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)
0.00000
Diff mu Z
(Debye)
-1.35900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00040
2
0.00000
-0.00021
0.00003
3
0.00000
0.00021
0.00003
4
0.00000
0.00061
-0.00033
5
0.00000
-0.00061
-0.00033
6
0.00000
-0.00020
0.00233
7
0.00000
0.00020
0.00233
8
0.00000
-0.03739
-0.00921
9
0.00000
0.03739
-0.00921
10
0.00000
0.00000
-0.06866
11
0.00000
0.00000
-0.00421
12
0.00000
-0.00390
-0.00347
13
0.00000
0.00390
-0.00347
14
0.00000
-0.00807
0.00081
15
0.00000
0.00807
0.00081
16
0.00000
0.39162
0.12117
17
0.00000
-0.39162
0.12117
18
0.00000
0.00000
0.75122