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)
-768.43015
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02846 b
(cm-1)
0.00844 c
(cm-1)
0.00651
Dipole Moments
mu_x(Debye)
0.18438 mu_y
(Debye)
0.13618 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.45000
Diff mu Y
(Debye)
1.42300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.03397
-0.08170
0.00000
2
-0.02281
0.07473
0.00000
3
0.02156
-0.05631
0.00000
4
0.03483
0.12050
0.00000
5
-0.00793
-0.04624
0.00000
6
-0.07199
0.06346
0.00000
7
-0.01709
-0.03399
0.00000
8
-0.02889
0.01402
0.00000
9
0.02629
-0.00547
0.00000
10
0.02660
0.01506
0.00000
11
-0.03356
0.06097
0.00000
12
0.03050
-0.01956
0.00000
13
-0.02077
0.00994
0.00000
14
-0.00748
-0.01958
0.00000
15
0.00375
0.01636
0.00000
16
-0.00152
-0.04648
0.00000
17
0.01051
0.03693
0.00000
18
-0.00255
-0.03016
0.00000
19
-0.01322
-0.00518
0.00000
20
0.01588
-0.00138
0.00000
21
0.06392
-0.13290
0.00000
22
-0.05599
-0.03796
0.00000
23
0.02160
-0.03389
0.00000
24
0.12626
-0.08770
0.00000
25
-0.03813
-0.24313
0.00000
26
0.03841
0.20684
0.00000
27
0.16033
-0.21741
0.00000
28
-0.09794
-0.07125
0.00000
29
0.01139
-0.00161
0.00000
30
0.05769
-0.09720
0.00000
31
0.00176
0.00724
0.00000
32
-0.00426
-0.07592
0.00000