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)
0.38500
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.14943
0.00000
0.00000
2
0.05976
0.00000
0.00000
3
0.10907
0.00000
0.02137
4
0.10907
0.00000
-0.02137
5
-0.03805
0.00000
-0.02196
6
-0.03805
0.00000
0.02196
7
-0.04861
0.00000
-0.01295
8
-0.04861
0.00000
0.01295
9
0.04181
0.00000
0.05294
10
0.04181
0.00000
-0.05294
11
-0.01225
0.00000
-0.00922
12
-0.01225
0.00000
0.00922
13
0.07304
0.00000
-0.01662
14
0.07304
0.00000
0.01662
15
-0.04073
0.00000
-0.03842
16
-0.04073
0.00000
0.03842
17
-0.07885
0.00000
-0.18057
18
-0.07885
0.00000
0.18057
19
-0.01917
0.07335
0.11334
20
-0.01917
-0.07335
0.11334
21
-0.01917
-0.07335
-0.11334
22
-0.01917
0.07335
-0.11334