Geometry & MOs

Info

ID:	258376
PubChem CID:	103153333
Reduced:	SN3O5C12H15 (1)
Stoich.:	AB3C5D12E15 (1)
Weight, g/mol:	286.116486
ΔH_f, kcal/mol:	-191.65
Dipole, Da:	12.94
IP(EA), eV:	-9.92(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(2,5-dioxopyrrolidin-1-yl)propanoylamino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)C1=CN=C2N(C1=O)CCS2

DOS

IR

Vibrations