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)
0.74800
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.01964
0.00000
0.00000
2
-0.17993
0.00000
0.00000
3
0.04511
0.00000
0.01570
4
0.04511
0.00000
-0.01570
5
0.00172
0.00000
-0.02761
6
0.00172
0.00000
0.02761
7
-0.02975
0.00000
-0.01062
8
-0.02975
0.00000
0.01062
9
0.03509
0.00000
-0.01848
10
0.03509
0.00000
0.01848
11
-0.01264
0.00000
0.01618
12
-0.01264
0.00000
-0.01618
13
0.43277
0.00000
-0.00254
14
0.43277
0.00000
0.00254
15
-0.07610
0.00000
0.06229
16
-0.07610
0.00000
-0.06229
17
0.11638
0.00000
0.13215
18
0.11638
0.00000
-0.13215
19
0.01049
0.00000
0.03287
20
0.01049
0.00000
-0.03287