Geometry & MOs

Info

ID:	61081
PubChem CID:	26705407
Reduced:	FO3N4H21C25 (1)
Stoich.:	AB3C4D21E25 (1)
Weight, g/mol:	481.095298
ΔH_f, kcal/mol:	-49.89
Dipole, Da:	4.46
IP(EA), eV:	-9.0(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-oxo-1,3-thiazolidin-3-yl)-N-[5-piperidin-1-ylsulfonyl-2-(2,2,2-trifluoroethoxy)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CCC3=NC(=NO3)C4=CC=C(C=C4)F

DOS

IR

Vibrations