Geometry & MOs

Info

ID:	371236
PubChem CID:	127344445
Reduced:	S2N4O4C13H24 (1)
Stoich.:	A2B4C4D13E24 (1)
Weight, g/mol:	378.175933
ΔH_f, kcal/mol:	-175.44
Dipole, Da:	5.16
IP(EA), eV:	-8.75(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-propan-2-yl-N-(2-thiomorpholin-4-ylsulfonylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN1CCC(C1=O)N(C)C(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations