Charge: -1
Inchi:1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H/q-1
Electronic States
Energy
(eV)
-461.48811
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Symmetry Elements
S0
Rotational Constants
(cm-1)
0.05036 b
(cm-1)
0.04065 c
(cm-1)
0.02249
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.14723
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.01500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.09556
0.00000
2
0.00000
-0.11325
0.00000
3
0.00000
0.02581
0.00000
4
0.00000
0.02581
0.00000
5
0.00000
-0.03736
0.00000
6
0.00000
-0.03736
0.00000
7
0.00000
-0.08901
0.00000
8
0.00000
-0.08901
0.00000
9
0.00000
0.10119
0.00000
10
0.00000
0.10119
0.00000
11
0.00000
0.00564
0.00000
12
0.00000
0.00564
0.00000
13
0.00000
0.00129
0.00000
14
0.00000
0.00129
0.00000
15
0.00000
-0.24603
0.00000
16
0.00000
-0.24603
0.00000
17
0.00000
0.25114
0.00000
18
0.00000
0.25114
0.00000
19
0.00000
0.02432
0.00000
20
0.00000
0.02432
0.00000