Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+1
Electronic States
Energy
(eV)
-385.33887
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09476 b
(cm-1)
0.04104 c
(cm-1)
0.02864
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.36944
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.26500
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.12524
0.00000
0.00000
2
0.09784
0.00000
0.00000
3
0.09784
0.00000
0.00000
4
-0.08957
0.00000
0.00000
5
-0.08957
0.00000
0.00000
6
0.01358
0.00000
0.00000
7
0.01358
0.00000
0.00000
8
0.07177
0.00000
0.00000
9
0.07177
0.00000
0.00000
10
-0.08743
0.00000
0.00000
11
-0.06980
0.00000
0.00000
12
0.23642
0.00000
0.00000
13
0.23642
0.00000
0.00000
14
-0.06325
0.00000
0.00000
15
-0.06325
0.00000
0.00000
16
0.09394
0.00000
0.00000
17
0.09394
0.00000
0.00000
18
-0.16157
0.00000
0.00000