Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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Species | Name |
---|---|
H2NCH2COOH | Glycine |
description | Value | Reference | Comment | Atom number | |||
---|---|---|---|---|---|---|---|
rCN | 1.469 | 1995Kuchitsu(II/23) | 4 | 5 | |||
rCC | 1.532 | 1995Kuchitsu(II/23) | 1 | 4 | |||
rCO | 1.207 | 1995Kuchitsu(II/23) | 1 | 2 | |||
rCO | 1.357 | 1995Kuchitsu(II/23) | 1 | 3 | |||
rOH | 0.974 | 1995Kuchitsu(II/23) | !assumed | 3 | 6 | ||
rNH | 1.014 | 1995Kuchitsu(II/23) | !assumed | 5 | 9 | ||
rCH | 1.096 | 1995Kuchitsu(II/23) | !assumed | 4 | 7 | ||
aCCN | 113.0 | 1995Kuchitsu(II/23) | 1 | 4 | 5 | ||
aCCO | 125.0 | 1995Kuchitsu(II/23) | 2 | 1 | 4 | ||
aCCO | 111.5 | 1995Kuchitsu(II/23) | 3 | 1 | 4 | ||
aHOC | 110.5 | 1995Kuchitsu(II/23) | 1 | 3 | 6 | ||
aHNC | 113.3 | 1995Kuchitsu(II/23) | !assumed | 4 | 5 | 9 | |
aHNH | 110.3 | 1995Kuchitsu(II/23) | !assumed | 9 | 5 | 10 | |
aHCH | 107.0 | 1995Kuchitsu(II/23) | !assumed | 7 | 4 | 8 |
squib | reference |
---|---|
1995Kuchitsu(II/23) | Kuchitsu (ed.), Landolt-Bornstein: Group II: Molecules and Radicals Volume 23: Structure Data for Free Polyatomic Molecules. Springer. Berlin. 1995 |