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)
-1.62400
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.05529
0.00000
0.00000
2
-0.17307
0.00000
0.00000
3
0.00530
0.00000
0.03788
4
0.00530
0.00000
-0.03788
5
-0.00903
0.00000
-0.01861
6
-0.00903
0.00000
0.01861
7
-0.02700
0.00000
-0.02571
8
-0.02700
0.00000
0.02571
9
0.05235
0.00000
-0.01198
10
0.05235
0.00000
0.01198
11
-0.01164
0.00000
0.00907
12
-0.01164
0.00000
-0.00907
13
0.44977
0.00000
0.00173
14
0.44977
0.00000
-0.00173
15
-0.05169
0.00000
0.01587
16
-0.05169
0.00000
-0.01587
17
0.09067
0.00000
0.05971
18
0.09067
0.00000
-0.05971
19
0.04682
-0.00816
0.03212
20
0.04682
0.00816
0.03212
21
0.04682
0.00816
-0.03212
22
0.04682
-0.00816
-0.03212