Geometry & MOs

Info

ID:	368643
PubChem CID:	127329716
Reduced:	SN2O4C11H18 (1)
Stoich.:	AB2C4D11E18 (1)
Weight, g/mol:	326.104876
ΔH_f, kcal/mol:	-123.17
Dipole, Da:	3.13
IP(EA), eV:	-9.83(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[1-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]piperidin-4-yl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CS(=O)(=O)NCC2CCCOC2

DOS

IR

Vibrations