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)
-692.28444
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00854 c
(cm-1)
0.00701
Dipole Moments
mu_x(Debye)
0.02298 mu_y
(Debye)
-0.00245 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.06200
Diff mu Y
(Debye)
-0.05400
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00618
-0.01338
0.00000
2
-0.00787
0.01565
0.00000
3
-0.01256
0.06503
0.00000
4
0.00168
-0.05951
0.00000
5
-0.02169
-0.05787
0.00000
6
0.00684
0.06535
0.00000
7
0.03527
-0.04752
0.00000
8
0.02552
-0.02587
0.00000
9
0.03818
0.02137
0.00000
10
0.01985
-0.04007
0.00000
11
-0.01611
0.03917
0.00000
12
-0.02893
0.05158
0.00000
13
-0.03307
0.05177
0.00000
14
-0.04859
-0.02655
0.00000
15
-0.02673
-0.01273
0.00000
16
-0.00866
0.05712
0.00000
17
0.06642
0.00925
0.00000
18
0.00526
-0.05406
0.00000
19
0.02012
0.09951
0.00000
20
-0.01379
0.01081
0.00000
21
0.00064
-0.14091
0.00000
22
0.06822
0.10734
0.00000
23
0.01930
-0.07133
0.00000
24
0.20610
-0.18220
0.00000
25
0.26059
0.04481
0.00000
26
0.09696
-0.07248
0.00000
27
0.03314
-0.09127
0.00000
28
-0.10116
-0.20563
0.00000
29
-0.30766
-0.06946
0.00000
30
-0.14684
0.10959
0.00000