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)
0.00000
Diff mu Z
(Debye)
0.25100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.09332
2
0.00000
0.00000
-0.06133
3
-0.03652
0.00000
-0.08271
4
0.03652
0.00000
-0.08271
5
-0.03902
0.00000
0.08010
6
0.03902
0.00000
0.08010
7
0.03571
0.00000
-0.01270
8
-0.03571
0.00000
-0.01270
9
-0.00680
0.00000
-0.00159
10
0.00680
0.00000
-0.00159
11
-0.00626
0.00000
0.10017
12
0.00626
0.00000
0.10017
13
0.00317
0.00000
0.08690
14
-0.00317
0.00000
0.08690
15
-0.00432
0.00000
0.05351
16
0.00433
0.00000
0.05351
17
-0.10320
0.00000
-0.18816
18
0.10320
0.00000
-0.18816
19
-0.18807
0.00000
-0.02306
20
0.18807
0.00000
-0.02306