Geometry & MOs

Info

ID:	294168
PubChem CID:	117429720
Reduced:	ClO4C13H15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	269.9804
ΔH_f, kcal/mol:	-162.99
Dipole, Da:	4.56
IP(EA), eV:	-8.98(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(6-bromo-2-fluoro-3-methylphenyl)-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

CCC1=C2C(=CC(=C1CC(C)C(=O)O)Cl)OCO2

DOS

IR

Vibrations