Geometry & MOs

Info

ID:

316566

PubChem CID:

126631250

Reduced:

N2H30C41 (1)

Stoich.:

A2B30C41 (1)

Weight, g/mol:

524.225249

ΔHf, kcal/mol:

177.4

Dipole, Da:

1.37

IP(EA), eV:

 -7.9(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-methyl-N-phenyl-21-(4-phenylphenyl)-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-16-amine

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)C2=CC=C(C=C2)C3=C4C(=CC=C3)N(C5=C4C6=CC=CC=C6C=C5)C7=CC=C(C=C7)C8=CC=CC=C8

DOS

IR

Vibrations