Geometry & MOs

Info

ID:	247662
PubChem CID:	103072607
Reduced:	O2N3C12H15 (1)
Stoich.:	A2B3C12D15 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	-25.54
Dipole, Da:	4.08
IP(EA), eV:	-9.22(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(propylaminomethyl)prop-2-enyl]-[1,3]oxazolo[4,5-b]pyridin-2-one

Drug info:

PubChemData

Smile

CCNCC(=C)CN1C2=C(C=CC=N2)OC1=O

DOS

IR

Vibrations