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)
0.30000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.04746
2
0.00000
0.00000
-0.00181
3
0.00000
0.00000
0.06364
4
0.00000
0.00000
0.03395
5
0.00000
0.00000
-0.03011
6
0.00000
0.00000
-0.00038
7
0.00000
0.00000
0.06410
8
0.00000
0.00000
-0.06063
9
0.00000
0.00000
0.02249
10
0.00000
0.00000
0.02242
11
0.00000
0.00000
0.08386
12
0.00000
0.00000
0.04835
13
0.00000
0.00000
0.00363
14
0.00000
0.00000
-0.02093
15
0.00000
0.00000
-0.11435
16
0.00000
0.00000
0.07110
17
0.00000
0.00000
0.04557
18
0.00000
0.00000
-0.11681
19
0.00000
0.00000
-0.07252
20
0.00000
0.00000
-0.03423
21
0.00000
0.00000
0.06235
22
0.00000
0.00000
0.05013
23
0.00000
0.00000
-0.19944
24
0.00000
0.00000
0.01461
25
0.00000
0.00000
-0.04074
26
0.00000
0.00000
-0.01199
27
0.00000
0.00000
-0.32234
28
0.00000
0.00000
0.06844
29
0.00000
0.00000
0.01566
30
0.00000
0.00000
-0.32321