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)
-385.85306
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09480 b
(cm-1)
0.04163 c
(cm-1)
0.02893
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.43892
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.01300
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.08523
0.00000
0.00000
2
0.07024
0.00000
0.00000
3
0.07024
0.00000
0.00000
4
-0.04281
0.00000
0.00000
5
-0.04281
0.00000
0.00000
6
0.01116
0.00000
0.00000
7
0.01116
0.00000
0.00000
8
-0.00807
0.00000
0.00000
9
-0.00807
0.00000
0.00000
10
0.00370
0.00000
0.00000
11
0.51428
0.00000
0.00000
12
-0.41140
0.00000
0.00000
13
-0.41140
0.00000
0.00000
14
0.26127
0.00000
0.00000
15
0.26127
0.00000
0.00000
16
0.01385
0.00000
0.00000
17
0.01385
0.00000
0.00000
18
0.00215
0.00000
0.00000