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)
-385.87618
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09453 b
(cm-1)
0.04092 c
(cm-1)
0.02856
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.38427
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.17100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.07811
0.00000
2
0.00000
0.01633
0.02341
3
0.00000
0.01633
-0.02341
4
0.00000
0.01885
0.06153
5
0.00000
0.01885
-0.06153
6
0.00000
-0.03445
-0.00849
7
0.00000
-0.03445
0.00849
8
0.00000
0.07577
0.00863
9
0.00000
0.07577
-0.00863
10
0.00000
-0.15793
0.00000
11
0.00000
0.22403
0.00000
12
0.00000
0.10021
-0.12434
13
0.00000
0.10021
0.12434
14
0.00000
-0.02421
-0.14358
15
0.00000
-0.02421
0.14358
16
0.00000
0.09991
-0.03148
17
0.00000
0.09991
0.03148
18
0.00000
0.41302
0.00000