Marvin  03300621112D          

  3  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Ca  0  2  0  0  0  0  0  0  0  0  0  0
    0.8250   -0.8250    0.0000 F   0  5  0  0  0  0  0  0  0  0  0  0
    0.8250    0.8250    0.0000 F   0  5  0  0  0  0  0  0  0  0  0  0
M  CHG  3   1   2   2  -1   3  -1
M  END
> <ID>
CHEBI:35437

> <NAME>
calcium difluoride

> <STAR>
3

> <SYNONYM>
Kalziumfluorid; Kalziumdifluorid; fluorite; calcium fluoride; CaF2

> <IUPAC_NAME>
calcium difluoride

> <FORMULA>
CaF2

> <MASS>
78.07481

> <MONOISOTOPIC_MASS>
77.95940

> <CHARGE>
0

> <SMILES>
[F-].[F-].[Ca++]

> <INCHI>
InChI=1S/Ca.2FH/h;2*1H/q+2;;/p-2

> <INCHIKEY>
WUKWITHWXAAZEY-UHFFFAOYSA-L

> <CAS_REGISTRY_NUMBER>
7789-75-5

> <GMELIN_REGISTRY_NUMBER>
18380

> <CHEMIDPLUS>
7789-75-5

> <NIST_CHEMISTRY_WEBBOOK>
7789-75-5

$$$$