Charge: 0
Inchi:1S/C14H9/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-7,9-10H
Electronic States
Energy
(eV)
-538.14563
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.07406 b
(cm-1)
0.01508 c
(cm-1)
0.01253
Dipole Moments
mu_x(Debye)
0.27998 mu_y
(Debye)
0.13249 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.13000
Diff mu Y
(Debye)
0.08900
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04887
0.03151
0.00000
2
-0.01022
-0.00632
0.00000
3
0.01147
-0.07291
0.00000
4
-0.04121
0.00926
0.00000
5
0.07757
-0.02310
0.00000
6
-0.06861
0.09913
0.00000
7
0.00555
-0.03594
0.00000
8
0.01876
0.03814
0.00000
9
0.00910
0.03769
0.00000
10
-0.03462
-0.00781
0.00000
11
-0.03825
0.01105
0.00000
12
-0.00597
-0.00750
0.00000
13
-0.05622
-0.01247
0.00000
14
0.07695
-0.05797
0.00000
15
0.05583
-0.32393
0.00000
16
-0.01061
-0.19539
0.00000
17
0.00290
0.27489
0.00000
18
0.01548
-0.08569
0.00000
19
0.01107
0.12069
0.00000
20
0.17690
0.12979
0.00000
21
0.09727
-0.06542
0.00000
22
-0.03928
-0.00254
0.00000
23
-0.22841
0.11482
0.00000