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)
0.15000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.12703
0.00000
2
0.00000
0.06985
0.00305
3
0.00000
0.06985
-0.00305
4
0.00000
-0.05246
-0.09478
5
0.00000
-0.05246
0.09478
6
0.00000
0.04525
0.09155
7
0.00000
0.04525
-0.09155
8
0.00000
-0.00603
0.01329
9
0.00000
-0.00603
-0.01329
10
0.00000
-0.00677
0.00000
11
0.00000
0.19471
0.00000
12
0.00000
-0.00021
0.09726
13
0.00000
-0.00021
-0.09726
14
0.00000
0.00939
0.21162
15
0.00000
0.00939
-0.21162
16
0.00000
0.01382
-0.04076
17
0.00000
0.01382
0.04076
18
0.00000
0.00438
0.00000