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)
-384.61791
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09639 b
(cm-1)
0.04048 c
(cm-1)
0.02851
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.27338
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.04700
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.06907
0.00000
2
0.00000
0.02578
0.03500
3
0.00000
0.02578
-0.03500
4
0.00000
-0.00203
0.00808
5
0.00000
-0.00203
-0.00808
6
0.00000
0.01957
0.03560
7
0.00000
0.01957
-0.03560
8
0.00000
-0.01115
-0.00431
9
0.00000
-0.01115
0.00431
10
0.00000
0.01113
0.00000
11
0.00000
-0.58898
0.00000
12
0.00000
0.30424
-0.38016
13
0.00000
0.30424
0.38016
14
0.00000
0.01088
0.07812
15
0.00000
0.01088
-0.07812
16
0.00000
-0.00852
-0.02062
17
0.00000
-0.00852
0.02062
18
0.00000
-0.10050
0.00000