Geometry & MOs

Info

ID:	68446
PubChem CID:	46508425
Reduced:	Cl2O2N3C20H21 (1)
Stoich.:	A2B2C3D20E21 (1)
Weight, g/mol:	367.189592
ΔH_f, kcal/mol:	-72.15
Dipole, Da:	5.17
IP(EA), eV:	-8.77(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-butoxypropyl)-3-methyl-6-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)NCCC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations