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)
-460.74502
Description
S1
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05226 b
(cm-1)
0.03846 c
(cm-1)
0.02216
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.65729
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.41400
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.09199
0.00000
0.00000
2
0.02178
0.00000
0.00000
3
-0.09787
0.00000
0.03194
4
-0.09787
0.00000
-0.03194
5
-0.07187
0.00000
0.02310
6
-0.07187
0.00000
-0.02310
7
0.04504
0.00000
0.06253
8
0.04504
0.00000
-0.06253
9
0.03724
0.00000
-0.06089
10
0.03724
0.00000
0.06089
11
0.00219
0.00000
0.05954
12
0.00219
0.00000
-0.05954
13
0.25729
0.00000
0.00274
14
0.25729
0.00000
-0.00274
15
-0.00243
0.00000
-0.01278
16
-0.00243
0.00000
0.01278
17
-0.00712
0.00000
0.02341
18
-0.00712
0.00000
-0.02341
19
0.09021
0.00000
0.01064
20
0.09021
0.00000
-0.01064