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)
0.43900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00835
2
0.00000
-0.01424
-0.01967
3
0.00000
0.01424
-0.01967
4
0.00000
0.02426
0.00270
5
0.00000
-0.02426
0.00270
6
0.00000
-0.13193
0.01959
7
0.00000
0.13193
0.01959
8
0.00000
-0.00257
-0.08478
9
0.00000
0.00257
-0.08478
10
0.00000
0.00000
0.06766
11
0.00000
0.00000
0.01397
12
0.00000
-0.00009
0.00538
13
0.00000
0.00009
0.00538
14
0.00000
0.09761
0.35392
15
0.00000
-0.09761
0.35392
16
0.00000
-0.06389
0.12391
17
0.00000
0.06389
0.12391
18
0.00000
0.00000
0.07103