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)
0.32400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.03294
2
0.00000
0.00000
-0.03046
3
0.00000
0.00000
-0.01315
4
0.00000
0.00000
0.01384
5
0.00000
0.00000
-0.01538
6
0.00000
0.00000
-0.01962
7
0.00000
0.00000
0.00531
8
0.00000
0.00000
-0.02206
9
0.00000
0.00000
0.04448
10
0.00000
0.00000
0.03855
11
0.00000
0.00000
-0.00486
12
0.00000
0.00000
0.03259
13
0.00000
0.00000
-0.08412
14
0.00000
0.00000
-0.01374
15
0.00000
0.00000
0.07257
16
0.00000
0.00000
0.01020
17
0.00000
0.00000
-0.01915
18
0.00000
0.00000
-0.06248
19
0.00000
0.00000
0.01318
20
0.00000
0.00000
-0.00265
21
0.00000
0.00000
0.05230
22
0.00000
0.00000
0.09344
23
0.00000
0.00000
-0.29785
24
0.00000
0.00000
-0.27395
25
0.00000
0.00000
-0.25699
26
0.00000
0.00000
0.49134
27
0.00000
0.00000
0.09310
28
0.00000
0.00000
-0.05561
29
0.00000
0.00000
0.08375
30
0.00000
0.00000
0.32124
31
0.00000
0.00000
0.22663
32
0.00000
0.00000
-0.19175