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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.06900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.02672
2
0.00000
0.00000
-0.06714
3
0.06976
0.00000
0.01548
4
-0.06976
0.00000
0.01548
5
-0.04085
0.00000
-0.04150
6
0.04085
0.00000
-0.04150
7
0.10834
0.00000
0.05647
8
-0.10834
0.00000
0.05647
9
-0.09268
0.00000
0.04281
10
0.09268
0.00000
0.04281
11
0.01146
0.00000
-0.01958
12
-0.01146
0.00000
-0.01958
13
0.03111
0.00000
-0.03611
14
-0.03111
0.00000
-0.03611
15
0.17104
0.00000
-0.04444
16
-0.17104
0.00000
-0.04444
17
-0.12688
0.00000
-0.02219
18
0.12688
0.00000
-0.02219
19
0.07294
0.00000
0.02253
20
-0.07294
0.00000
0.02253