Geometry & MOs

Info

ID:	337398
PubChem CID:	127257083
Reduced:	NSO3C21H39 (1)
Stoich.:	ABC3D21E39 (1)
Weight, g/mol:	385.265065
ΔH_f, kcal/mol:	-194.62
Dipole, Da:	3.61
IP(EA), eV:	-8.7(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-oxohexadecyl (3R)-thiomorpholine-3-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)CCCCOC(=O)C1CSCCN1

DOS

IR

Vibrations