Charge: 2
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+2
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)
0.01600
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
0.02757
2
0.00000
0.00000
0.00265
3
0.00000
0.00000
-0.02629
4
0.00000
0.00000
0.02173
5
0.00000
0.00000
0.04690
6
0.00000
0.00000
-0.05866
7
0.00000
0.00000
-0.04084
8
0.00000
0.00000
0.06940
9
0.00000
0.00000
0.07578
10
0.00000
0.00000
-0.06538
11
0.00000
0.00000
-0.01405
12
0.00000
0.00000
-0.06668
13
0.00000
0.00000
-0.07178
14
0.00000
0.00000
0.03613
15
0.00000
0.00000
-0.07202
16
0.00000
0.00000
0.02702
17
0.00000
0.00000
0.08742
18
0.00000
0.00000
-0.08133
19
0.00000
0.00000
0.01536
20
0.00000
0.00000
0.07311
21
0.00000
0.00000
-0.11961
22
0.00000
0.00000
0.13730
23
0.00000
0.00000
0.14220
24
0.00000
0.00000
-0.13255
25
0.00000
0.00000
-0.16966
26
0.00000
0.00000
-0.11627
27
0.00000
0.00000
0.11079
28
0.00000
0.00000
0.06893
29
0.00000
0.00000
0.03591
30
0.00000
0.00000
-0.21284
31
0.00000
0.00000
0.23275
32
0.00000
0.00000
0.18899