Charge: 0
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
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)
-0.07700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.03701
2
0.00000
0.00000
0.01637
3
0.00000
0.00000
-0.12369
4
0.00000
0.00000
0.08601
5
0.00000
0.00000
0.07412
6
0.00000
0.00000
-0.12456
7
0.00000
0.00000
0.06032
8
0.00000
0.00000
-0.07111
9
0.00000
0.00000
-0.06095
10
0.00000
0.00000
0.04935
11
0.00000
0.00000
-0.01623
12
0.00000
0.00000
0.01255
13
0.00000
0.00000
0.00210
14
0.00000
0.00000
0.02277
15
0.00000
0.00000
0.03080
16
0.00000
0.00000
-0.01749
17
0.00000
0.00000
0.04378
18
0.00000
0.00000
-0.02601
19
0.00000
0.00000
0.03491
20
0.00000
0.00000
-0.02226
21
0.00000
0.00000
0.22123
22
0.00000
0.00000
-0.10760
23
0.00000
0.00000
-0.05624
24
0.00000
0.00000
0.20411
25
0.00000
0.00000
-0.08630
26
0.00000
0.00000
-0.15407
27
0.00000
0.00000
0.17597
28
0.00000
0.00000
-0.03510
29
0.00000
0.00000
0.00650
30
0.00000
0.00000
-0.13904
31
0.00000
0.00000
-0.02565
32
0.00000
0.00000
-0.09668