Geometry & MOs

Info

ID:

179874

PubChem CID:

76548776

Reduced:

NOC10H13 (1)

Stoich.:

ABC10D13 (1)

Weight, g/mol:

272.961309

ΔHf, kcal/mol:

0.15

Dipole, Da:

3.26

IP(EA), eV:

-8.32(0.47)

Spin(Sz, S2):

None, None

Charge, e:

-2

Chem-info

IUPAC name:

(2-amino-5-oxo-5-sulfinatooxypentanoyl) sulfite

Drug info:

PubChemData

Smile

COC1CN(C1)C2=CC=CC=C2

DOS

IR

Vibrations