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)
1.61600
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00002
0.00000
0.00000
2
-0.00238
0.00000
0.00000
3
-0.00128
0.00000
0.00142
4
-0.00128
0.00000
-0.00142
5
0.00129
0.00000
-0.03620
6
0.00129
0.00000
0.03620
7
0.02492
0.00000
0.01634
8
0.02492
0.00000
-0.01634
9
0.03036
0.00000
-0.01569
10
0.03036
0.00000
0.01569
11
-0.00732
0.00000
0.01133
12
-0.00732
0.00000
-0.01133
13
-0.02684
0.00000
0.41407
14
-0.02684
0.00000
-0.41407
15
-0.28895
0.00000
-0.17462
16
-0.28895
0.00000
0.17462
17
-0.33425
0.00000
0.17363
18
-0.33425
0.00000
-0.17363
19
0.09319
0.00000
-0.13063
20
0.09319
0.00000
0.13063