Geometry & MOs

Info

ID:

435531

PubChem CID:

135191734

Reduced:

NH15C22 (2)

Stoich.:

AB15C22 (2)

Weight, g/mol:

704.387898

ΔHf, kcal/mol:

374.58

Dipole, Da:

2.73

IP(EA), eV:

 -8.12(-0.63)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-N-[4-(N-cyclohexyl-3-methylanilino)phenyl]-4-N-[4-(N-(3-methylphenyl)anilino)phenyl]-1-N-phenylbenzene-1,4-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=C(C=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC#CC6=CC=CC=C65)C7=CC=CC8=CC=CC=C87

DOS

IR

Vibrations