Geometry & MOs

Info

ID:	393042
PubChem CID:	135019098
Reduced:	NO8C22H31 (1)
Stoich.:	AB8C22D31 (1)
Weight, g/mol:	313.152537
ΔH_f, kcal/mol:	-332.09
Dipole, Da:	4.07
IP(EA), eV:	-8.31(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-ethoxy-5-oxo-1-prop-2-enylpyrrolidine-3,3-dicarboxylate

Drug info:

PubChemData

Smile

CCOC1C(CC(=O)N1CCC2=CC(=C(C=C2)OC)OC)(C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations