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)
-0.43500
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.10438
0.00000
0.00000
2
-0.00013
0.00000
0.00000
3
0.02213
0.00000
0.08825
4
0.02213
0.00000
-0.08825
5
-0.04426
0.00000
0.03006
6
-0.04426
0.00000
-0.03006
7
-0.06738
0.00000
0.00601
8
-0.06738
0.00000
-0.00601
9
0.06711
0.00000
-0.02760
10
0.06711
0.00000
0.02760
11
-0.01779
0.00000
0.05819
12
-0.01779
0.00000
-0.05819
13
-0.28590
0.00000
0.01428
14
-0.28590
0.00000
-0.01428
15
-0.09971
0.00000
0.06115
16
-0.09971
0.00000
-0.06115
17
0.11240
0.00000
0.05035
18
0.11240
0.00000
-0.05035
19
0.06553
-0.01457
0.09364
20
0.06553
0.01457
0.09364
21
0.06553
0.01457
-0.09364
22
0.06553
-0.01457
-0.09364