Geometry & MOs

Info

ID:	258778
PubChem CID:	103156964
Reduced:	NOC18H31 (1)
Stoich.:	ABC18D31 (1)
Weight, g/mol:	298.12772
ΔH_f, kcal/mol:	-102.05
Dipole, Da:	2.65
IP(EA), eV:	-8.77(2.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[(5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carbonyl)amino]butanoic acid

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CNC23CC4CC(C2)CC(C4)C3)O

DOS

IR

Vibrations