Grouptheoretical Analysis




Composition Input Structure


Atomic
Number
Atomic
Symbol
Isotope Isotope
Mass
Isotope
Abundance
Number
Atoms
Mass
1H11.007899.98441010.0783
6C1212.000098.900010120.0000
26Fe5655.934991.7540155.9349
Total21 186.0132
Isotopomer Natural Abundance (%)82.0182


Determined Point Group: D5d








Representation ΓN


Characters of reducible representation
E 2C5 2(C5)2 5C'2 i 2(S10)3 2S10 d
21 1.000 1.000 1 1 1.000 1.000 5

Direct sum of irreducible representation
A1g A2g E1g E2g A1u A2u E1u E2u
3 0 2 2 0 2 2 2



Representation Γ3N


Characters of reducible representation
E 2C5 2(C5)2 5C'2 i 2(S10)3 2S10 d
63 1.618 -0.618 -1 -3 -1.618 0.618 5

Direct sum of irreducible representation
A1g A2g E1g E2g A1u A2u E1u E2u
4 2 6 6 2 5 7 6

Molecular motions and force field analysis



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