Geometry & MOs

Info

ID:	35918
PubChem CID:	7980488
Reduced:	ClN2O6H15C20 (1)
Stoich.:	AB2C6D15E20 (1)
Weight, g/mol:	352.142307
ΔH_f, kcal/mol:	-191.22
Dipole, Da:	4.72
IP(EA), eV:	-10.03(-2.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC(=O)NC)OC(=O)C1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)Cl

DOS

IR

Vibrations