Geometry & MOs

Info

ID:	240768
PubChem CID:	93617420
Reduced:	NSO5C15H21 (1)
Stoich.:	ABC5D15E21 (1)
Weight, g/mol:	340.089306
ΔH_f, kcal/mol:	-186.8
Dipole, Da:	5.13
IP(EA), eV:	-9.32(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1R)-1-(4-fluorophenyl)ethyl]sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCOCC1)S(=O)(=O)CC2=CC=CC=C2OC

DOS

IR

Vibrations