Charge: 2
Inchi:1S/C10H9/c1-2-5-9-7-4-8-10(9)6-3-1/h1-7H,8H2/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)
0.00000
Diff mu Z
(Debye)
-0.70700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.01752
2
0.00000
-0.00815
-0.01633
3
0.00000
0.00815
-0.01633
4
0.00000
-0.01216
-0.00071
5
0.00000
0.01216
-0.00071
6
0.00000
-0.01343
0.03403
7
0.00000
0.01343
0.03403
8
0.00000
0.08491
-0.02939
9
0.00000
-0.08491
-0.02939
10
0.00000
0.00000
0.09948
11
0.00000
0.00000
0.01907
12
0.00000
0.04263
-0.06001
13
0.00000
-0.04263
-0.06001
14
0.00000
-0.02811
-0.06324
15
0.00000
0.02811
-0.06324
16
0.00000
0.24320
-0.49160
17
0.00000
-0.24320
-0.49160
18
0.00000
0.00000
0.11277