Geometry & MOs

Info

ID:

316534

PubChem CID:

126631178

Reduced:

N2H26C35 (1)

Stoich.:

A2B26C35 (1)

Weight, g/mol:

676.287849

ΔHf, kcal/mol:

150.94

Dipole, Da:

1.9

IP(EA), eV:

 -7.93(-0.75)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[4-(21-methyl-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-19-yl)phenyl]phenyl]-N,4-diphenylaniline

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C2=CC=C(C=C2)C3=CC4=C(C=C3)N(C5=CC6=CC=CC=C6C=C54)C7=CC=CC=C7

DOS

IR

Vibrations