Geometry & MOs

Info

ID:	8033
PubChem CID:	74779
Reduced:	BrFNO2H5C7 (1)
Stoich.:	ABCD2E5F7 (1)
Weight, g/mol:	232.94877
ΔH_f, kcal/mol:	-33.42
Dipole, Da:	4.67
IP(EA), eV:	-10.52(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(bromomethyl)-1-fluoro-3-nitrobenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)CBr)[N+](=O)[O-]

DOS

IR

Vibrations