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)
-385.87618
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09453 b
(cm-1)
0.04092 c
(cm-1)
0.02856
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.38427
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
-0.52200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.02085
0.00000
2
0.00000
-0.01467
-0.03536
3
0.00000
-0.01467
0.03536
4
0.00000
-0.03699
-0.02658
5
0.00000
-0.03699
0.02658
6
0.00000
0.07847
0.00465
7
0.00000
0.07847
-0.00465
8
0.00000
-0.00746
-0.02867
9
0.00000
-0.00746
0.02867
10
0.00000
-0.03537
0.00000
11
0.00000
0.30485
0.00000
12
0.00000
-0.18007
0.23884
13
0.00000
-0.18007
-0.23884
14
0.00000
-0.13077
-0.44719
15
0.00000
-0.13077
0.44719
16
0.00000
0.00992
-0.08217
17
0.00000
0.00992
0.08217
18
0.00000
0.00925
0.00000