Geometry & MOs

Info

ID:	140827
PubChem CID:	52767963
Reduced:	SN2O5C15H22 (1)
Stoich.:	AB2C5D15E22 (1)
Weight, g/mol:	332.173607
ΔH_f, kcal/mol:	-211.74
Dipole, Da:	3.76
IP(EA), eV:	-9.95(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[[(3R)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoate

Drug info:

PubChemData

Smile

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NCCC(=O)OCC

DOS

IR

Vibrations