Geometry & MOs

Info

ID:	123204
PubChem CID:	50837423
Reduced:	ClN4O4H19C21 (1)
Stoich.:	AB4C4D19E21 (1)
Weight, g/mol:	412.211055
ΔH_f, kcal/mol:	-65.64
Dipole, Da:	5.36
IP(EA), eV:	-8.25(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-N-[5-[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl]propanamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N2CC(CC2=O)C3=NN=C(O3)NC(=O)C4=CC(=CC=C4)Cl

DOS

IR

Vibrations