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 |
---|---|
C7H12 | Norbornane |
description | Value | Reference | Comment | Atom number | |||
---|---|---|---|---|---|---|---|
rCC | 1.536 | 1987Kuchitsu(II/15) | 2 | 4 | |||
rCC | 1.573 | 1987Kuchitsu(II/15) | 4 | 7 | |||
rCC | 1.546 | 1987Kuchitsu(II/15) | 1 | 2 | |||
rCH | 1.113 | 1987Kuchitsu(II/15) | average C-H | 1 | 8 | ||
aCCC | 102.0 | 1987Kuchitsu(II/15) | 1 | 2 | 4 | ||
aCCC | 93.4 | 1987Kuchitsu(II/15) | 2 | 1 | 3 | ||
aCCC | 102.7 | 1987Kuchitsu(II/15) | 2 | 4 | 7 | ||
aCCC | 109.0 | 1987Kuchitsu(II/15) | 4 | 2 | 5 | ||
dCCCC | 35.8 | 1987Kuchitsu(II/15) | 1 | 2 | 5 | 6 | |
dCCCC | 56.3 | 1987Kuchitsu(II/15) | 2 | 1 | 3 | 6 | |
dCCCC | 71.6 | 1987Kuchitsu(II/15) | 4 | 2 | 5 | 6 |
squib | reference |
---|---|
1987Kuchitsu(II/15) | Kuchitsu (ed.), Landolt-Bornstein: Group II: Atomic and Molecular Physics Volume 15: Structure Data of Free Polyatomic Molecules. Springer-Verlag, Berlin, 1987. |