Geometry & MOs

Info

ID:	290504
PubChem CID:	104643207
Reduced:	BrFON2C10H12 (1)
Stoich.:	ABCD2E10F12 (1)
Weight, g/mol:	332.9913
ΔH_f, kcal/mol:	-71.1
Dipole, Da:	2.88
IP(EA), eV:	-10.11(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-bromophenyl)-5-(5-fluoropyridin-2-yl)-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

CC(CCBr)NC(=O)C1=NC=C(C=C1)F

DOS

IR

Vibrations