Geometry & MOs

Info

ID:

357836

PubChem CID:

127294679

Reduced:

S2O3N4C15H28 (1)

Stoich.:

A2B3C4D15E28 (1)

Weight, g/mol:

335.133734

ΔHf, kcal/mol:

-114.11

Dipole, Da:

5.69

IP(EA), eV:

-8.56(0.25)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC1CN2CCN(CC2)C(=O)NCCS(=O)(=O)N3CCSCC3

DOS

IR

Vibrations