Geometry & MOs

Info

ID:	131794
PubChem CID:	51262064
Reduced:	NO4C17H19 (1)
Stoich.:	AB4C17D19 (1)
Weight, g/mol:	350.090272
ΔH_f, kcal/mol:	-136.4
Dipole, Da:	1.87
IP(EA), eV:	-8.71(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-acetyl-1,3-benzodioxol-5-yl)-5-phenyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC2=C(C=C1NC(=O)C3CC4CCC3C4)OCO2

DOS

IR

Vibrations