Charge: 2
Inchi:1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2/q+2
Electronic States
Energy
(eV)
-462.67905
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.04694 b
(cm-1)
0.03882 c
(cm-1)
0.02141
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.82674
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.49700
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.01422
0.00000
0.00000
2
0.05827
0.00000
0.00000
3
-0.02001
0.00000
0.07886
4
-0.02001
0.00000
-0.07886
5
0.02208
0.00000
-0.08599
6
0.02208
0.00000
0.08599
7
-0.08754
0.00000
0.01332
8
-0.08754
0.00000
-0.01332
9
-0.04018
0.00000
0.01084
10
-0.04018
0.00000
-0.01084
11
0.08050
0.00000
-0.07270
12
0.08050
0.00000
0.07270
13
0.03223
0.00000
-0.08382
14
0.03223
0.00000
0.08382
15
-0.06883
0.00000
-0.01426
16
-0.06883
0.00000
0.01426
17
0.01217
0.00000
0.10898
18
0.01217
0.00000
-0.10898
19
0.06525
0.00274
-0.08493
20
0.06525
-0.00274
-0.08493
21
0.06525
-0.00274
0.08493
22
0.06525
0.00274
0.08493