Geometry & MOs

Info

ID:	79212
PubChem CID:	49747440
Reduced:	N2O3S3C18H22 (1)
Stoich.:	A2B3C3D18E22 (1)
Weight, g/mol:	450.055327
ΔH_f, kcal/mol:	-60.38
Dipole, Da:	2.5
IP(EA), eV:	-9.09(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-difluoro-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)CCNC(=O)/C=C/C2=CSC=C2)S(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations