Geometry & MOs

Info

ID:	166498
PubChem CID:	74700545
Reduced:	N4O4C21H26 (1)
Stoich.:	A4B4C21D26 (1)
Weight, g/mol:	388.118498
ΔH_f, kcal/mol:	-124.46
Dipole, Da:	2.56
IP(EA), eV:	-9.1(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

[1-(furan-2-ylmethyl)-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene]-phenylmethanolate

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=NC=C1)NC2COC3C2OCC3OC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations