Geometry & MOs

Info

ID:	357822
PubChem CID:	127294665
Reduced:	S2N3O3C15H29 (1)
Stoich.:	A2B3C3D15E29 (1)
Weight, g/mol:	336.128983
ΔH_f, kcal/mol:	-152.5
Dipole, Da:	8.31
IP(EA), eV:	-8.6(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C1CCCCCC1)C(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations