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)
-461.49413
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05061 b
(cm-1)
0.03995 c
(cm-1)
0.02232
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.29247
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)
-0.35200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.01716
2
0.00000
0.00000
-0.01865
3
-0.10932
0.00000
0.05438
4
0.10932
0.00000
0.05438
5
0.05344
0.00000
0.02259
6
-0.05344
0.00000
0.02259
7
0.08574
0.00000
-0.05956
8
-0.08574
0.00000
-0.05956
9
-0.05669
0.00000
-0.02519
10
0.05669
0.00000
-0.02519
11
-0.03138
0.00000
-0.02569
12
0.03138
0.00000
-0.02569
13
-0.07845
0.00000
0.01885
14
0.07845
0.00000
0.01885
15
-0.05704
0.00000
0.18831
16
0.05704
0.00000
0.18831
17
0.04079
0.00000
0.16599
18
-0.04079
0.00000
0.16599
19
0.06250
0.00000
0.03439
20
-0.06250
0.00000
0.03439