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)
-0.60600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.00018
0.00000
2
0.00000
0.01580
-0.01134
3
0.00000
0.01580
0.01134
4
0.00000
-0.05281
0.01085
5
0.00000
-0.05280
-0.01085
6
0.00000
0.00051
0.00152
7
0.00000
0.00051
-0.00152
8
0.00000
0.00109
0.00031
9
0.00000
0.00109
-0.00031
10
0.00000
-0.00015
0.00000
11
0.00000
-0.00026
0.00003
12
0.00000
-0.18462
-0.14875
13
0.00000
-0.18459
0.14872
14
0.00000
0.61935
-0.13070
15
0.00000
0.61929
0.13069
16
0.00000
-0.01092
-0.00219
17
0.00000
-0.01092
0.00219
18
0.00000
-0.00025
0.00000