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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.29700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.07430
2
0.00000
0.00000
-0.07411
3
0.01567
0.00000
-0.04295
4
-0.01567
0.00000
-0.04295
5
-0.08639
0.00000
0.01176
6
0.08639
0.00000
0.01176
7
-0.01966
0.00000
0.07042
8
0.01966
0.00000
0.07042
9
-0.06947
0.00000
0.07862
10
0.06947
0.00000
0.07862
11
-0.00788
0.00000
-0.05905
12
0.00788
0.00000
-0.05905
13
-0.19090
0.00000
0.01795
14
0.19090
0.00000
0.01795
15
0.01947
0.00000
0.13433
16
-0.01947
0.00000
0.13433
17
-0.08325
0.00000
0.10367
18
0.08325
0.00000
0.10367
19
0.00905
0.00000
-0.07235
20
-0.00905
0.00000
-0.07235