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)
0.68900
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.11481
2
0.00000
0.00000
0.08139
3
0.00000
0.00000
0.05510
4
0.00000
0.00000
-0.02554
5
0.00000
0.00000
0.05555
6
0.00000
0.00000
-0.01669
7
0.00000
0.00000
0.00352
8
0.00000
0.00000
0.03100
9
0.00000
0.00000
-0.00935
10
0.00000
0.00000
0.02931
11
0.00000
0.00000
-0.04530
12
0.00000
0.00000
-0.03234
13
0.00000
0.00000
-0.00240
14
0.00000
0.00000
-0.03853
15
0.00000
0.00000
0.07070
16
0.00000
0.00000
-0.02294
17
0.00000
0.00000
-0.01442
18
0.00000
0.00000
-0.04291
19
0.00000
0.00000
-0.00302
20
0.00000
0.00000
-0.03883
21
0.00000
0.00000
-0.18827
22
0.00000
0.00000
-0.08453
23
0.00000
0.00000
-0.13371
24
0.00000
0.00000
-0.06500
25
0.00000
0.00000
0.22194
26
0.00000
0.00000
-0.16881
27
0.00000
0.00000
0.23478
28
0.00000
0.00000
0.30061
29
0.00000
0.00000
0.25798
30
0.00000
0.00000
0.20064
31
0.00000
0.00000
0.28804
32
0.00000
0.00000
0.09477