Geometry & MOs

Info

ID:	171947
PubChem CID:	75444676
Reduced:	N2O4C13H18 (1)
Stoich.:	A2B4C13D18 (1)
Weight, g/mol:	285.111341
ΔH_f, kcal/mol:	-124.61
Dipole, Da:	1.39
IP(EA), eV:	-9.93(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-oxo-1,2-dihydroisoindol-4-yl)-5-propan-2-yl-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC2(CC1)OCC(O2)CNC(=O)C3=NOC=C3

DOS

IR

Vibrations