Geometry & MOs

Info

ID:	79213
PubChem CID:	49747444
Reduced:	F2N2S3O4C17H20 (1)
Stoich.:	A2B2C3D4E17F20 (1)
Weight, g/mol:	345.081698
ΔH_f, kcal/mol:	-201.44
Dipole, Da:	7.85
IP(EA), eV:	-9.63(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]oxamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)CCNS(=O)(=O)C2=CC(=C(C=C2)F)F)S(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations