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)
-385.33887
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09476 b
(cm-1)
0.04104 c
(cm-1)
0.02864
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.36944
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)
-1.04600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.01574
2
0.00000
0.00021
-0.00206
3
0.00000
-0.00021
-0.00206
4
0.00000
-0.01952
0.00110
5
0.00000
0.01952
0.00110
6
0.00000
-0.00517
0.02226
7
0.00000
0.00517
0.02226
8
0.00000
0.10511
-0.02792
9
0.00000
-0.10511
-0.02792
10
0.00000
0.00000
0.09898
11
0.00000
0.00000
-0.01435
12
0.00000
-0.00269
-0.00174
13
0.00000
0.00269
-0.00174
14
0.00000
-0.02265
-0.00091
15
0.00000
0.02265
-0.00091
16
0.00000
0.25366
-0.46217
17
0.00000
-0.25366
-0.46217
18
0.00000
0.00000
0.11031