Charge: 1
Inchi:1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2/q+1
Electronic States
Energy
(eV)
-462.45186
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.04727 b
(cm-1)
0.03942 c
(cm-1)
0.02167
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.01975
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)
-0.00100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.12289
2
0.00000
0.00000
-0.05291
3
-0.03925
0.00000
-0.08293
4
0.03925
0.00000
-0.08293
5
-0.03410
0.00000
0.08677
6
0.03410
0.00000
0.08677
7
0.03436
0.00000
-0.01173
8
-0.03436
0.00000
-0.01173
9
-0.01771
0.00000
0.00013
10
0.01771
0.00000
0.00013
11
0.02631
0.00000
0.09256
12
-0.02631
0.00000
0.09256
13
-0.01229
0.00000
0.09411
14
0.01229
0.00000
0.09411
15
0.00299
0.00000
0.03335
16
-0.00299
0.00000
0.03335
17
-0.11050
0.00000
-0.17212
18
0.11050
0.00000
-0.17212
19
-0.01985
-0.00555
0.04079
20
-0.01985
0.00555
0.04079
21
0.01985
-0.00555
0.04079
22
0.01985
0.00555
0.04079