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)
0.08000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.03861
0.00000
0.00000
2
-0.01942
0.00000
0.00000
3
-0.00554
0.00000
0.03423
4
-0.00554
0.00000
-0.03423
5
-0.00717
0.00000
0.09714
6
-0.00717
0.00000
-0.09714
7
-0.05378
0.00000
-0.05016
8
-0.05378
0.00000
0.05016
9
0.06323
0.00000
-0.03951
10
0.06323
0.00000
0.03951
11
0.04767
0.00000
-0.10478
12
0.04767
0.00000
0.10478
13
-0.08087
0.00000
0.09107
14
-0.08087
0.00000
-0.09107
15
-0.07288
0.00000
-0.01583
16
-0.07288
0.00000
0.01583
17
0.04813
0.00000
-0.06117
18
0.04813
0.00000
0.06117
19
-0.07783
0.00000
-0.19194
20
-0.07783
0.00000
0.19194