Geometry & MOs

Info

ID:	393043
PubChem CID:	135019100
Reduced:	NO6C15H23 (1)
Stoich.:	AB6C15D23 (1)
Weight, g/mol:	316.142307
ΔH_f, kcal/mol:	-259.24
Dipole, Da:	4.29
IP(EA), eV:	-9.9(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2R,3R)-1-benzyl-3-cyano-2-ethoxy-5-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CCOC1C(CC(=O)N1CC=C)(C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations