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)
-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)
0.47700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.03985
2
0.00000
0.00000
0.04116
3
0.00000
0.00000
-0.12228
4
0.00000
0.00000
-0.08588
5
0.00000
0.00000
0.06389
6
0.00000
0.00000
0.11798
7
0.00000
0.00000
-0.00568
8
0.00000
0.00000
0.03007
9
0.00000
0.00000
-0.01364
10
0.00000
0.00000
-0.00978
11
0.00000
0.00000
0.05419
12
0.00000
0.00000
-0.01375
13
0.00000
0.00000
0.00003
14
0.00000
0.00000
-0.05461
15
0.00000
0.00000
0.03217
16
0.00000
0.00000
0.04726
17
0.00000
0.00000
0.03848
18
0.00000
0.00000
-0.03866
19
0.00000
0.00000
0.05574
20
0.00000
0.00000
-0.04526
21
0.00000
0.00000
0.15515
22
0.00000
0.00000
0.19767
23
0.00000
0.00000
-0.11456
24
0.00000
0.00000
-0.14713
25
0.00000
0.00000
-0.03391
26
0.00000
0.00000
-0.09119
27
0.00000
0.00000
-0.25268
28
0.00000
0.00000
0.04356
29
0.00000
0.00000
0.04837
30
0.00000
0.00000
-0.20242
31
0.00000
0.00000
-0.03779
32
0.00000
0.00000
-0.17928