Geometry & MOs

Info

ID:	123192
PubChem CID:	50836732
Reduced:	SO3N4C17H20 (1)
Stoich.:	AB3C4D17E20 (1)
Weight, g/mol:	384.089226
ΔH_f, kcal/mol:	-58.95
Dipole, Da:	8.63
IP(EA), eV:	-8.42(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[1-(4-methylsulfanylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1=NN=C(O1)C2CC(=O)N(C2)C3=CC=C(C=C3)SC

DOS

IR

Vibrations