Geometry & MOs

Info

ID:	154042
PubChem CID:	56313407
Reduced:	BrFN2O3H20C21 (1)
Stoich.:	ABC2D3E20F21 (1)
Weight, g/mol:	307.118399
ΔH_f, kcal/mol:	-127.2
Dipole, Da:	4.49
IP(EA), eV:	-9.68(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-difluoro-N-[2-(2-fluorophenyl)-2-methylpropyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CCN1C(=O)C2=C(C1=O)C=C(C=C2)Br)C3=CC=CC=C3F

DOS

IR

Vibrations