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)
-385.33849
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09497 b
(cm-1)
0.04175 c
(cm-1)
0.02900
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.45804
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.11900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
0.07906
0.00000
2
0.00000
-0.04859
0.02006
3
0.00000
-0.04859
-0.02006
4
0.00000
0.02084
0.03925
5
0.00000
0.02083
-0.03925
6
0.00000
-0.04350
0.10743
7
0.00000
-0.04350
-0.10743
8
0.00000
0.02156
0.03285
9
0.00000
0.02156
-0.03285
10
0.00000
0.02967
0.00000
11
0.00000
0.44947
0.00000
12
0.00000
-0.09298
0.02998
13
0.00000
-0.09298
-0.02997
14
0.00000
0.02435
0.07823
15
0.00000
0.02435
-0.07823
16
0.00000
-0.01749
0.16092
17
0.00000
-0.01749
-0.16092
18
0.00000
-0.38845
0.00000