Charge: 1
Inchi:1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2/q+1
Electronic States
Energy
(eV)
-462.45186
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.04727 b
(cm-1)
0.03942 c
(cm-1)
0.02167
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.01975
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)
-0.33800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.16031
2
0.00000
0.00000
-0.12190
3
-0.00227
0.00000
-0.07267
4
0.00227
0.00000
-0.07267
5
0.01312
0.00000
0.03783
6
-0.01312
0.00000
0.03783
7
-0.02124
0.00000
0.07728
8
0.02124
0.00000
0.07728
9
-0.01919
0.00000
-0.07122
10
0.01919
0.00000
-0.07122
11
0.00202
0.00000
0.00371
12
-0.00202
0.00000
0.00371
13
-0.05442
0.00000
0.03595
14
0.05442
0.00000
0.03595
15
0.08542
0.00000
-0.09269
16
-0.08542
0.00000
-0.09269
17
0.06066
0.00000
0.07648
18
-0.06066
0.00000
0.07648
19
0.00345
0.00992
0.02507
20
0.00345
-0.00992
0.02507
21
-0.00345
0.00992
0.02507
22
-0.00345
-0.00992
0.02507