Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/q+1
Electronic States
Energy
(eV)
-384.61791
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09639 b
(cm-1)
0.04048 c
(cm-1)
0.02851
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.27338
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)
-0.04000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00810
2
0.00000
0.05614
0.04654
3
0.00000
-0.05614
0.04654
4
0.00000
0.01401
-0.05128
5
0.00000
-0.01401
-0.05128
6
0.00000
-0.05582
0.03475
7
0.00000
0.05582
0.03475
8
0.00000
-0.02338
-0.02044
9
0.00000
0.02338
-0.02044
10
0.00000
0.00000
0.00579
11
0.00000
0.00000
-0.01079
12
0.00000
-0.27925
0.32363
13
0.00000
0.27925
0.32363
14
0.00000
-0.05679
-0.38433
15
0.00000
0.05679
-0.38434
16
0.00000
-0.02343
-0.03647
17
0.00000
0.02343
-0.03646
18
0.00000
0.00000
0.00497