Geometry & MOs

Info

ID:	202669
PubChem CID:	79708536
Reduced:	BrFNOC15H23 (1)
Stoich.:	ABCDE15F23 (1)
Weight, g/mol:	339.04342
ΔH_f, kcal/mol:	-92.39
Dipole, Da:	2.39
IP(EA), eV:	-8.97(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-5-fluorophenyl)-3-(4-fluorophenyl)-N-methylpropan-2-amine

Drug info:

PubChemData

Smile

CCC(C)(CC1=CC(=CC(=C1)Br)F)CNCCOC

DOS

IR

Vibrations