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)
-692.28642
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.03906 b
(cm-1)
0.00844 c
(cm-1)
0.00694
Dipole Moments
mu_x(Debye)
-0.13629 mu_y
(Debye)
0.70909 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
-0.21500
Diff mu Y
(Debye)
0.58200
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.02318
-0.07289
0.00000
2
0.00293
0.02276
0.00000
3
-0.00317
0.02495
0.00000
4
0.05040
0.03055
0.00000
5
0.01762
0.05038
0.00000
6
-0.01116
-0.03380
0.00000
7
-0.01452
0.02123
0.00000
8
-0.05231
-0.07959
0.00000
9
-0.01208
0.01919
0.00000
10
-0.01664
-0.00481
0.00000
11
-0.07798
0.04428
0.00000
12
0.07421
-0.00729
0.00000
13
0.00502
-0.04029
0.00000
14
0.03692
0.02523
0.00000
15
0.06433
-0.04756
0.00000
16
-0.05717
-0.01654
0.00000
17
0.06723
0.03441
0.00000
18
0.01138
-0.04991
0.00000
19
0.03360
0.14197
0.00000
20
-0.00441
-0.01997
0.00000
21
-0.02787
-0.02027
0.00000
22
-0.02419
-0.01422
0.00000
23
0.04536
0.22594
0.00000
24
-0.08640
0.05235
0.00000
25
-0.12795
-0.01257
0.00000
26
-0.08324
0.17127
0.00000
27
-0.13319
0.17891
0.00000
28
-0.01915
0.11663
0.00000
29
-0.14937
-0.00769
0.00000
30
-0.15948
0.13651
0.00000