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vibrations frequencies details

The vibration of the carbonic acid molecule is composed of 12 normal modes. Four modes are stretching the molecule along the O-H bonds, along the C=O double bond, and along the C-O single bond. The stretching mode ν9(B2) is antisymmetric with respect to the σv reflection plane. The stretching modes ν1(A1), ν2(A1), ν4(A1) are symmetric with respect to the σv reflection plane. The other 8 modes describe angular deformations. The deformation modes ν10(B2), ν11(B2), ν12(B2), and ν6(A2) are antisymmetric with respect to the σv reflection plane. The deformation modes ν3(A1), ν7(B1), ν8(B1), and ν5(A1) are symmetric with respect to the σv reflection plane.

pg1 Carbonic acid is in the C2v point group with three symmetry elements: C2 proper rotation axis (black), σv' and σv'' reflection plane (yellow and cyan).

normal modes of the carbonic acid molecule

mode12

ν1(A1) | νsOH

mode11

ν9(B2) | νasOH

mode10

ν2(A1) | νC=O

mode9

ν10(B2) | δasCH

mode8

ν3(A1) | δsCH

mode7

ν11(B2) | δasCH

mode6

ν4(A1) | νC-O

mode5

ν7(B1) | δC-O

mode4

ν12(B2) | δC-O

mode3

ν8(B1) | δsOH

mode2

ν5(A1) | δC-O

mode1

ν6(A2) | δsOH