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)
-461.48811
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)
-1.28000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00073
0.00000
0.00000
2
0.00245
0.00000
0.00000
3
0.00143
0.00000
-0.00116
4
0.00143
0.00000
0.00116
5
-0.00004
0.00000
0.02662
6
-0.00004
0.00000
-0.02662
7
-0.02538
0.00000
-0.01599
8
-0.02538
0.00000
0.01599
9
-0.04087
0.00000
0.01989
10
-0.04087
0.00000
-0.01989
11
0.00034
0.00000
-0.00057
12
0.00034
0.00000
0.00057
13
0.01802
0.00000
-0.29005
14
0.01802
0.00000
0.29005
15
0.28508
0.00000
0.17180
16
0.28508
0.00000
-0.17180
17
0.45235
0.00000
-0.22876
18
0.45236
0.00000
0.22877
19
-0.00620
0.00000
0.00702
20
-0.00620
0.00000
-0.00702