Geometry & MOs

Info

ID:	286582
PubChem CID:	104179037
Reduced:	BrClON3H9C12 (1)
Stoich.:	ABCD3E9F12 (1)
Weight, g/mol:	294.99564
ΔH_f, kcal/mol:	8.15
Dipole, Da:	2.31
IP(EA), eV:	-9.29(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-bromo-5-methylpyridin-3-yl)-4-methyl-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1Br)NC(=O)C2=C(C=NC=C2)Cl

DOS

IR

Vibrations