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)
-385.33849
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09497 b
(cm-1)
0.04175 c
(cm-1)
0.02900
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.45804
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.36900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.07585
0.00000
2
0.00000
0.03546
0.03594
3
0.00000
0.03546
-0.03594
4
0.00000
-0.00028
0.01326
5
0.00000
-0.00029
-0.01326
6
0.00000
-0.02658
0.01616
7
0.00000
-0.02658
-0.01616
8
0.00000
0.06885
-0.05499
9
0.00000
0.06885
0.05499
10
0.00000
-0.03538
0.00000
11
0.00000
-0.22523
0.00000
12
0.00000
0.04212
-0.04390
13
0.00000
0.04214
0.04393
14
0.00000
-0.05043
-0.21411
15
0.00000
-0.05043
0.21408
16
0.00000
-0.10701
0.47650
17
0.00000
-0.10701
-0.47651
18
0.00000
-0.06396
0.00000