Charge: -1
Inchi:1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H/q-1
Electronic States
Energy
(eV)
-461.21366
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05139 b
(cm-1)
0.03981 c
(cm-1)
0.02243
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.36522
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.76100
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.06952
0.00000
0.00000
2
0.06415
0.00000
0.00000
3
0.02198
0.00000
0.03811
4
0.02198
0.00000
-0.03811
5
0.02862
0.00000
-0.08691
6
0.02862
0.00000
0.08691
7
-0.00362
0.00000
-0.04668
8
-0.00362
0.00000
0.04668
9
0.00354
0.00000
-0.07448
10
0.00354
0.00000
0.07448
11
-0.10490
0.00000
-0.04842
12
-0.10490
0.00000
0.04842
13
-0.00590
0.00000
-0.08880
14
-0.00590
0.00000
0.08880
15
0.02741
0.00000
-0.10052
16
0.02741
0.00000
0.10052
17
0.02115
0.00000
-0.03979
18
0.02115
0.00000
0.03979
19
-0.19095
0.00000
-0.10771
20
-0.19095
0.00000
0.10771