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)
-1.20800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.05841
2
0.00000
0.02684
-0.02283
3
0.00000
-0.02684
-0.02283
4
0.00000
-0.01970
0.00537
5
0.00000
0.01970
0.00537
6
0.00000
0.00030
0.00094
7
0.00000
-0.00030
0.00094
8
0.00000
-0.00559
-0.00170
9
0.00000
0.00559
-0.00170
10
0.00000
0.00000
0.00064
11
0.00000
0.00000
0.68571
12
0.00000
0.31248
0.25687
13
0.00000
-0.31248
0.25687
14
0.00000
0.22076
-0.05696
15
0.00000
-0.22076
-0.05696
16
0.00000
0.06645
0.02205
17
0.00000
-0.06645
0.02205
18
0.00000
0.00000
-0.00794