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)
-385.33887
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
C2v
Symmetry Elements
E
C2(z)
sigmav(xz)
sigmav(yz)
Rotational Constants
(cm-1)
0.09476 b
(cm-1)
0.04104 c
(cm-1)
0.02864
Dipole Moments
mu_x(Debye)
0.00000 mu_y
(Debye)
0.00000 mu_z
(Debye)
-0.36944
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)
0.65300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.02955
2
0.00000
0.04347
0.01092
3
0.00000
-0.04347
0.01092
4
0.00000
0.02171
0.07236
5
0.00000
-0.02171
0.07236
6
0.00000
0.02804
-0.00375
7
0.00000
-0.02804
-0.00375
8
0.00000
0.04472
-0.07845
9
0.00000
-0.04472
-0.07845
10
0.00000
0.00000
0.07382
11
0.00000
0.00000
-0.03941
12
0.00000
0.19957
-0.29028
13
0.00000
-0.19957
-0.29028
14
0.00000
-0.04522
-0.25624
15
0.00000
0.04522
-0.25624
16
0.00000
-0.05511
0.24603
17
0.00000
0.05511
0.24603
18
0.00000
0.00000
0.08765