Marvin  03040701052D          

  6  3  0  0  0  0            999 V2000
   -0.7145   -0.4125    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7000    0.8250    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    1.7000   -0.4125    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
M  CHG  4   1  -1   3  -1   5   1   6   1
M  END
> <ID>
CHEBI:29377

> <NAME>
sodium carbonate

> <STAR>
3

> <SYNONYM>
Natriumkarbonat; Na2CO3; disodium carbonate

> <IUPAC_NAME>
sodium carbonate; disodium trioxidocarbonate

> <FORMULA>
CNa2O3

> <MASS>
105.98844

> <MONOISOTOPIC_MASS>
105.96428

> <CHARGE>
0

> <SMILES>
[Na+].[Na+].[O-]C([O-])=O

> <INCHI>
InChI=1S/CH2O3.2Na/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2

> <INCHIKEY>
CDBYLPFSWZWCQE-UHFFFAOYSA-L

> <CAS_REGISTRY_NUMBER>
497-19-8

> <CHEMIDPLUS>
497-19-8

> <NIST_CHEMISTRY_WEBBOOK>
497-19-8

$$$$