Geometry & MOs

Info

ID:	369256
PubChem CID:	127331628
Reduced:	NOSC13H23 (1)
Stoich.:	ABCD13E23 (1)
Weight, g/mol:	251.064986
ΔH_f, kcal/mol:	-80.24
Dipole, Da:	3.79
IP(EA), eV:	-8.64(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethylthiomorpholin-4-yl)-2-methylsulfonylethanone

Drug info:

PubChemData

Smile

CC1C(SCCN1C(=O)C2(CCCC2)C)C

DOS

IR

Vibrations