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)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
0.00200
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.00897
2
0.00000
0.00000
-0.00017
3
0.00000
0.00000
0.05880
4
0.00000
0.00000
-0.06544
5
0.00000
0.00000
-0.04164
6
0.00000
0.00000
0.05307
7
0.00000
0.00000
0.07947
8
0.00000
0.00000
-0.01552
9
0.00000
0.00000
-0.09320
10
0.00000
0.00000
-0.01259
11
0.00000
0.00000
0.04335
12
0.00000
0.00000
-0.13032
13
0.00000
0.00000
-0.02159
14
0.00000
0.00000
0.13335
15
0.00000
0.00000
0.02830
16
0.00000
0.00000
0.01093
17
0.00000
0.00000
-0.00644
18
0.00000
0.00000
-0.04264
19
0.00000
0.00000
-0.00724
20
0.00000
0.00000
0.03439
21
0.00000
0.00000
0.15236
22
0.00000
0.00000
-0.02240
23
0.00000
0.00000
-0.16349
24
0.00000
0.00000
-0.01732
25
0.00000
0.00000
-0.22274
26
0.00000
0.00000
-0.05011
27
0.00000
0.00000
0.23612
28
0.00000
0.00000
0.02491
29
0.00000
0.00000
-0.02045
30
0.00000
0.00000
-0.09375
31
0.00000
0.00000
-0.03513
32
0.00000
0.00000
0.04700