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)
-0.06700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00087
2
0.00000
0.00000
-0.00977
3
0.00000
0.00000
0.00471
4
0.00000
0.00000
0.00216
5
0.00000
0.00000
0.00436
6
0.00000
0.00000
-0.00164
7
0.00000
0.00000
-0.01712
8
0.00000
0.00000
0.01637
9
0.00000
0.00000
-0.01376
10
0.00000
0.00000
0.01726
11
0.00000
0.00000
-0.00297
12
0.00000
0.00000
0.04624
13
0.00000
0.00000
-0.00413
14
0.00000
0.00000
0.05968
15
0.00000
0.00000
0.00296
16
0.00000
0.00000
-0.11262
17
0.00000
0.00000
-0.00017
18
0.00000
0.00000
-0.00238
19
0.00000
0.00000
0.00718
20
0.00000
0.00000
-0.00591
21
0.00000
0.00000
0.09702
22
0.00000
0.00000
-0.08634
23
0.00000
0.00000
0.07589
24
0.00000
0.00000
-0.08563
25
0.00000
0.00000
-0.27766
26
0.00000
0.00000
0.01096
27
0.00000
0.00000
-0.35980
28
0.00000
0.00000
0.71975
29
0.00000
0.00000
-0.04192
30
0.00000
0.00000
0.01283
31
0.00000
0.00000
0.00675
32
0.00000
0.00000
0.03152