Geometry & MOs

Info

ID:	357827
PubChem CID:	127294670
Reduced:	S2O3N4C16H32 (1)
Stoich.:	A2B3C4D16E32 (1)
Weight, g/mol:	350.108248
ΔH_f, kcal/mol:	-147.92
Dipole, Da:	7.3
IP(EA), eV:	-8.64(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-oxo-N-(2-thiomorpholin-4-ylsulfonylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCCN1CCC(CC1)N(C)C(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations