Geometry & MOs

Info

ID:	337396
PubChem CID:	127257081
Reduced:	NSO3C13H23 (1)
Stoich.:	ABC3D13E23 (1)
Weight, g/mol:	301.171165
ΔH_f, kcal/mol:	-157.09
Dipole, Da:	2.96
IP(EA), eV:	-8.82(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-oxodecyl thiomorpholine-3-carboxylate

Drug info:

PubChemData

Smile

CCC(CCC(=O)C)COC(=O)C1CSCCN1

DOS

IR

Vibrations