Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/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)
0.26200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00369
2
0.00000
0.05695
0.04038
3
0.00000
-0.05695
0.04039
4
0.00000
0.03771
-0.03604
5
0.00000
-0.03771
-0.03604
6
0.00000
-0.06765
0.00292
7
0.00000
0.06765
0.00292
8
0.00000
-0.02084
-0.02337
9
0.00000
0.02084
-0.02338
10
0.00000
0.00000
0.02490
11
0.00000
0.00001
0.00206
12
0.00000
-0.32116
0.36373
13
0.00000
0.32116
0.36373
14
0.00000
-0.01971
-0.31196
15
0.00000
0.01971
-0.31197
16
0.00000
-0.01502
-0.04399
17
0.00000
0.01503
-0.04394
18
0.00000
0.00000
0.02550