Geometry & MOs

Info

ID:	246085
PubChem CID:	103043374
Reduced:	ClFINH14C15 (1)
Stoich.:	ABCDE14F15 (1)
Weight, g/mol:	313.084512
ΔH_f, kcal/mol:	3.99
Dipole, Da:	5.51
IP(EA), eV:	-9.29(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-fluorophenyl)-3-(3,4-difluorophenyl)-N-methylpropan-2-amine

Drug info:

PubChemData

Smile

CNC(CC1=CC(=C(C=C1)F)Cl)C2=CC=C(C=C2)I

DOS

IR

Vibrations