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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.04800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00039
2
0.00000
0.00000
-0.00031
3
-0.00055
0.00000
0.00087
4
0.00055
0.00000
0.00087
5
0.00309
0.00000
-0.03435
6
-0.00309
0.00000
-0.03435
7
0.02191
0.00000
0.01194
8
-0.02192
0.00000
0.01194
9
-0.03398
0.00000
0.01729
10
0.03399
0.00000
0.01729
11
0.00013
0.00000
-0.00024
12
-0.00013
0.00000
-0.00024
13
-0.03164
0.00000
0.40584
14
0.03164
0.00000
0.40589
15
-0.25290
0.00000
-0.14848
16
0.25293
0.00000
-0.14850
17
0.40445
0.00000
-0.20462
18
-0.40449
0.00000
-0.20464
19
-0.00108
0.00000
0.00027
20
0.00108
0.00000
0.00028