Geometry & MOs

Info

ID:	295676
PubChem CID:	117542117
Reduced:	BrFN2O2H10C14 (1)
Stoich.:	ABC2D2E10F14 (1)
Weight, g/mol:	335.99097
ΔH_f, kcal/mol:	-61.06
Dipole, Da:	2.88
IP(EA), eV:	-9.06(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-2-(4-fluorophenyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one

Drug info:

PubChemData

Smile

CN1C(=O)C(OC2=C1N=C(C=C2)Br)C3=CC=CC=C3F

DOS

IR

Vibrations