Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+2
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)
-0.97100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00282
0.00000
2
0.00000
-0.04174
0.03538
3
0.00000
-0.04174
-0.03538
4
0.00000
-0.02033
0.00577
5
0.00000
-0.02033
-0.00577
6
0.00000
0.00053
0.00088
7
0.00000
0.00053
-0.00088
8
0.00000
0.00051
0.00029
9
0.00000
0.00051
-0.00029
10
0.00000
0.00002
0.00000
11
0.00000
-0.00439
0.00000
12
0.00000
0.48872
0.40108
13
0.00000
0.48872
-0.40108
14
0.00000
0.22971
-0.05063
15
0.00000
0.22971
0.05063
16
0.00000
-0.00647
-0.00168
17
0.00000
-0.00647
0.00168
18
0.00000
-0.00024
0.00000