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)
-0.09100
Diff mu Y
(Debye)
-0.07300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.00477
-0.00079
0.00000
2
0.02641
-0.07246
0.00000
3
0.03758
-0.05373
0.00000
4
0.02094
-0.07594
0.00000
5
-0.02589
0.00904
0.00000
6
-0.02190
-0.00413
0.00000
7
0.02692
-0.04690
0.00000
8
-0.08354
0.00409
0.00000
9
-0.02659
0.02351
0.00000
10
0.02121
0.02719
0.00000
11
-0.06630
0.03804
0.00000
12
-0.12177
-0.00114
0.00000
13
0.02438
0.04056
0.00000
14
0.02646
0.04102
0.00000
15
0.05594
-0.03827
0.00000
16
0.08960
-0.02899
0.00000
17
0.01495
0.06066
0.00000
18
0.00616
0.06910
0.00000
19
0.00551
0.03503
0.00000
20
0.01265
-0.12053
0.00000
21
-0.03185
0.00295
0.00000
22
0.02907
0.05907
0.00000
23
-0.05430
0.09843
0.00000
24
0.04780
0.01745
0.00000
25
0.01291
0.03841
0.00000
26
-0.10271
-0.02157
0.00000
27
0.02178
0.00350
0.00000
28
0.07563
-0.07091
0.00000
29
-0.06000
0.04474
0.00000
30
0.04633
0.02231
0.00000