Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-3,5-8H,4H2/q+2
Electronic States
Energy
(eV)
-384.61791
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09639 b
(cm-1)
0.04048 c
(cm-1)
0.02851
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
0.27338
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.27300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.03332
0.00000
2
0.00000
0.00173
-0.01162
3
0.00000
0.00173
0.01162
4
0.00000
0.02879
-0.02663
5
0.00000
0.02879
0.02663
6
0.00000
-0.07511
-0.05124
7
0.00000
-0.07511
0.05123
8
0.00000
0.01251
-0.03181
9
0.00000
0.01251
0.03181
10
0.00000
0.04397
0.00000
11
0.00000
-0.09266
0.00000
12
0.00000
-0.01161
0.03057
13
0.00000
-0.01161
-0.03057
14
0.00000
0.14586
0.49386
15
0.00000
0.14586
-0.49386
16
0.00000
-0.07255
0.22886
17
0.00000
-0.07255
-0.22886
18
0.00000
-0.18720
0.00000