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)
-0.14100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00030
2
0.00000
0.00000
-0.00080
3
-0.00217
0.00000
0.00146
4
0.00217
0.00000
0.00146
5
-0.00178
0.00000
0.03100
6
0.00178
0.00000
0.03100
7
0.04264
0.00000
0.02460
8
-0.04264
0.00000
0.02460
9
-0.00833
0.00000
0.00143
10
0.00833
0.00000
0.00143
11
0.00304
0.00000
-0.00461
12
-0.00304
0.00000
-0.00461
13
0.02432
0.00000
-0.35497
14
-0.02432
0.00000
-0.35497
15
-0.48230
0.00000
-0.28713
16
0.48230
0.00000
-0.28713
17
0.08772
0.00000
-0.04268
18
-0.08772
0.00000
-0.04268
19
-0.02903
0.00000
0.04970
20
0.02903
0.00000
0.04970