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)
-384.61791
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09639 b
(cm-1)
0.04048 c
(cm-1)
0.02851
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.27338
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)
-1.09300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.05377
2
0.00000
0.13975
-0.05406
3
0.00000
-0.13975
-0.05406
4
0.00000
0.02516
0.06166
5
0.00000
-0.02516
0.06166
6
0.00000
0.03513
0.03820
7
0.00000
-0.03513
0.03820
8
0.00000
-0.01295
-0.02504
9
0.00000
0.01295
-0.02504
10
0.00000
0.00000
-0.01103
11
0.00000
0.00000
-0.06156
12
0.00000
-0.20482
0.01214
13
0.00000
0.20482
0.01214
14
0.00000
0.06359
0.24765
15
0.00000
-0.06359
0.24765
16
0.00000
0.00320
-0.08397
17
0.00000
-0.00320
-0.08397
18
0.00000
0.00000
-0.01313