Charge: 0
Inchi:1S/C14H9/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-3,5-10H
Electronic States
Energy
(eV)
-538.14555
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.07193 b
(cm-1)
0.01539 c
(cm-1)
0.01268
Dipole Moments
mu_x(Debye)
0.19464 mu_y
(Debye)
0.32252 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.51800
Diff mu Y
(Debye)
-0.08100
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04170
-0.01330
0.00000
2
0.04921
-0.01270
0.00000
3
-0.08584
-0.01898
0.00000
4
-0.07729
0.07171
0.00000
5
0.04111
-0.03414
0.00000
6
-0.02629
-0.02508
0.00000
7
0.03424
-0.02739
0.00000
8
0.02873
0.02054
0.00000
9
0.00912
0.01517
0.00000
10
0.02831
0.05852
0.00000
11
-0.00038
0.02470
0.00000
12
-0.01619
-0.02749
0.00000
13
-0.01115
-0.01828
0.00000
14
-0.04886
0.00334
0.00000
15
0.04682
0.38550
0.00000
16
0.05245
-0.37854
0.00000
17
0.02909
-0.07862
0.00000
18
0.02105
0.00931
0.00000
19
0.00659
0.22201
0.00000
20
0.02719
-0.36381
0.00000
21
0.01265
0.02947
0.00000
22
0.07539
-0.07890
0.00000
23
0.12839
0.05578
0.00000