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)
0.09800
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.05394
2
0.00000
0.00000
0.00769
3
0.00000
0.00000
0.01583
4
0.00000
0.00000
-0.03974
5
0.00000
0.00000
0.09500
6
0.00000
0.00000
-0.02645
7
0.00000
0.00000
0.05344
8
0.00000
0.00000
0.00497
9
0.00000
0.00000
0.00730
10
0.00000
0.00000
-0.09620
11
0.00000
0.00000
-0.07365
12
0.00000
0.00000
-0.06527
13
0.00000
0.00000
0.07113
14
0.00000
0.00000
0.04896
15
0.00000
0.00000
-0.06962
16
0.00000
0.00000
0.04840
17
0.00000
0.00000
-0.07353
18
0.00000
0.00000
0.05863
19
0.00000
0.00000
0.04847
20
0.00000
0.00000
-0.08113
21
0.00000
0.00000
0.08508
22
0.00000
0.00000
-0.00342
23
0.00000
0.00000
0.00376
24
0.00000
0.00000
-0.19000
25
0.00000
0.00000
-0.13902
26
0.00000
0.00000
0.13413
27
0.00000
0.00000
0.09987
28
0.00000
0.00000
0.10391
29
0.00000
0.00000
0.12715
30
0.00000
0.00000
0.16035
31
0.00000
0.00000
-0.10544
32
0.00000
0.00000
-0.13562