Geometry & MOs

Info

ID:	366138
PubChem CID:	127319540
Reduced:	SN3O3C16H27 (1)
Stoich.:	AB3C3D16E27 (1)
Weight, g/mol:	320.083078
ΔH_f, kcal/mol:	-146.91
Dipole, Da:	5.59
IP(EA), eV:	-8.81(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-5-phenyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2CCCS(=O)(=O)C2

DOS

IR

Vibrations