Charge: 2
Inchi:1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H/q+2
Electronic States
Energy
(eV)
-767.79023
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02870 b
(cm-1)
0.00846 c
(cm-1)
0.00654
Dipole Moments
mu_x(Debye)
-0.17956 mu_y
(Debye)
-0.00356 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)
-0.02200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.08508
2
0.00000
0.00000
-0.03059
3
0.00000
0.00000
0.02626
4
0.00000
0.00000
0.03664
5
0.00000
0.00000
0.01458
6
0.00000
0.00000
0.03226
7
0.00000
0.00000
0.02003
8
0.00000
0.00000
-0.05592
9
0.00000
0.00000
0.03548
10
0.00000
0.00000
-0.06346
11
0.00000
0.00000
0.06047
12
0.00000
0.00000
0.07099
13
0.00000
0.00000
0.02216
14
0.00000
0.00000
0.07547
15
0.00000
0.00000
-0.04692
16
0.00000
0.00000
-0.10061
17
0.00000
0.00000
0.02442
18
0.00000
0.00000
-0.06353
19
0.00000
0.00000
0.07938
20
0.00000
0.00000
-0.04989
21
0.00000
0.00000
0.05969
22
0.00000
0.00000
-0.14769
23
0.00000
0.00000
0.10929
24
0.00000
0.00000
-0.14717
25
0.00000
0.00000
0.20165
26
0.00000
0.00000
0.06262
27
0.00000
0.00000
0.19372
28
0.00000
0.00000
-0.20597
29
0.00000
0.00000
0.15602
30
0.00000
0.00000
-0.20308
31
0.00000
0.00000
0.02668
32
0.00000
0.00000
-0.13135