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)
-385.60867
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09587 b
(cm-1)
0.04112 c
(cm-1)
0.02878
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.18402
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.06000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.04177
0.00000
2
0.00000
-0.03659
0.05965
3
0.00000
-0.03659
-0.05965
4
0.00000
0.11821
-0.00799
5
0.00000
0.11821
0.00799
6
0.00000
0.01472
0.04418
7
0.00000
0.01472
-0.04418
8
0.00000
-0.07018
-0.09926
9
0.00000
-0.07018
0.09926
10
0.00000
-0.02310
0.00000
11
0.00000
0.06238
0.00000
12
0.00000
-0.09094
0.00913
13
0.00000
-0.09094
-0.00913
14
0.00000
0.12398
0.01427
15
0.00000
0.12398
-0.01427
16
0.00000
-0.06789
-0.11218
17
0.00000
-0.06789
0.11218
18
0.00000
0.15648
0.00000