Geometry & MOs

Info

ID:	342153
PubChem CID:	127264866
Reduced:	NSO3C18H19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	325.095949
ΔH_f, kcal/mol:	-76.05
Dipole, Da:	4.71
IP(EA), eV:	-9.2(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=CC=C1CC(=O)NCC=CC2=CC=CC=C2

DOS

IR

Vibrations