Grouptheoretical Analysis




Composition Input Structure


Atomic
Number
Atomic
Symbol
Isotope Isotope
Mass
Isotope
Abundance
Number
Atoms
Mass
1H11.007899.98442424.1878
6C1212.000098.900024288.0000
Total48 312.1878
Isotopomer Natural Abundance (%)76.3985


Determined Point Group: D6h








Representation ΓN


Characters of reducible representation
E 2C6 2C3 C2 3C'2 3C''2 i 2S3 2S6 σh d v
48 0 0 0 0 0 0 0 0 0 0 8

Direct sum of irreducible representation
A1g A2g B1g B2g E1g E2g A1u A2u B1u B2u E1u E2u
3 1 1 3 4 4 1 3 3 1 4 4



Representation Γ3N


Characters of reducible representation
E 2C6 2C3 C2 3C'2 3C''2 i 2S3 2S6 σh d v
144 0 0 0 0 0 0 0 0 0 0 8

Direct sum of irreducible representation
A1g A2g B1g B2g E1g E2g A1u A2u B1u B2u E1u E2u
7 5 5 7 12 12 5 7 7 5 12 12

Molecular motions and force field analysis



Last update July, 8th 2020 by A. Gelessus, Impressum, Datenschutzerklärung/DataPrivacyStatement