Charge: -1
Inchi:1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H/q-1
Electronic States
Energy
(eV)
-461.49413
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05061 b
(cm-1)
0.03995 c
(cm-1)
0.02232
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.29247
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)
-1.51200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00100
2
0.00000
0.00000
-0.00041
3
-0.00061
0.00000
0.00118
4
0.00061
0.00000
0.00118
5
0.00174
0.00000
-0.03931
6
-0.00174
0.00000
-0.03931
7
0.02174
0.00000
0.01429
8
-0.02174
0.00000
0.01429
9
0.03339
0.00000
-0.01660
10
-0.03339
0.00000
-0.01660
11
0.00191
0.00000
-0.00272
12
-0.00191
0.00000
-0.00272
13
-0.03115
0.00000
0.43973
14
0.03115
0.00000
0.43973
15
-0.24797
0.00000
-0.14923
16
0.24797
0.00000
-0.14923
17
-0.36991
0.00000
0.19167
18
0.36991
0.00000
0.19167
19
-0.02128
0.00000
0.02822
20
0.02128
0.00000
0.02822