Geometry & MOs

Info

ID:	68745
PubChem CID:	46509020
Reduced:	SO2N5H19C20 (1)
Stoich.:	AB2C5D19E20 (1)
Weight, g/mol:	427.143116
ΔH_f, kcal/mol:	73.04
Dipole, Da:	8.34
IP(EA), eV:	-8.91(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N2C(=NN=N2)SCC3=C(OC(=N3)C4=CC=CC=C4)C

DOS

IR

Vibrations