Geometry & MOs

Info

ID:	265277
PubChem CID:	103516450
Reduced:	BrNF3C11H13 (1)
Stoich.:	ABC3D11E13 (1)
Weight, g/mol:	266.98705
ΔH_f, kcal/mol:	-135.78
Dipole, Da:	3.31
IP(EA), eV:	-9.44(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-bromo-4-fluorophenyl)-1,1-difluoropropan-2-amine

Drug info:

PubChemData

Smile

CCNC(CC1=CC(=C(C=C1)F)Br)C(F)F

DOS

IR

Vibrations