Geometry & MOs

Info

ID:	38726
PubChem CID:	8137824
Reduced:	SN3O3C17H21 (1)
Stoich.:	AB3C3D17E21 (1)
Weight, g/mol:	301.142641
ΔH_f, kcal/mol:	-79.67
Dipole, Da:	3.34
IP(EA), eV:	-8.44(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)NC(=O)COC(=O)CCSC2=CC=CC=C2

DOS

IR

Vibrations