Geometry & MOs

Info

ID:	216733
PubChem CID:	85086693
Reduced:	NO4H15C17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	297.100108
ΔH_f, kcal/mol:	-99.62
Dipole, Da:	1.84
IP(EA), eV:	-9.64(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(furan-2-yl)-2-oxoethylidene]-1-(3-methoxyphenyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1C(N(C(=O)O1)C(=O)C=CC2=COC=C2)CC3=CC=CC=C3

DOS

IR

Vibrations