Geometry & MOs

Info

ID:	357546
PubChem CID:	127294209
Reduced:	S2N3O4C16H29 (1)
Stoich.:	A2B3C4D16E29 (1)
Weight, g/mol:	377.180684
ΔH_f, kcal/mol:	-199.48
Dipole, Da:	1.32
IP(EA), eV:	-8.68(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-piperidin-1-yl-N-(2-thiomorpholin-4-ylsulfonylethyl)butanamide

Drug info:

PubChemData

Smile

CCCC(=O)N1CCCC(C1)C(=O)NCCS(=O)(=O)N2CCSCC2

DOS

IR

Vibrations