Charge: 1
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+1
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)
-0.20600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.03938
0.00000
2
0.00000
-0.01409
0.01160
3
0.00000
-0.01409
-0.01160
4
0.00000
0.00027
0.04704
5
0.00000
0.00027
-0.04704
6
0.00000
0.03917
0.07395
7
0.00000
0.03917
-0.07395
8
0.00000
-0.02365
0.07777
9
0.00000
-0.02365
-0.07777
10
0.00000
-0.00642
0.00000
11
0.00000
0.05725
0.00000
12
0.00000
0.14693
-0.21212
13
0.00000
0.14693
0.21212
14
0.00000
-0.09158
-0.36434
15
0.00000
-0.09158
0.36434
16
0.00000
0.08567
-0.25278
17
0.00000
0.08567
0.25278
18
0.00000
0.16541
0.00000