Geometry & MOs

Info

ID:	375353
PubChem CID:	131500064
Reduced:	NO4C9H13 (1)
Stoich.:	AB4C9D13 (1)
Weight, g/mol:	202.085461
ΔH_f, kcal/mol:	-155.89
Dipole, Da:	3.03
IP(EA), eV:	-8.85(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-5-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(C(CO)O)N)O)O

DOS

IR

Vibrations