |||||||||||||||||||||||||||||||
0 | |||||||||||||||||||||||||||||||
1.33 | 1.33 | 1.33 | 1.33 | 1.33 | 1.34 | 1.34 | 1.34 | 1.34 | 1.34 | ||||||||||||||||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.332 | 0.006 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | BeH2 | beryllium dihydride | 1.328 |
Highest value | BeH | beryllium monohydride | 1.342 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
BeH | beryllium monohydride | 1.342 | 1 | 2 |
BeH2 | beryllium dihydride | 1.328 | 1 | 2 |
1.328 | 1 | 3 |