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)
-0.06600
Diff mu Y
(Debye)
0.01200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00158
0.00156
0.00000
2
-0.00171
-0.00115
0.00000
3
-0.02182
0.02234
0.00000
4
0.01798
0.02270
0.00000
5
0.00991
-0.02273
0.00000
6
-0.00839
-0.01922
0.00000
7
0.04840
0.03740
0.00000
8
-0.04199
0.03896
0.00000
9
-0.03343
-0.02681
0.00000
10
0.01772
-0.01847
0.00000
11
0.09720
-0.06370
0.00000
12
-0.10074
-0.06390
0.00000
13
-0.06658
0.03985
0.00000
14
0.08101
0.02910
0.00000
15
-0.00207
-0.01651
0.00000
16
0.00011
-0.01729
0.00000
17
0.05809
0.27063
0.00000
18
-0.04662
0.27428
0.00000
19
-0.03949
-0.17279
0.00000
20
0.21575
-0.00597
0.00000
21
-0.22333
-0.00084
0.00000
22
-0.13869
0.00474
0.00000
23
0.22426
-0.04976
0.00000