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)
-385.60867
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09587 b
(cm-1)
0.04112 c
(cm-1)
0.02878
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.18402
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
1.59500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.00647
0.00000
2
0.00000
0.01102
0.01862
3
0.00000
0.01102
-0.01862
4
0.00000
0.01281
0.00665
5
0.00000
0.01281
-0.00665
6
0.00000
-0.04567
0.00677
7
0.00000
-0.04567
-0.00677
8
0.00000
0.08939
0.01156
9
0.00000
0.08939
-0.01156
10
0.00000
-0.18558
0.00000
11
0.00000
-0.07944
0.00000
12
0.00000
-0.02324
0.02268
13
0.00000
-0.02324
-0.02268
14
0.00000
0.02718
0.07915
15
0.00000
0.02718
-0.07915
16
0.00000
0.11439
-0.02222
17
0.00000
0.11439
0.02222
18
0.00000
0.52128
0.00000