Charge: 1
Inchi:1S/C22H12/c1-3-13-7-9-18-12-16-6-2-4-14-8-10-17-11-15(5-1)19(13)21(18)22(17)20(14)16/h1-12H/q+1
Electronic States
Energy
(eV)
-845.040198
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
C2h
Symmetry Elements
E
C2(z)
sigmah(xy)
i
Dipole Moments
mu_x(Debye)
0.000000 mu_y
(Debye)
0.000000 mu_z
(Debye)
0.000000
#
Atom
Basis Sets
1
Carbon(C, 6, 12)
6-31+G*
2
Carbon(C, 6, 12)
6-31+G*
3
Carbon(C, 6, 12)
6-31+G*
4
Carbon(C, 6, 12)
6-31+G*
5
Carbon(C, 6, 12)
6-31+G*
6
Carbon(C, 6, 12)
6-31+G*
7
Carbon(C, 6, 12)
6-31+G*
8
Carbon(C, 6, 12)
6-31+G*
9
Carbon(C, 6, 12)
6-31+G*
10
Carbon(C, 6, 12)
6-31+G*
11
Carbon(C, 6, 12)
6-31+G*
12
Carbon(C, 6, 12)
6-31+G*
13
Carbon(C, 6, 12)
6-31+G*
14
Carbon(C, 6, 12)
6-31+G*
15
Carbon(C, 6, 12)
6-31+G*
16
Carbon(C, 6, 12)
6-31+G*
17
Carbon(C, 6, 12)
6-31+G*
18
Carbon(C, 6, 12)
6-31+G*
19
Carbon(C, 6, 12)
6-31+G*
20
Carbon(C, 6, 12)
6-31+G*
21
Carbon(C, 6, 12)
6-31+G*
22
Carbon(C, 6, 12)
6-31+G*
23
Hydrogen(H, 1, 1)
6-31+G*
24
Hydrogen(H, 1, 1)
6-31+G*
25
Hydrogen(H, 1, 1)
6-31+G*
26
Hydrogen(H, 1, 1)
6-31+G*
27
Hydrogen(H, 1, 1)
6-31+G*
28
Hydrogen(H, 1, 1)
6-31+G*
29
Hydrogen(H, 1, 1)
6-31+G*
30
Hydrogen(H, 1, 1)
6-31+G*
31
Hydrogen(H, 1, 1)
6-31+G*
32
Hydrogen(H, 1, 1)
6-31+G*
33
Hydrogen(H, 1, 1)
6-31+G*
34
Hydrogen(H, 1, 1)
6-31+G*