Geometry & MOs

Info

ID:

316749

PubChem CID:

126631707

Reduced:

N7H55C81 (1)

Stoich.:

A7B55C81 (1)

Weight, g/mol:

1126.447144

ΔHf, kcal/mol:

401.65

Dipole, Da:

4.53

IP(EA), eV:

 -7.72(-0.48)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-N,3-N,5-N-triphenyl-2-N,3-N,5-N-tris(9-phenylcarbazol-3-yl)quinoxaline-2,3,5-triamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)N(C4=CC=CC=C4)C5=C6C(=CC(=CC6=NC=C5)N(C7=CC=CC=C7)C8=CC9=C(C=C8)N(C1=CC=CC=C19)C1=CC=CC=C1)N(C1=CC=CC=C1)C1=CC3=C(C=C1)N(C1=CC=CC=C13)C1=CC=CC=C1)C1=CC=CC=C12

DOS

IR

Vibrations