Geometry & MOs

Info

ID:	165364
PubChem CID:	74539341
Reduced:	NH9C13 (2)
Stoich.:	AB9C13 (2)
Weight, g/mol:	376.098511
ΔH_f, kcal/mol:	145.49
Dipole, Da:	7.33
IP(EA), eV:	-7.75(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=CC2=C3C=CC=CC3=NC2=C1C4=C5C=CC=CC5=CC6=CC=CC=C64

DOS

IR

Vibrations