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)
-460.74533
Description
T0
Multiplicity
3
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.05095 b
(cm-1)
0.03935 c
(cm-1)
0.02220
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.10117
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.23400
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00023
0.00000
0.00000
2
-0.00118
0.00000
0.00000
3
0.00145
0.00000
0.00038
4
0.00145
0.00000
-0.00038
5
0.00039
0.00000
0.01871
6
0.00039
0.00000
-0.01871
7
-0.03263
0.00000
0.01859
8
-0.03263
0.00000
-0.01859
9
0.03742
0.00000
0.01816
10
0.03742
0.00000
-0.01816
11
0.00069
0.00000
0.00212
12
0.00069
0.00000
-0.00212
13
-0.01639
0.00000
-0.20877
14
-0.01639
0.00000
0.20877
15
0.36881
0.00000
-0.22541
16
0.36881
0.00000
0.22541
17
-0.41796
0.00000
-0.22030
18
-0.41796
0.00000
0.22030
19
-0.01323
0.00000
-0.01952
20
-0.01323
0.00000
0.01952