Geometry & MOs

Info

ID:	128514
PubChem CID:	51048022
Reduced:	FNO4H22C27 (1)
Stoich.:	ABC4D22E27 (1)
Weight, g/mol:	415.141973
ΔH_f, kcal/mol:	-112.82
Dipole, Da:	9.74
IP(EA), eV:	-9.26(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CC2=C(O1)C=CC(=C2)/C(=C/3\C(N(C(=O)C3=O)CC4=CC=CC=C4)C5=CC=CC=C5F)/O

DOS

IR

Vibrations