Geometry & MOs

Info

ID:	240765
PubChem CID:	93617396
Reduced:	SN3O4C14H21 (1)
Stoich.:	AB3C4D14E21 (1)
Weight, g/mol:	246.067428
ΔH_f, kcal/mol:	-105.5
Dipole, Da:	8.44
IP(EA), eV:	-9.92(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-ethylsulfonyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCCN1C(=O)CS(=O)(=O)CC2=NC(=NO2)C3CC3

DOS

IR

Vibrations