Geometry & MOs

Info

ID:	139206
PubChem CID:	52491858
Reduced:	N2S2O3C16H24 (1)
Stoich.:	A2B2C3D16E24 (1)
Weight, g/mol:	329.140927
ΔH_f, kcal/mol:	-127.43
Dipole, Da:	3.8
IP(EA), eV:	-8.71(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[[(3S)-1,1-dioxothiolan-3-yl]-methylamino]acetamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N[C@@H]1CCCN(C1)C(=O)CSC2=CC=C(C=C2)C

DOS

IR

Vibrations