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)
-385.86921
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09470 b
(cm-1)
0.04162 c
(cm-1)
0.02891
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.41127
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)
-1.19400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00003
-0.03717
2
0.00000
0.02963
0.08489
3
0.00000
-0.02967
0.08490
4
0.00000
-0.03417
-0.13477
5
0.00000
0.03419
-0.13481
6
0.00000
0.05985
0.08652
7
0.00000
-0.05986
0.08657
8
0.00000
-0.00721
-0.02568
9
0.00000
0.00721
-0.02567
10
0.00000
0.00001
-0.00271
11
0.00000
-0.00004
-0.03761
12
0.00000
0.05670
-0.01817
13
0.00000
-0.05671
-0.01813
14
0.00000
0.02198
0.12153
15
0.00000
-0.02198
0.12161
16
0.00000
-0.03056
0.02401
17
0.00000
0.03054
0.02399
18
0.00000
-0.00001
-0.00390