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)
-691.62999
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03982 b
(cm-1)
0.00842 c
(cm-1)
0.00695
Dipole Moments
mu_x(Debye)
-0.27351 mu_y
(Debye)
0.67795 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)
0.34900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.03387
2
0.00000
0.00000
-0.06392
3
0.00000
0.00000
0.05943
4
0.00000
0.00000
0.05492
5
0.00000
0.00000
-0.05063
6
0.00000
0.00000
0.01306
7
0.00000
0.00000
-0.08216
8
0.00000
0.00000
0.02239
9
0.00000
0.00000
-0.03963
10
0.00000
0.00000
0.07133
11
0.00000
0.00000
-0.03330
12
0.00000
0.00000
-0.02786
13
0.00000
0.00000
0.06795
14
0.00000
0.00000
-0.08832
15
0.00000
0.00000
-0.02454
16
0.00000
0.00000
0.04347
17
0.00000
0.00000
-0.07665
18
0.00000
0.00000
0.07738
19
0.00000
0.00000
0.05457
20
0.00000
0.00000
-0.21291
21
0.00000
0.00000
-0.07210
22
0.00000
0.00000
0.23490
23
0.00000
0.00000
0.02955
24
0.00000
0.00000
0.22237
25
0.00000
0.00000
-0.16101
26
0.00000
0.00000
-0.02121
27
0.00000
0.00000
0.07944
28
0.00000
0.00000
0.23628
29
0.00000
0.00000
-0.10690
30
0.00000
0.00000
0.23152