Geometry & MOs

Info

ID:

47551

PubChem CID:

10534154

Reduced:

N2Si2O13C57H86 (1)

Stoich.:

A2B2C13D57E86 (1)

Weight, g/mol:

1062.341372

ΔHf, kcal/mol:

-621.47

Dipole, Da:

5.33

IP(EA), eV:

 -8.1(-0.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(2,4,6-triphenylphenyl)-1-[7-[4-(2,4,6-triphenylphenyl)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium;diperchlorate

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)O[C@H]1C[C@@H]2[C@@](CO2)(C3[C@@]1(C(=O)[C@H]4/C(=C(\C)/CNC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)OC(C)(C)C)O[Si](C(C)C)(C(C)C)C(C)C)/C([C@@]([C@H]3OC(=O)C6=CC=CC=C6)(O4)O)(C)C)C)OC(=O)C

DOS

IR

Vibrations