Geometry & MOs

Info

ID:

316846

PubChem CID:

126631867

Reduced:

NH29C46 (1)

Stoich.:

AB29C46 (1)

Weight, g/mol:

447.162314

ΔHf, kcal/mol:

197.95

Dipole, Da:

2.48

IP(EA), eV:

 -7.93(-0.7)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

16-dibenzofuran-3-yl-21-methyl-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene

Drug info:

PubChemData

Smile

CN1C2=CC=CC(=C2C3=C1C4=CC=CC=C4C5=CC=CC=C53)C6=CC7=C(C=C6)C8=CC=CC=C8C79C1=CC=CC=C1C1=CC=CC=C91

DOS

IR

Vibrations