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)
0.04900
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.07034
0.00000
0.00000
2
-0.02260
0.00000
0.00000
3
-0.00819
0.00000
0.00937
4
-0.00819
0.00000
-0.00937
5
-0.01620
0.00000
0.09708
6
-0.01620
0.00000
-0.09708
7
-0.02997
0.00000
-0.04871
8
-0.02997
0.00000
0.04871
9
0.07999
0.00000
-0.04211
10
0.07999
0.00000
0.04211
11
0.03393
0.00000
-0.10280
12
0.03393
0.00000
0.10280
13
-0.08976
0.00000
0.09032
14
-0.08976
0.00000
-0.09032
15
-0.06056
0.00000
0.00596
16
-0.06056
0.00000
-0.00596
17
0.05570
0.00000
-0.08038
18
0.05570
0.00000
0.08038
19
-0.03058
0.00375
-0.14017
20
-0.03058
-0.00375
-0.14017
21
-0.03058
-0.00375
0.14017
22
-0.03058
0.00375
0.14017