Geometry & MOs

Info

ID:	79277
PubChem CID:	49747781
Reduced:	NO2C13H14 (2)
Stoich.:	AB2C13D14 (2)
Weight, g/mol:	451.210721
ΔH_f, kcal/mol:	-81.15
Dipole, Da:	7.09
IP(EA), eV:	-8.93(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-dioxoisoindol-2-yl)-N-[2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]butanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C(CNC(=O)C2=CC=CC=C2OC3=CC=CC=C3)N4CCOCC4

DOS

IR

Vibrations