Geometry & MOs

Info

ID:	38521
PubChem CID:	8136976
Reduced:	ClNO6C20H20 (1)
Stoich.:	ABC6D20E20 (1)
Weight, g/mol:	301.142641
ΔH_f, kcal/mol:	-203.42
Dipole, Da:	2.1
IP(EA), eV:	-9.0(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)-2-oxoethyl]-4-(2-oxopyrrolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC3=C(C(=C2)Cl)OCCCO3

DOS

IR

Vibrations