Geometry & MOs

Info

ID:	282710
PubChem CID:	103936836
Reduced:	FN2C17H21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	292.114254
ΔH_f, kcal/mol:	-12.05
Dipole, Da:	2.72
IP(EA), eV:	-8.99(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(2-chlorophenyl)ethyl]-1-(5-fluoropyridin-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

CCC(C1=NC=C(C=C1)F)N[C@@H](C)C2=CC=CC=C2C

DOS

IR

Vibrations