Geometry & MOs

Info

ID:	70653
PubChem CID:	48413663
Reduced:	N4O5C20H20 (1)
Stoich.:	A4B5C20D20 (1)
Weight, g/mol:	418.164105
ΔH_f, kcal/mol:	-21.63
Dipole, Da:	5.24
IP(EA), eV:	-9.54(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-dioxoisoindol-2-yl)-N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]propanamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations