Charge: -1
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-1
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)
0.89700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.01408
2
0.00000
0.00000
-0.09850
3
0.00000
0.00000
0.04940
4
0.00000
0.00000
0.03256
5
0.00000
0.00000
-0.00518
6
0.00000
0.00000
0.05851
7
0.00000
0.00000
0.02800
8
0.00000
0.00000
0.00299
9
0.00000
0.00000
0.01871
10
0.00000
0.00000
-0.01946
11
0.00000
0.00000
-0.15357
12
0.00000
0.00000
0.00145
13
0.00000
0.00000
-0.02048
14
0.00000
0.00000
0.00648
15
0.00000
0.00000
0.12116
16
0.00000
0.00000
0.02309
17
0.00000
0.00000
0.02698
18
0.00000
0.00000
-0.01548
19
0.00000
0.00000
0.04326
20
0.00000
0.00000
-0.01211
21
0.00000
0.00000
-0.17584
22
0.00000
0.00000
-0.12951
23
0.00000
0.00000
0.03389
24
0.00000
0.00000
-0.07009
25
0.00000
0.00000
-0.12328
26
0.00000
0.00000
-0.11644
27
0.00000
0.00000
-0.17559
28
0.00000
0.00000
-0.12748
29
0.00000
0.00000
-0.09945
30
0.00000
0.00000
-0.13637
31
0.00000
0.00000
0.18593
32
0.00000
0.00000
-0.27889