Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+1
Electronic States
Energy
(eV)
-385.33849
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09497 b
(cm-1)
0.04175 c
(cm-1)
0.02900
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.45804
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.39500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.09055
0.00000
2
0.00000
0.01681
0.08087
3
0.00000
0.01681
-0.08087
4
0.00000
-0.03060
0.01159
5
0.00000
-0.03060
-0.01159
6
0.00000
0.01817
0.05941
7
0.00000
0.01817
-0.05941
8
0.00000
0.00718
0.02976
9
0.00000
0.00718
-0.02976
10
0.00000
-0.03404
0.00000
11
0.00000
-0.55852
0.00000
12
0.00000
-0.25287
0.23699
13
0.00000
-0.25287
-0.23698
14
0.00000
-0.03601
0.02531
15
0.00000
-0.03601
-0.02531
16
0.00000
0.04619
-0.06765
17
0.00000
0.04619
0.06765
18
0.00000
0.09569
0.00000