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)
-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)
-0.09500
Diff mu Y
(Debye)
-0.23300
Diff mu Z
(Debye)
0.00000
Eigenvectors
#
X
Y
Z
1
0.03612
0.07458
0.00000
2
0.03698
0.04040
0.00000
3
0.01396
0.08083
0.00000
4
0.02734
-0.01249
0.00000
5
-0.00041
-0.02575
0.00000
6
0.00133
-0.00852
0.00000
7
-0.05651
-0.03747
0.00000
8
-0.02305
-0.01441
0.00000
9
-0.02172
0.01091
0.00000
10
-0.00260
0.02491
0.00000
11
0.04218
0.00573
0.00000
12
0.03426
0.00798
0.00000
13
-0.06070
-0.05781
0.00000
14
-0.05523
-0.07931
0.00000
15
-0.00762
-0.04552
0.00000
16
0.00233
0.03869
0.00000
17
0.05506
-0.03545
0.00000
18
-0.06943
-0.06630
0.00000
19
-0.01538
0.10272
0.00000
20
0.05458
0.00906
0.00000
21
-0.01341
-0.09336
0.00000
22
-0.00072
0.05887
0.00000
23
-0.01257
0.04018
0.00000
24
-0.00696
0.03009
0.00000
25
0.02300
-0.02800
0.00000
26
-0.07461
-0.09629
0.00000
27
-0.02035
-0.12611
0.00000
28
0.08284
0.05496
0.00000
29
0.04282
0.12007
0.00000
30
-0.03295
-0.10828
0.00000
31
0.07415
0.03867
0.00000
32
0.03999
-0.04323
0.00000