Geometry & MOs

Info

ID:	123194
PubChem CID:	50836794
Reduced:	ClO2N5H24C25 (1)
Stoich.:	AB2C5D24E25 (1)
Weight, g/mol:	432.056212
ΔH_f, kcal/mol:	18.3
Dipole, Da:	3.96
IP(EA), eV:	-8.68(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COCCN1C2=NC=NC3=C2N(C=C3C4=CC=CC=C4)CC(=O)NCC5=CC=C(C=C5)Cl

DOS

IR

Vibrations