Geometry & MOs

Info

ID:	217328
PubChem CID:	85087627
Reduced:	NO2H19C24 (1)
Stoich.:	AB2C19D24 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-0.17
Dipole, Da:	4.41
IP(EA), eV:	-9.13(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(7-azabicyclo[2.2.1]heptan-2-yl)-3-(pyrrolidine-1-carbonyl)-1-benzofuran-5-carboxamide

Drug info:

PubChemData

Smile

C1C(=O)C(C(C12C3=CC=CC=C3NC2=O)C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations