Geometry & MOs

Info

ID:	274311
PubChem CID:	103808507
Reduced:	BrFON2C11H14 (1)
Stoich.:	ABCD2E11F14 (1)
Weight, g/mol:	288.02735
ΔH_f, kcal/mol:	-84.98
Dipole, Da:	3.32
IP(EA), eV:	-9.33(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(2-bromo-5-fluorophenyl)-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=C(C=CC(=C1)F)Br)CN

DOS

IR

Vibrations