Geometry & MOs

Info

ID:	269193
PubChem CID:	103616306
Reduced:	ClFNOC17H17 (1)
Stoich.:	ABCDE17F17 (1)
Weight, g/mol:	307.11392
ΔH_f, kcal/mol:	-26.13
Dipole, Da:	1.02
IP(EA), eV:	-8.97(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(2-chlorophenyl)methoxy]-5-fluorophenyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

C1CC1NCC2=C(C=CC(=C2)F)OCC3=CC=CC=C3Cl

DOS

IR

Vibrations