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)
-461.49413
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05061 b
(cm-1)
0.03995 c
(cm-1)
0.02232
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.29247
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.58000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.07612
2
0.00000
0.00000
-0.07422
3
-0.01866
0.00000
-0.04700
4
0.01866
0.00000
-0.04700
5
0.08031
0.00000
0.01641
6
-0.08031
0.00000
0.01641
7
0.02136
0.00000
0.07018
8
-0.02136
0.00000
0.07018
9
0.06747
0.00000
0.07987
10
-0.06747
0.00000
0.07987
11
0.00734
0.00000
-0.06084
12
-0.00734
0.00000
-0.06084
13
0.18642
0.00000
0.02140
14
-0.18642
0.00000
0.02140
15
-0.02242
0.00000
0.14352
16
0.02242
0.00000
0.14352
17
0.08094
0.00000
0.10549
18
-0.08094
0.00000
0.10549
19
-0.00998
0.00000
-0.07328
20
0.00998
0.00000
-0.07328