Geometry & MOs

Info

ID:

345948

PubChem CID:

127270248

Reduced:

N3O3S3C13H23 (1)

Stoich.:

A3B3C3D13E23 (1)

Weight, g/mol:

379.105805

ΔHf, kcal/mol:

-125.99

Dipole, Da:

2.75

IP(EA), eV:

-8.86(-0.29)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[3-(2-methylpiperidin-1-yl)sulfonyl-1,3-thiazolidin-4-yl]-thiomorpholin-4-ylmethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)N2CSCC2C(=O)N3CCSCC3

DOS

IR

Vibrations