Geometry & MOs

Info

ID:	246051
PubChem CID:	103039622
Reduced:	ClOSF2H13C15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	281.078283
ΔH_f, kcal/mol:	-109.44
Dipole, Da:	3.21
IP(EA), eV:	-9.06(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-4-fluorophenyl)-1-(3-fluorophenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)SCC(CC2=CC(=C(C=C2)F)Cl)O)F

DOS

IR

Vibrations