Charge: 0
Inchi:1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H
Electronic States
Energy
(eV)
-461.48811
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Symmetry Elements
S0
Rotational Constants
(cm-1)
0.05036 b
(cm-1)
0.04065 c
(cm-1)
0.02249
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.14723
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.72800
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.12901
0.00000
0.00000
2
0.05873
0.00000
0.00000
3
0.02459
0.00000
0.09060
4
0.02459
0.00000
-0.09060
5
-0.03037
0.00000
-0.00797
6
-0.03037
0.00000
0.00797
7
0.05798
0.00000
-0.08832
8
0.05798
0.00000
0.08832
9
-0.00849
0.00000
0.02976
10
-0.00849
0.00000
-0.02976
11
-0.00171
0.00000
0.02264
12
-0.00171
0.00000
-0.02264
13
0.04607
0.00000
0.00030
14
0.04607
0.00000
-0.00030
15
-0.15299
0.00000
0.27574
16
-0.15299
0.00000
-0.27574
17
0.01404
0.00000
0.07989
18
0.01405
0.00000
-0.07989
19
0.01125
0.00000
0.03340
20
0.01125
0.00000
-0.03340