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)
-768.43015
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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.30300
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00824
2
0.00000
0.00000
-0.00422
3
0.00000
0.00000
-0.03053
4
0.00000
0.00000
0.01294
5
0.00000
0.00000
-0.00247
6
0.00000
0.00000
0.00142
7
0.00000
0.00000
0.03571
8
0.00000
0.00000
-0.03567
9
0.00000
0.00000
-0.00411
10
0.00000
0.00000
0.00300
11
0.00000
0.00000
0.04540
12
0.00000
0.00000
-0.00617
13
0.00000
0.00000
-0.00545
14
0.00000
0.00000
0.00150
15
0.00000
0.00000
0.01081
16
0.00000
0.00000
-0.00268
17
0.00000
0.00000
-0.11790
18
0.00000
0.00000
0.06338
19
0.00000
0.00000
0.03631
20
0.00000
0.00000
-0.04368
21
0.00000
0.00000
-0.14398
22
0.00000
0.00000
0.18670
23
0.00000
0.00000
0.03113
24
0.00000
0.00000
-0.02335
25
0.00000
0.00000
0.01452
26
0.00000
0.00000
0.02041
27
0.00000
0.00000
-0.01165
28
0.00000
0.00000
0.02557
29
0.00000
0.00000
-0.20944
30
0.00000
0.00000
-0.34289
31
0.00000
0.00000
0.62884
32
0.00000
0.00000
0.23106