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)
-385.71438
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09692 b
(cm-1)
0.04154 c
(cm-1)
0.02908
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.16806
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.17500
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.00174
0.00000
2
0.00000
0.02802
-0.02126
3
0.00000
0.02802
0.02126
4
0.00000
-0.04436
0.00877
5
0.00000
-0.04436
-0.00877
6
0.00000
0.00040
0.00119
7
0.00000
0.00040
-0.00119
8
0.00000
0.00628
0.00203
9
0.00000
0.00628
-0.00203
10
0.00000
-0.00079
0.00000
11
0.00000
0.00165
0.00000
12
0.00000
-0.32164
-0.25922
13
0.00000
-0.32164
0.25922
14
0.00000
0.51805
-0.11160
15
0.00000
0.51805
0.11160
16
0.00000
-0.06754
-0.02086
17
0.00000
-0.06754
0.02086
18
0.00000
0.00062
0.00000