Geometry & MOs

Info

ID:	357367
PubChem CID:	127294000
Reduced:	S2O3N4C10H16 (1)
Stoich.:	A2B3C4D10E16 (1)
Weight, g/mol:	398.108248
ΔH_f, kcal/mol:	-84.88
Dipole, Da:	3.86
IP(EA), eV:	-8.63(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-propan-2-yl-N-(2-thiomorpholin-4-ylsulfonylethyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

C1CSCCN1S(=O)(=O)CCNC(=O)C2=CC=NN2

DOS

IR

Vibrations