Geometry & MOs

Info

ID:	357155
PubChem CID:	127293389
Reduced:	OSN2C7H9 (2)
Stoich.:	ABC2D7E9 (2)
Weight, g/mol:	329.173942
ΔH_f, kcal/mol:	-5.41
Dipole, Da:	4.42
IP(EA), eV:	-8.98(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopropyl-N-methyl-N-(oxolan-3-yl)-3-propyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CN1C(=NN=C1SCC(=O)N(C)C2CCOC2)C3=CC=CS3

DOS

IR

Vibrations