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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
-0.05600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00735
2
0.00000
0.00000
0.00864
3
0.00000
0.00000
0.00429
4
0.00000
0.00000
-0.00343
5
0.00000
0.00000
-0.00030
6
0.00000
0.00000
0.00002
7
0.00000
0.00000
-0.00652
8
0.00000
0.00000
0.00357
9
0.00000
0.00000
-0.04423
10
0.00000
0.00000
0.05072
11
0.00000
0.00000
-0.00320
12
0.00000
0.00000
0.00123
13
0.00000
0.00000
0.07358
14
0.00000
0.00000
-0.08274
15
0.00000
0.00000
0.01830
16
0.00000
0.00000
-0.01162
17
0.00000
0.00000
-0.00733
18
0.00000
0.00000
0.01173
19
0.00000
0.00000
0.02133
20
0.00000
0.00000
-0.03652
21
0.00000
0.00000
0.31786
22
0.00000
0.00000
-0.34973
23
0.00000
0.00000
-0.01559
24
0.00000
0.00000
-0.48528
25
0.00000
0.00000
0.54878
26
0.00000
0.00000
-0.00558
27
0.00000
0.00000
-0.09796
28
0.00000
0.00000
0.06383
29
0.00000
0.00000
0.04109
30
0.00000
0.00000
-0.06600