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)
0.00000
Diff mu Z
(Debye)
0.05600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00531
2
0.00000
-0.06548
0.06979
3
0.00000
0.06548
0.06979
4
0.00000
0.10690
0.04466
5
0.00000
-0.10690
0.04466
6
0.00000
0.03847
0.01363
7
0.00000
-0.03847
0.01363
8
0.00000
0.02407
-0.07410
9
0.00000
-0.02407
-0.07410
10
0.00000
0.00000
-0.11686
11
0.00000
0.00000
0.00776
12
0.00000
0.01610
0.13492
13
0.00000
-0.01610
0.13492
14
0.00000
0.11196
0.05109
15
0.00000
-0.11196
0.05109
16
0.00000
0.03248
-0.10825
17
0.00000
-0.03248
-0.10825
18
0.00000
0.00000
-0.12059