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Calculated Frequencies for SiH2F2 (difluorosilane) 1A1 C2v

B1B95/STO-3G 1A1 C2V

19 05 15 13 41
InChI=1S/F2H2Si/c1-3-2/h3H2 INChIKey=PUUOOWSPWTVMDS-UHFFFAOYSA-N
Mode
Number
Symmetry Frequency
(cm-1)
Scaled Frequency
(cm-1)
IR Intensity
(km/mol)
reduced mass
(u)
description Raman Act
4/u)
Dep P Dep U
1 A1 2618 2312 32.429 1.0322 64.58 0.14 0.24
2 A1 1109 979 118.456 1.0842 18.26 0.72 0.84
3 A1 853 754 10.818 10.3788 4.48 0.17 0.30
4 A1 302 266 12.076 15.5046 1.47 0.75 0.86
5 A2 797 704 0.000 1.0494 12.19 0.75 0.86
6 B1 2653 2342 55.105 1.0546 39.82 0.75 0.86
7 B1 692 611 105.342 1.3773 3.77 0.75 0.86
8 B2 1058 934 225.745 1.8392 2.55 0.75 0.86
9 B2 914 807 5.457 2.3586 6.27 0.75 0.86
List of frequencies only

Unscaled Zero Point Vibrational Energy (zpe) 5498 cm-1
Scaled (by 0.883) Zero Point Vibrational Energy (zpe) 4855 cm-1

See section Calculated; Vibrations; Scale Factors; Set scaling factors to change the scale factors used here.
See section Calculated; Vibrations; Scale Factors; Calculate a scale factor to determine the least squares best scaling factor.

List of Irreducible Representations for C2v

Rep deg. n vib IR R
A1 1 4 active active
A2 1 1 active
B1 1 2 active active
B2 1 2 active active