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)
-768.41876
Description
S1
Multiplicity
1
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02837 b
(cm-1)
0.00856 c
(cm-1)
0.00657
Dipole Moments
mu_x(Debye)
-0.01429 mu_y
(Debye)
-0.01154 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)
0.59400
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.01330
2
0.00000
0.00000
-0.02090
3
0.00000
0.00000
0.00010
4
0.00000
0.00000
-0.00224
5
0.00000
0.00000
0.00286
6
0.00000
0.00000
0.02572
7
0.00000
0.00000
0.02186
8
0.00000
0.00000
0.00151
9
0.00000
0.00000
-0.00213
10
0.00000
0.00000
-0.01964
11
0.00000
0.00000
-0.04158
12
0.00000
0.00000
0.00445
13
0.00000
0.00000
0.00486
14
0.00000
0.00000
0.00450
15
0.00000
0.00000
0.12271
16
0.00000
0.00000
0.01554
17
0.00000
0.00000
-0.03020
18
0.00000
0.00000
-0.07963
19
0.00000
0.00000
0.00926
20
0.00000
0.00000
-0.07081
21
0.00000
0.00000
-0.06453
22
0.00000
0.00000
-0.03839
23
0.00000
0.00000
0.11275
24
0.00000
0.00000
0.06167
25
0.00000
0.00000
-0.06897
26
0.00000
0.00000
-0.28698
27
0.00000
0.00000
-0.12103
28
0.00000
0.00000
-0.07976
29
0.00000
0.00000
0.39160
30
0.00000
0.00000
0.35894
31
0.00000
0.00000
0.44169
32
0.00000
0.00000
0.09153