Geometry & MOs

Info

ID:	128513
PubChem CID:	51047983
Reduced:	NO5H29C30 (1)
Stoich.:	AB5C29D30 (1)
Weight, g/mol:	443.153286
ΔH_f, kcal/mol:	-126.96
Dipole, Da:	6.9
IP(EA), eV:	-9.05(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-1-benzyl-5-(2-fluorophenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C2/C(=C(\C3=CC4=C(C=C3)OC(C4)C)/O)/C(=O)C(=O)N2CC5=CC=CC=C5

DOS

IR

Vibrations