Geometry & MOs

Info

ID:

226304

PubChem CID:

87350390

Reduced:

C3S3O5H6 (1)

Stoich.:

A3B3C5D6 (1)

Weight, g/mol:

195.074287

ΔHf, kcal/mol:

-201.74

Dipole, Da:

2.41

IP(EA), eV:

-9.46(-1.27)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N,2,3,4,6-pentahydroxyhexanamide

Drug info:

PubChemData

Smile

C(C(C(=O)O)(S)S(=O)(=O)O)S

DOS

IR

Vibrations