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)
-385.85306
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09480 b
(cm-1)
0.04163 c
(cm-1)
0.02893
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.43892
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.08300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.05102
0.00000
2
0.00000
-0.03109
0.08036
3
0.00000
-0.03109
-0.08036
4
0.00000
0.11400
-0.00053
5
0.00000
0.11400
0.00053
6
0.00000
0.00797
0.03648
7
0.00000
0.00797
-0.03648
8
0.00000
-0.05650
-0.10370
9
0.00000
-0.05650
0.10370
10
0.00000
-0.03012
0.00000
11
0.00000
0.06932
0.00000
12
0.00000
-0.08712
-0.01088
13
0.00000
-0.08712
0.01088
14
0.00000
0.11684
0.01594
15
0.00000
0.11683
-0.01594
16
0.00000
-0.04976
-0.12643
17
0.00000
-0.04976
0.12642
18
0.00000
0.11806
0.00000