Geometry & MOs

Info

ID:	366131
PubChem CID:	127319511
Reduced:	NSO4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	354.050813
ΔH_f, kcal/mol:	-162.39
Dipole, Da:	4.83
IP(EA), eV:	-8.87(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-(2-fluorophenyl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CC2=CC3=C(C=C2)OCC3

DOS

IR

Vibrations