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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
2.06500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00125
2
0.00000
0.00000
0.00018
3
0.00094
0.00000
0.00262
4
-0.00094
0.00000
0.00262
5
-0.00043
0.00000
-0.00894
6
0.00043
0.00000
-0.00894
7
0.00701
0.00000
-0.00495
8
-0.00701
0.00000
-0.00495
9
-0.00776
0.00000
-0.00385
10
0.00776
0.00000
-0.00385
11
-0.03668
0.00000
-0.04712
12
0.03668
0.00000
-0.04712
13
0.00654
0.00000
0.10566
14
-0.00654
0.00000
0.10566
15
-0.08636
0.00000
0.05292
16
0.08636
0.00000
0.05292
17
0.08873
0.00000
0.04790
18
-0.08873
0.00000
0.04790
19
0.37734
0.00000
0.52613
20
-0.37734
0.00000
0.52613