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)
0.00000
Diff mu Z
(Debye)
0.19200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.02041
2
0.00000
-0.05151
0.06534
3
0.00000
0.05151
0.06534
4
0.00000
0.11548
0.04371
5
0.00000
-0.11548
0.04371
6
0.00000
0.07145
-0.00608
7
0.00000
-0.07145
-0.00608
8
0.00000
-0.00129
-0.07369
9
0.00000
0.00129
-0.07369
10
0.00000
0.00000
-0.08451
11
0.00000
0.00000
0.02330
12
0.00000
0.00789
0.12308
13
0.00000
-0.00789
0.12308
14
0.00000
0.12664
0.08029
15
0.00000
-0.12664
0.08029
16
0.00000
0.01716
-0.13859
17
0.00000
-0.01716
-0.13859
18
0.00000
0.00000
-0.08696