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)
-1.01400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00008
2
0.00000
0.00000
-0.00017
3
-0.00157
0.00000
0.00235
4
0.00157
0.00000
0.00235
5
0.00014
0.00000
-0.00083
6
-0.00014
0.00000
-0.00083
7
-0.00460
0.00000
-0.00355
8
0.00460
0.00000
-0.00355
9
-0.00268
0.00000
0.00084
10
0.00268
0.00000
0.00084
11
0.03750
0.00000
-0.04758
12
-0.03750
0.00000
-0.04758
13
-0.00072
0.00000
0.01860
14
0.00072
0.00000
0.01860
15
0.05767
0.00000
0.03393
16
-0.05767
0.00000
0.03393
17
0.02616
0.00000
-0.01336
18
-0.02616
0.00000
-0.01336
19
-0.39014
0.00000
0.54214
20
0.39014
0.00000
0.54214