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)
0.76500
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.01774
2
0.00000
0.00000
0.00589
3
0.00000
0.00000
-0.09528
4
0.00000
0.00000
0.07043
5
0.00000
0.00000
0.01836
6
0.00000
0.00000
0.01007
7
0.00000
0.00000
0.14600
8
0.00000
0.00000
-0.02837
9
0.00000
0.00000
-0.00830
10
0.00000
0.00000
-0.01638
11
0.00000
0.00000
-0.09545
12
0.00000
0.00000
0.03234
13
0.00000
0.00000
-0.01053
14
0.00000
0.00000
-0.01564
15
0.00000
0.00000
-0.03292
16
0.00000
0.00000
0.01939
17
0.00000
0.00000
-0.06378
18
0.00000
0.00000
-0.00613
19
0.00000
0.00000
0.17868
20
0.00000
0.00000
-0.14643
21
0.00000
0.00000
0.02885
22
0.00000
0.00000
0.12346
23
0.00000
0.00000
-0.09804
24
0.00000
0.00000
0.11087
25
0.00000
0.00000
0.13612
26
0.00000
0.00000
0.05951
27
0.00000
0.00000
-0.13115
28
0.00000
0.00000
0.19677
29
0.00000
0.00000
0.21113
30
0.00000
0.00000
0.37811