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)
-768.43015
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02846 b
(cm-1)
0.00844 c
(cm-1)
0.00651
Dipole Moments
mu_x(Debye)
0.18438 mu_y
(Debye)
0.13618 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)
0.67600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.04733
2
0.00000
0.00000
0.02976
3
0.00000
0.00000
0.04972
4
0.00000
0.00000
-0.01765
5
0.00000
0.00000
0.05460
6
0.00000
0.00000
-0.00125
7
0.00000
0.00000
-0.01051
8
0.00000
0.00000
0.00146
9
0.00000
0.00000
-0.01680
10
0.00000
0.00000
-0.01741
11
0.00000
0.00000
-0.07522
12
0.00000
0.00000
0.00932
13
0.00000
0.00000
-0.07975
14
0.00000
0.00000
-0.00671
15
0.00000
0.00000
0.11052
16
0.00000
0.00000
-0.00558
17
0.00000
0.00000
0.04856
18
0.00000
0.00000
0.03259
19
0.00000
0.00000
-0.02549
20
0.00000
0.00000
-0.09511
21
0.00000
0.00000
-0.03751
22
0.00000
0.00000
0.06735
23
0.00000
0.00000
0.00542
24
0.00000
0.00000
0.16347
25
0.00000
0.00000
-0.02315
26
0.00000
0.00000
0.25764
27
0.00000
0.00000
0.04891
28
0.00000
0.00000
0.01503
29
0.00000
0.00000
0.27953
30
0.00000
0.00000
-0.28455
31
0.00000
0.00000
-0.13892
32
0.00000
0.00000
0.38829