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)
1.34900
Diff mu Y
(Debye)
0.80600
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
-0.02564
-0.02710
0.00000
2
0.02718
0.01828
0.00000
3
0.04002
-0.01759
0.00000
4
-0.02221
0.04289
0.00000
5
0.06690
0.05833
0.00000
6
-0.05873
-0.05957
0.00000
7
-0.00518
0.03733
0.00000
8
0.00442
-0.10329
0.00000
9
-0.03720
-0.06714
0.00000
10
0.04951
0.07476
0.00000
11
0.01011
-0.04775
0.00000
12
-0.04394
0.09733
0.00000
13
0.03614
0.02414
0.00000
14
-0.07927
-0.04088
0.00000
15
0.00201
-0.00783
0.00000
16
0.00998
0.00210
0.00000
17
-0.04021
-0.00014
0.00000
18
0.02829
0.00038
0.00000
19
-0.00164
0.06814
0.00000
20
0.01226
-0.05173
0.00000
21
0.01424
0.13400
0.00000
22
-0.00744
-0.13556
0.00000
23
0.07996
0.12132
0.00000
24
0.03019
0.03871
0.00000
25
0.12622
0.00299
0.00000
26
0.12869
-0.07959
0.00000
27
-0.01463
0.01301
0.00000
28
0.01621
0.01738
0.00000
29
0.06192
0.02445
0.00000
30
0.00415
0.03457
0.00000