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)
-0.03600
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.05988
0.00000
0.00000
2
0.07156
0.00000
0.00000
3
-0.07165
0.00000
-0.05075
4
-0.07165
0.00000
0.05075
5
0.08171
0.00000
-0.04931
6
0.08171
0.00000
0.04931
7
-0.05762
0.00000
-0.06150
8
-0.05762
0.00000
0.06150
9
0.06866
0.00000
-0.06056
10
0.06866
0.00000
0.06056
11
-0.02958
0.00000
0.04017
12
-0.02958
0.00000
-0.04017
13
0.03658
0.00000
-0.05266
14
0.03658
0.00000
0.05266
15
-0.09286
0.00000
-0.00235
16
-0.09286
0.00000
0.00235
17
0.10175
0.00000
0.00161
18
0.10175
0.00000
-0.00161
19
-0.00701
-0.00036
0.05861
20
-0.00701
0.00036
0.05861
21
-0.00701
0.00036
-0.05861
22
-0.00701
-0.00036
-0.05861