Geometry & MOs

Info

ID:	310027
PubChem CID:	126572952
Reduced:	FN2O4H7C9 (1)
Stoich.:	AB2C4D7E9 (1)
Weight, g/mol:	269.94402
ΔH_f, kcal/mol:	-97.65
Dipole, Da:	5.73
IP(EA), eV:	-9.67(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-bromo-7-fluoro-5-nitroquinoline

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1N)/C=C/C(=O)O)[N+](=O)[O-])F

DOS

IR

Vibrations