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)
-460.74533
Description
T0
Multiplicity
3
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05095 b
(cm-1)
0.03935 c
(cm-1)
0.02220
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.10117
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.35400
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.07855
0.00000
0.00000
2
-0.05258
0.00000
0.00000
3
-0.04361
0.00000
-0.09385
4
-0.04361
0.00000
0.09385
5
0.00405
0.00000
0.01768
6
0.00405
0.00000
-0.01768
7
0.03865
0.00000
-0.00734
8
0.03865
0.00000
0.00734
9
0.03102
0.00000
-0.00480
10
0.03102
0.00000
0.00480
11
-0.00009
0.00000
-0.00608
12
-0.00009
0.00000
0.00608
13
-0.13182
0.00000
0.03442
14
-0.13182
0.00000
-0.03442
15
0.24906
0.00000
0.32457
16
0.24906
0.00000
-0.32457
17
0.11319
0.00000
-0.15481
18
0.11319
0.00000
0.15481
19
0.19284
0.00000
-0.14484
20
0.19284
0.00000
0.14484