Geometry & MOs

Info

ID:

316745

PubChem CID:

126631703

Reduced:

N4H27C40 (2)

Stoich.:

A4B27C40 (2)

Weight, g/mol:

1075.436245

ΔHf, kcal/mol:

426.96

Dipole, Da:

6.66

IP(EA), eV:

 -7.78(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-N,3-N,6-N-triphenyl-2-N,3-N,6-N-tris(9-phenylcarbazol-3-yl)pyridine-2,3,6-triamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)N(C4=CC=CC=C4)C5=CC6=C(C=C5)N=NC(=C6N(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