Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+1
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)
0.11700
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.13264
0.00000
0.00000
2
0.02531
0.00000
0.00000
3
0.02531
0.00000
0.00000
4
-0.10590
0.00000
0.00000
5
-0.10590
0.00000
0.00000
6
-0.08273
0.00000
0.00000
7
-0.08273
0.00000
0.00000
8
0.02623
0.00000
0.00000
9
0.02623
0.00000
0.00000
10
0.11107
0.00000
0.00000
11
0.25009
0.00000
0.00000
12
0.05410
0.00000
0.00000
13
0.05410
0.00000
0.00000
14
-0.16385
0.00000
0.00000
15
-0.16385
0.00000
0.00000
16
0.06020
0.00000
0.00000
17
0.06020
0.00000
0.00000
18
0.21172
0.00000
0.00000