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)
0.81400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.02451
2
0.00000
0.00000
0.04353
3
0.00000
0.00000
-0.00502
4
0.00000
0.00000
0.02409
5
0.00000
0.00000
-0.00010
6
0.00000
0.00000
-0.01262
7
0.00000
0.00000
0.02885
8
0.00000
0.00000
-0.07860
9
0.00000
0.00000
0.02516
10
0.00000
0.00000
-0.02207
11
0.00000
0.00000
0.03974
12
0.00000
0.00000
-0.05217
13
0.00000
0.00000
0.00663
14
0.00000
0.00000
-0.00073
15
0.00000
0.00000
-0.04477
16
0.00000
0.00000
-0.04462
17
0.00000
0.00000
0.01654
18
0.00000
0.00000
0.00772
19
0.00000
0.00000
0.12910
20
0.00000
0.00000
-0.27651
21
0.00000
0.00000
-0.14153
22
0.00000
0.00000
0.13943
23
0.00000
0.00000
0.50002
24
0.00000
0.00000
-0.07432
25
0.00000
0.00000
0.02841
26
0.00000
0.00000
0.40808
27
0.00000
0.00000
0.33120
28
0.00000
0.00000
0.22007
29
0.00000
0.00000
0.03810
30
0.00000
0.00000
-0.19566