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)
-0.06600
Diff mu Y
(Debye)
-0.27800
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.04406
-0.00706
0.00000
2
0.04508
-0.02957
0.00000
3
-0.02556
0.01568
0.00000
4
-0.01842
0.01276
0.00000
5
-0.03443
-0.01477
0.00000
6
-0.02409
0.03146
0.00000
7
-0.05668
0.01122
0.00000
8
0.00355
-0.02424
0.00000
9
0.04504
-0.05184
0.00000
10
0.05847
0.01386
0.00000
11
-0.02628
-0.03837
0.00000
12
0.02709
0.03489
0.00000
13
-0.02101
0.02947
0.00000
14
-0.02790
-0.00634
0.00000
15
0.04172
0.04980
0.00000
16
0.00527
-0.02497
0.00000
17
-0.01847
-0.01553
0.00000
18
0.04078
0.03035
0.00000
19
0.06046
0.07389
0.00000
20
0.01609
-0.13072
0.00000
21
-0.00877
-0.24029
0.00000
22
0.11217
0.19624
0.00000
23
-0.08117
-0.28822
0.00000
24
-0.20516
0.22338
0.00000
25
-0.27269
-0.06949
0.00000
26
-0.13343
0.20564
0.00000
27
-0.01306
0.11239
0.00000
28
-0.05386
-0.21622
0.00000
29
-0.19435
-0.04883
0.00000
30
0.08077
-0.01763
0.00000