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)
-0.13300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00998
2
0.00000
-0.01601
0.03607
3
0.00000
0.01602
0.03606
4
0.00000
-0.00071
-0.03143
5
0.00000
0.00073
-0.03144
6
0.00000
0.02844
-0.11231
7
0.00000
-0.02848
-0.11230
8
0.00000
0.09541
0.01120
9
0.00000
-0.09540
0.01119
10
0.00000
0.00000
0.09153
11
0.00000
-0.00004
-0.00759
12
0.00000
-0.07886
0.15654
13
0.00000
0.07889
0.15658
14
0.00000
0.05872
0.21590
15
0.00000
-0.05866
0.21570
16
0.00000
0.03669
0.23991
17
0.00000
-0.03669
0.23987
18
0.00000
0.00002
0.10941