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)
-768.18063
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02857 b
(cm-1)
0.00852 c
(cm-1)
0.00656
Dipole Moments
mu_x(Debye)
-0.12448 mu_y
(Debye)
-0.13148 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)
-0.46100
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.11036
2
0.00000
0.00000
0.14404
3
0.00000
0.00000
0.02383
4
0.00000
0.00000
0.08302
5
0.00000
0.00000
0.01459
6
0.00000
0.00000
0.07832
7
0.00000
0.00000
-0.07882
8
0.00000
0.00000
-0.03668
9
0.00000
0.00000
-0.07832
10
0.00000
0.00000
-0.03606
11
0.00000
0.00000
-0.00836
12
0.00000
0.00000
-0.00851
13
0.00000
0.00000
-0.04062
14
0.00000
0.00000
-0.01069
15
0.00000
0.00000
-0.00903
16
0.00000
0.00000
-0.06180
17
0.00000
0.00000
-0.02838
18
0.00000
0.00000
-0.00955
19
0.00000
0.00000
0.02682
20
0.00000
0.00000
0.01334
21
0.00000
0.00000
-0.20953
22
0.00000
0.00000
-0.13108
23
0.00000
0.00000
-0.19519
24
0.00000
0.00000
-0.12308
25
0.00000
0.00000
-0.07330
26
0.00000
0.00000
-0.10503
27
0.00000
0.00000
-0.07443
28
0.00000
0.00000
-0.15869
29
0.00000
0.00000
0.05600
30
0.00000
0.00000
-0.01490
31
0.00000
0.00000
-0.03683
32
0.00000
0.00000
0.02423