Geometry & MOs

Info

ID:	357830
PubChem CID:	127294673
Reduced:	S2N3O4C13H25 (1)
Stoich.:	A2B3C4D13E25 (1)
Weight, g/mol:	350.144633
ΔH_f, kcal/mol:	-191.0
Dipole, Da:	5.72
IP(EA), eV:	-8.57(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CCC1CO)C(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations