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)
-461.21366
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05139 b
(cm-1)
0.03981 c
(cm-1)
0.02243
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.36522
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)
-0.52800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.02589
2
0.00000
0.00000
0.00958
3
-0.10124
0.00000
0.07586
4
0.10124
0.00000
0.07586
5
0.04584
0.00000
0.01244
6
-0.04584
0.00000
0.01244
7
0.09027
0.00000
-0.07131
8
-0.09027
0.00000
-0.07131
9
-0.05236
0.00000
-0.01250
10
0.05236
0.00000
-0.01250
11
-0.00645
0.00000
-0.02559
12
0.00645
0.00000
-0.02559
13
-0.05644
0.00000
0.00831
14
0.05644
0.00000
0.00831
15
-0.06670
0.00000
0.21190
16
0.06670
0.00000
0.21190
17
0.02077
0.00000
0.14028
18
-0.02077
0.00000
0.14028
19
0.03011
0.00000
-0.01217
20
-0.03011
0.00000
-0.01217