Geometry & MOs

Info

ID:	402490
PubChem CID:	135056178
Reduced:	ClFNC5H13 (1)
Stoich.:	ABCD5E13 (1)
Weight, g/mol:	558.238614
ΔH_f, kcal/mol:	-108.72
Dipole, Da:	4.85
IP(EA), eV:	-10.55(1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-N-[(2R,3S)-1-(benzenesulfonyl)-3-(dibenzylamino)-1-fluoro-4-methylpentan-2-yl]-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CCC[C@@H](CF)[NH3+].[Cl-]

DOS

IR

Vibrations