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)
-385.85306
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09480 b
(cm-1)
0.04163 c
(cm-1)
0.02893
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.43892
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)
-0.26000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.13194
2
0.00000
0.10159
-0.06735
3
0.00000
-0.10159
-0.06735
4
0.00000
0.07758
-0.03536
5
0.00000
-0.07758
-0.03536
6
0.00000
0.01654
0.02930
7
0.00000
-0.01654
0.02930
8
0.00000
0.06254
0.02352
9
0.00000
-0.06254
0.02352
10
0.00000
0.00000
-0.04678
11
0.00000
0.00000
0.13024
12
0.00000
-0.06673
-0.10816
13
0.00000
0.06673
-0.10816
14
0.00000
0.09971
0.07289
15
0.00000
-0.09971
0.07289
16
0.00000
0.04496
0.08013
17
0.00000
-0.04496
0.08013
18
0.00000
0.00000
-0.04597