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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.19600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.08025
2
0.00000
0.00000
-0.07776
3
0.01713
0.00000
-0.04335
4
-0.01713
0.00000
-0.04335
5
-0.08714
0.00000
0.01103
6
0.08714
0.00000
0.01103
7
-0.01826
0.00000
0.07159
8
0.01826
0.00000
0.07159
9
-0.06708
0.00000
0.07711
10
0.06708
0.00000
0.07711
11
-0.01992
0.00000
-0.05396
12
0.01992
0.00000
-0.05396
13
-0.18210
0.00000
0.01778
14
0.18210
0.00000
0.01778
15
0.02161
0.00000
0.13763
16
-0.02161
0.00000
0.13763
17
-0.08348
0.00000
0.10620
18
0.08348
0.00000
0.10620
19
-0.00671
0.00000
-0.06419
20
0.00671
0.00000
-0.06419