Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+1
Electronic States
Energy
(eV)
-385.86921
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09470 b
(cm-1)
0.04162 c
(cm-1)
0.02891
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.41127
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.20300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00073
0.00000
2
0.00000
0.06252
-0.10916
3
0.00000
0.06252
0.10917
4
0.00000
0.03117
0.10064
5
0.00000
0.03118
-0.10064
6
0.00000
0.02350
0.04164
7
0.00000
0.02350
-0.04164
8
0.00000
-0.06375
-0.01505
9
0.00000
-0.06375
0.01504
10
0.00000
-0.08795
0.00000
11
0.00000
-0.12949
0.00000
12
0.00000
0.03704
0.13993
13
0.00000
0.03704
-0.13994
14
0.00000
0.03014
0.08844
15
0.00000
0.03015
-0.08844
16
0.00000
-0.08726
0.05811
17
0.00000
-0.08726
-0.05811
18
0.00000
-0.06468
0.00000