Geometry & MOs

Info

ID:	375761
PubChem CID:	134221751
Reduced:	FSO2N3C17H18 (1)
Stoich.:	ABC2D3E17F18 (1)
Weight, g/mol:	399.022261
ΔH_f, kcal/mol:	-46.17
Dipole, Da:	8.93
IP(EA), eV:	-9.43(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-[4-(N-carbamoyl-S-methylsulfonimidoyl)phenyl]-3-fluoro-1-hydroxypropan-2-yl]-2,2-dichloroacetamide

Drug info:

PubChemData

Smile

CS(=NC#N)(=O)CC1=NC=C(C=C1)C2=CC=C(C=C2)C(CCF)O

DOS

IR

Vibrations