Geometry & MOs

Info

ID:

129678

PubChem CID:

51073543

Reduced:

SO2N3H5C8 (1)

Stoich.:

AB2C3D5E8 (1)

Weight, g/mol:

343.102434

ΔHf, kcal/mol:

24.8

Dipole, Da:

4.06

IP(EA), eV:

-9.68(-1.47)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(1,1-dioxothiolan-3-yl)-N-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1=CSC(=C1)C2=NN(C(=O)O2)CC#N

DOS

IR

Vibrations