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)
-0.00300
Diff mu Y
(Debye)
-0.11200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00345
-0.00887
0.00000
2
0.00715
0.00975
0.00000
3
-0.08470
0.01918
0.00000
4
-0.08483
-0.03736
0.00000
5
0.08732
-0.01857
0.00000
6
0.08775
0.03851
0.00000
7
-0.05371
0.04803
0.00000
8
-0.04594
-0.08526
0.00000
9
0.05263
-0.05003
0.00000
10
0.04256
0.09085
0.00000
11
0.01443
0.01194
0.00000
12
0.01362
-0.06096
0.00000
13
-0.02137
-0.01192
0.00000
14
-0.01571
0.06153
0.00000
15
-0.00394
-0.11889
0.00000
16
0.00750
0.11969
0.00000
17
-0.05336
0.10146
0.00000
18
-0.04682
-0.14144
0.00000
19
0.05313
-0.10551
0.00000
20
0.04281
0.15459
0.00000
21
0.07189
0.04361
0.00000
22
0.06141
-0.08930
0.00000
23
-0.08209
-0.04535
0.00000