Charge: 0
Inchi:1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H
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)
-0.33900
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.12642
0.00000
0.00000
2
0.08397
0.00000
0.00000
3
0.05101
0.00000
0.05902
4
0.05101
0.00000
-0.05902
5
-0.03963
0.00000
0.00104
6
-0.03963
0.00000
-0.00104
7
0.04510
0.00000
-0.07894
8
0.04510
0.00000
0.07894
9
-0.02151
0.00000
0.01952
10
-0.02151
0.00000
-0.01952
11
-0.01708
0.00000
0.00209
12
-0.01708
0.00000
-0.00209
13
0.09549
0.00000
0.01644
14
0.09549
0.00000
-0.01644
15
-0.17394
0.00000
0.28987
16
-0.17394
0.00000
-0.28987
17
0.03617
0.00000
0.13699
18
0.03617
0.00000
-0.13699
19
0.08192
0.00000
0.07337
20
0.08192
0.00000
-0.07337