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)
0.52200
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.04519
0.00000
0.00000
2
0.06421
0.00000
0.00000
3
-0.03767
0.00000
-0.06292
4
-0.03767
0.00000
0.06292
5
0.02623
0.00000
-0.01511
6
0.02623
0.00000
0.01511
7
0.03562
0.00000
-0.06837
8
0.03562
0.00000
0.06837
9
-0.02399
0.00000
0.07608
10
-0.02399
0.00000
-0.07608
11
0.00506
0.00000
-0.01260
12
0.00506
0.00000
0.01260
13
-0.06574
0.00000
-0.01150
14
-0.06574
0.00000
0.01150
15
-0.01018
0.00000
-0.15581
16
-0.01018
0.00000
0.15581
17
-0.19139
0.00000
0.39519
18
-0.19139
0.00000
-0.39519
19
0.09145
0.00000
-0.07585
20
0.09145
0.00000
0.07585