Grouptheoretical Analysis




Composition Input Structure


Atomic
Number
Atomic
Symbol
Isotope Isotope
Mass
Isotope
Abundance
Number
Atoms
Mass
1H11.007899.98443636.2817
6C1212.000098.900036432.0000
7N1414.003199.634024336.0738
8O1615.994999.762012191.9390
Total108 996.2945
Isotopomer Natural Abundance (%)59.4279


Determined Point Group: D6h








Representation ΓN


Characters of reducible representation
E 2C6 2C3 C2 3C'2 3C''2 i 2S3 2S6 σh d v
108 0 0 0 0 0 0 0 0 24 12 8

Direct sum of irreducible representation
A1g A2g B1g B2g E1g E2g A1u A2u B1u B2u E1u E2u
8 3 4 3 7 11 1 6 5 6 11 7



Representation Γ3N


Characters of reducible representation
E 2C6 2C3 C2 3C'2 3C''2 i 2S3 2S6 σh d v
324 0 0 0 0 0 0 0 0 24 12 8

Direct sum of irreducible representation
A1g A2g B1g B2g E1g E2g A1u A2u B1u B2u E1u E2u
17 12 13 12 25 29 10 15 14 15 29 25

Molecular motions and force field analysis



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