Geometry & MOs

Info

ID:	297098
PubChem CID:	117608818
Reduced:	NF2O2C17H19 (1)
Stoich.:	AB2C2D17E19 (1)
Weight, g/mol:	372.07107
ΔH_f, kcal/mol:	-129.4
Dipole, Da:	3.39
IP(EA), eV:	-9.1(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[(1R)-1-aminopropyl]-6-chloro-2-fluorophenoxy]-N-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC[C@@H](C1=C(C(=C(C=C1)F)OC2=CC=CC=C2)F)NCCO

DOS

IR

Vibrations