Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+2
Electronic States
Energy
(eV)
-385.33887
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09476 b
(cm-1)
0.04104 c
(cm-1)
0.02864
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.36944
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-2.52000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00269
0.00000
2
0.00000
-0.02429
0.02178
3
0.00000
-0.02429
-0.02178
4
0.00000
-0.04714
0.01172
5
0.00000
-0.04714
-0.01172
6
0.00000
0.00049
0.00177
7
0.00000
0.00049
-0.00177
8
0.00000
0.00335
0.00084
9
0.00000
0.00335
-0.00084
10
0.00000
-0.00019
0.00000
11
0.00000
-0.00510
0.00000
12
0.00000
0.28137
0.23455
13
0.00000
0.28137
-0.23455
14
0.00000
0.55189
-0.12136
15
0.00000
0.55189
0.12136
16
0.00000
-0.03869
-0.01069
17
0.00000
-0.03869
0.01069
18
0.00000
-0.00420
0.00000