Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+2
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)
0.00000
Diff mu Z
(Debye)
-0.73500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.04308
2
0.00000
0.03845
-0.03016
3
0.00000
-0.03845
-0.03016
4
0.00000
-0.01527
0.00485
5
0.00000
0.01527
0.00485
6
0.00000
0.00006
0.00085
7
0.00000
-0.00006
0.00085
8
0.00000
-0.00089
-0.00039
9
0.00000
0.00088
-0.00039
10
0.00000
0.00000
0.00027
11
0.00000
0.00000
0.47906
12
0.00000
0.43043
0.35023
13
0.00000
-0.43044
0.35024
14
0.00000
0.17099
-0.03876
15
0.00000
-0.17100
-0.03876
16
0.00000
0.01005
0.00271
17
0.00000
-0.01004
0.00271
18
0.00000
0.00000
-0.00590