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)
-385.60867
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)
0.00000
Diff mu Z
(Debye)
0.19500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.03099
2
0.00000
-0.02901
0.02304
3
0.00000
0.02901
0.02304
4
0.00000
-0.03688
0.00673
5
0.00000
0.03688
0.00673
6
0.00000
0.00045
0.00114
7
0.00000
-0.00045
0.00114
8
0.00000
-0.00097
-0.00050
9
0.00000
0.00097
-0.00050
10
0.00000
0.00000
0.00262
11
0.00000
0.00000
0.37446
12
0.00000
-0.34226
-0.27620
13
0.00000
0.34226
-0.27620
14
0.00000
0.42957
-0.09267
15
0.00000
-0.42957
-0.09267
16
0.00000
0.01154
0.00343
17
0.00000
-0.01154
0.00343
18
0.00000
0.00000
-0.02998