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)
0.10700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.11946
2
0.00000
0.00000
-0.02481
3
0.00000
0.00000
-0.03319
4
0.00000
0.00000
-0.08523
5
0.00000
0.00000
0.03921
6
0.00000
0.00000
-0.02199
7
0.00000
0.00000
-0.05548
8
0.00000
0.00000
0.08023
9
0.00000
0.00000
-0.07181
10
0.00000
0.00000
0.08131
11
0.00000
0.00000
-0.02933
12
0.00000
0.00000
-0.04220
13
0.00000
0.00000
-0.02232
14
0.00000
0.00000
-0.06404
15
0.00000
0.00000
0.05528
16
0.00000
0.00000
0.06269
17
0.00000
0.00000
-0.02507
18
0.00000
0.00000
0.04329
19
0.00000
0.00000
-0.04050
20
0.00000
0.00000
0.02168
21
0.00000
0.00000
-0.05044
22
0.00000
0.00000
0.24482
23
0.00000
0.00000
-0.16863
24
0.00000
0.00000
0.14933
25
0.00000
0.00000
0.02469
26
0.00000
0.00000
-0.16071
27
0.00000
0.00000
-0.06337
28
0.00000
0.00000
0.21167
29
0.00000
0.00000
-0.11361
30
0.00000
0.00000
0.10696
31
0.00000
0.00000
-0.02755
32
0.00000
0.00000
-0.00054