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 |
---|---|
C2H2O2+ | Ethanedial cation |
description | Value | Reference | Comment | Atom number | |||
---|---|---|---|---|---|---|---|
rCC | 1.526 | 1998Kuc | rg values | 1 | 2 | ||
rCO | 1.212 | 1998Kuc | 1 | 5 | |||
rCH | 1.132 | rg value | 1 | 3 | |||
aCCO | 121.2 | 1998Kuc | 1 | 2 | 6 | ||
aHCC | 112.2 | 1998Kuc | 1 | 2 | 4 |
squib | reference |
---|---|
1998Kuc | K Kuchitsu(ed) "Structure of Free Polyatomic Molecules - Basic Data" Springer, Berlin, 1998 |