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)
-0.54200
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.08458
0.00000
0.00000
2
0.10545
0.00000
0.00000
3
0.10024
0.00000
-0.04475
4
0.10024
0.00000
0.04475
5
-0.08406
0.00000
-0.00602
6
-0.08406
0.00000
0.00602
7
-0.06459
0.00000
0.04851
8
-0.06459
0.00000
-0.04851
9
0.04247
0.00000
0.00877
10
0.04247
0.00000
-0.00877
11
-0.02499
0.00000
-0.02429
12
-0.02499
0.00000
0.02429
13
0.13996
0.00000
0.01240
14
0.13996
0.00000
-0.01240
15
0.02423
0.00000
-0.11656
16
0.02423
0.00000
0.11656
17
0.00933
0.00000
-0.06755
18
0.00933
0.00000
0.06755
19
0.07039
0.00000
0.03463
20
0.07039
0.00000
-0.03463