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)
-0.53400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.16599
2
0.00000
0.00000
-0.12893
3
-0.00216
0.00000
-0.06072
4
0.00216
0.00000
-0.06072
5
0.01805
0.00000
0.04032
6
-0.01805
0.00000
0.04032
7
-0.01464
0.00000
0.07185
8
0.01464
0.00000
0.07185
9
-0.02453
0.00000
-0.07516
10
0.02453
0.00000
-0.07516
11
-0.01137
0.00000
-0.00081
12
0.01137
0.00000
-0.00081
13
-0.04299
0.00000
0.03519
14
0.04299
0.00000
0.03519
15
0.07046
0.00000
-0.07273
16
-0.07046
0.00000
-0.07273
17
0.06262
0.00000
0.09077
18
-0.06262
0.00000
0.09077
19
0.01004
0.00000
0.01817
20
-0.01004
0.00000
0.01817