Geometry & MOs

Info

ID:	342154
PubChem CID:	127264867
Reduced:	NSF3O3C13H18 (1)
Stoich.:	ABC3D3E13F18 (1)
Weight, g/mol:	343.086527
ΔH_f, kcal/mol:	-280.17
Dipole, Da:	3.73
IP(EA), eV:	-9.68(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)-N-[(2S,3S)-1,1,1-trifluoro-2-hydroxy-4-methylpentan-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC(C)[C@@H]([C@@H](C(F)(F)F)O)NS(=O)(=O)CC1=CC=CC=C1

DOS

IR

Vibrations