Geometry & MOs

Info

ID:	79427
PubChem CID:	49748582
Reduced:	SN3O5H15C17 (1)
Stoich.:	AB3C5D15E17 (1)
Weight, g/mol:	418.136257
ΔH_f, kcal/mol:	-72.42
Dipole, Da:	3.83
IP(EA), eV:	-8.82(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-4-(4-fluorophenyl)oxane-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(S(=O)(=O)C1)C2=CC=C(C=C2)NC(=O)C3=NOC(=C3)C4=CC=CO4

DOS

IR

Vibrations