Charge: 2
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+2
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)
-0.35000
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.00974
2
0.00000
0.00000
0.00525
3
0.00000
0.00000
0.04591
4
0.00000
0.00000
-0.00515
5
0.00000
0.00000
-0.02237
6
0.00000
0.00000
-0.01092
7
0.00000
0.00000
-0.02052
8
0.00000
0.00000
-0.00102
9
0.00000
0.00000
0.01466
10
0.00000
0.00000
0.01759
11
0.00000
0.00000
-0.06917
12
0.00000
0.00000
0.00644
13
0.00000
0.00000
0.03258
14
0.00000
0.00000
0.00136
15
0.00000
0.00000
0.02285
16
0.00000
0.00000
0.00151
17
0.00000
0.00000
0.10526
18
0.00000
0.00000
0.02965
19
0.00000
0.00000
-0.01870
20
0.00000
0.00000
-0.08194
21
0.00000
0.00000
0.03613
22
0.00000
0.00000
0.04839
23
0.00000
0.00000
-0.08133
24
0.00000
0.00000
-0.11463
25
0.00000
0.00000
-0.03193
26
0.00000
0.00000
-0.16502
27
0.00000
0.00000
0.01419
28
0.00000
0.00000
-0.02842
29
0.00000
0.00000
0.19297
30
0.00000
0.00000
-0.27121
31
0.00000
0.00000
-0.54532
32
0.00000
0.00000
0.42783