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)
-385.85306
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)
0.00000
Diff mu Z
(Debye)
-0.39600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00001
2
0.00000
0.00049
-0.00034
3
0.00000
-0.00049
-0.00034
4
0.00000
-0.00057
0.00014
5
0.00000
0.00057
0.00014
6
0.00000
-0.00028
-0.00106
7
0.00000
0.00028
-0.00106
8
0.00000
0.03079
0.01265
9
0.00000
-0.03079
0.01265
10
0.00000
0.00000
-0.06693
11
0.00000
0.00000
0.00007
12
0.00000
0.00507
0.00428
13
0.00000
-0.00507
0.00428
14
0.00000
0.00752
-0.00049
15
0.00000
-0.00752
-0.00049
16
0.00000
-0.37190
-0.12903
17
0.00000
0.37193
-0.12904
18
0.00000
0.00000
0.77610