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)
-0.27200
Diff mu Y
(Debye)
-0.36000
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00178
0.00051
0.00000
2
-0.02918
0.00829
0.00000
3
0.00031
0.00022
0.00000
4
-0.00030
-0.00259
0.00000
5
0.00001
-0.00028
0.00000
6
0.00033
0.00148
0.00000
7
0.00030
0.00017
0.00000
8
0.03929
-0.01126
0.00000
9
-0.00215
0.00071
0.00000
10
-0.00083
0.00019
0.00000
11
0.00171
-0.00207
0.00000
12
-0.03056
-0.02734
0.00000
13
0.00296
0.00281
0.00000
14
0.00111
-0.00546
0.00000
15
0.00127
0.00080
0.00000
16
-0.01261
0.00476
0.00000
17
0.00383
-0.02245
0.00000
18
0.02779
0.02411
0.00000
19
0.02043
-0.00532
0.00000
20
0.34044
-0.09240
0.00000
21
0.02674
-0.00780
0.00000
22
0.01205
-0.00498
0.00000
23
-0.47355
0.14958
0.00000
24
-0.03548
-0.03436
0.00000
25
-0.01581
0.06303
0.00000
26
0.36030
0.33256
0.00000
27
-0.02044
-0.01757
0.00000
28
0.15366
-0.05053
0.00000
29
-0.05886
0.27893
0.00000
30
-0.32731
-0.28493
0.00000