Geometry & MOs

Info

ID:	345571
PubChem CID:	127269871
Reduced:	ON2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	248.152478
ΔH_f, kcal/mol:	-29.17
Dipole, Da:	2.55
IP(EA), eV:	-8.68(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1C3CCCN3C(=O)NC4CCCC5=C4C=CO5

DOS

IR

Vibrations