Geometry & MOs

Info

ID:	153831
PubChem CID:	56313149
Reduced:	FSN2O4C19H23 (1)
Stoich.:	ABC2D4E19F23 (1)
Weight, g/mol:	443.167891
ΔH_f, kcal/mol:	-141.95
Dipole, Da:	3.96
IP(EA), eV:	-9.67(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-[2-(2-fluorophenyl)-2-methylpropyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)OC)C2=CC=CC=C2F

DOS

IR

Vibrations