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)
-692.03603
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03932 b
(cm-1)
0.00852 c
(cm-1)
0.00700
Dipole Moments
mu_x(Debye)
0.12919 mu_y
(Debye)
-0.56125 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)
0.31100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.07882
2
0.00000
0.00000
-0.10684
3
0.00000
0.00000
-0.03531
4
0.00000
0.00000
0.04871
5
0.00000
0.00000
-0.05532
6
0.00000
0.00000
0.06532
7
0.00000
0.00000
0.01147
8
0.00000
0.00000
-0.01088
9
0.00000
0.00000
0.05179
10
0.00000
0.00000
-0.04821
11
0.00000
0.00000
0.01385
12
0.00000
0.00000
-0.03026
13
0.00000
0.00000
0.01935
14
0.00000
0.00000
-0.02614
15
0.00000
0.00000
0.00114
16
0.00000
0.00000
0.00416
17
0.00000
0.00000
-0.01007
18
0.00000
0.00000
-0.00791
19
0.00000
0.00000
-0.33305
20
0.00000
0.00000
0.48567
21
0.00000
0.00000
-0.24997
22
0.00000
0.00000
0.21467
23
0.00000
0.00000
0.03587
24
0.00000
0.00000
-0.15362
25
0.00000
0.00000
0.20112
26
0.00000
0.00000
0.18546
27
0.00000
0.00000
-0.04042
28
0.00000
0.00000
-0.00677
29
0.00000
0.00000
0.05997
30
0.00000
0.00000
0.03349