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)
-385.71438
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09692 b
(cm-1)
0.04154 c
(cm-1)
0.02908
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.16806
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.30300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.05848
0.00000
2
0.00000
-0.01651
0.04328
3
0.00000
-0.01651
-0.04328
4
0.00000
-0.04452
0.05506
5
0.00000
-0.04452
-0.05506
6
0.00000
0.04255
0.00631
7
0.00000
0.04255
-0.00631
8
0.00000
0.03502
-0.05325
9
0.00000
0.03502
0.05325
10
0.00000
-0.09362
0.00000
11
0.00000
0.24121
0.00000
12
0.00000
0.05090
-0.12971
13
0.00000
0.05090
0.12971
14
0.00000
-0.01477
0.19931
15
0.00000
-0.01477
-0.19931
16
0.00000
0.09654
-0.23258
17
0.00000
0.09654
0.23258
18
0.00000
-0.48183
0.00000