Geometry & MOs

Info

ID:	247663
PubChem CID:	103072610
Reduced:	O2N3C13H17 (1)
Stoich.:	A2B3C13D17 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	-28.92
Dipole, Da:	3.05
IP(EA), eV:	-9.13(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations