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)
-0.61000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.00000
-0.01701
0.00000
2
0.00000
0.00949
0.00710
3
0.00000
0.00949
-0.00710
4
0.00000
-0.00352
0.00319
5
0.00000
-0.00352
-0.00319
6
0.00000
-0.00453
0.01819
7
0.00000
-0.00453
-0.01819
8
0.00000
-0.04987
0.03367
9
0.00000
-0.04986
-0.03367
10
0.00000
0.08801
0.00000
11
0.00000
-0.02629
0.00000
12
0.00000
0.01015
-0.00660
13
0.00000
0.01015
0.00661
14
0.00000
-0.01553
-0.04442
15
0.00000
-0.01553
0.04442
16
0.00000
-0.16646
0.37254
17
0.00000
-0.16646
-0.37254
18
0.00000
0.67802
0.00000