Charge: 2
Inchi:1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H/q+2
Electronic States
Energy
(eV)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.21100
Diff mu Y
(Debye)
-0.31200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.05360
-0.05323
0.00000
2
-0.06590
0.03766
0.00000
3
-0.03649
-0.04116
0.00000
4
0.01668
0.03151
0.00000
5
0.02211
-0.00368
0.00000
6
-0.02527
0.00378
0.00000
7
-0.03589
-0.06139
0.00000
8
0.13257
-0.02652
0.00000
9
0.05793
0.02554
0.00000
10
-0.02393
-0.00175
0.00000
11
-0.01352
0.00571
0.00000
12
0.03529
-0.03124
0.00000
13
0.02044
0.03897
0.00000
14
-0.00377
-0.02930
0.00000
15
-0.03708
-0.05585
0.00000
16
0.05373
-0.02800
0.00000
17
-0.02220
0.09665
0.00000
18
-0.00553
0.08437
0.00000
19
-0.06873
-0.10348
0.00000
20
-0.07178
0.01250
0.00000
21
0.06416
0.04754
0.00000
22
-0.01469
0.02790
0.00000
23
0.12169
-0.05714
0.00000
24
-0.03411
0.09642
0.00000
25
-0.02415
-0.03291
0.00000
26
0.00052
0.00682
0.00000
27
-0.09510
0.00639
0.00000
28
0.04098
-0.05363
0.00000
29
-0.11747
0.07897
0.00000
30
0.01319
0.06507
0.00000