Charge: 0
Inchi:1S/C28H14/c1-5-15-13-16-6-3-11-21-22-12-4-8-18-14-17-7-2-10-20-19(9-1)23(15)27(25(16)21)28(24(17)20)26(18)22/h1-14H
Electronic States
Energy
(eV)
-1074.967247
Description
S0
Multiplicity
1
Is Minimum
yes
Symmetry Group
D2h
Symmetry Elements
E
C2(z)
C2(y)
C2(x)
i
sigmah(xy)
sigmah(xz)
sigmah(yz)
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
Carbon(C, 6, 12)
6-31+G*
24
Carbon(C, 6, 12)
6-31+G*
25
Carbon(C, 6, 12)
6-31+G*
26
Carbon(C, 6, 12)
6-31+G*
27
Carbon(C, 6, 12)
6-31+G*
28
Carbon(C, 6, 12)
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*
35
Hydrogen(H, 1, 1)
6-31+G*
36
Hydrogen(H, 1, 1)
6-31+G*
37
Hydrogen(H, 1, 1)
6-31+G*
38
Hydrogen(H, 1, 1)
6-31+G*
39
Hydrogen(H, 1, 1)
6-31+G*
40
Hydrogen(H, 1, 1)
6-31+G*
41
Hydrogen(H, 1, 1)
6-31+G*
42
Hydrogen(H, 1, 1)
6-31+G*