12729162
  -OEChem-04252421392D

  3  2  0     0  0  0  0  0  0999 V2000
    2.5369   -0.1550    0.0000 Ti  0  0  0  0  0  0  0  0  0  0  0  0
    3.0739    0.1550    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.1550    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
12729162

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
0

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQAAAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
titanium dihydride

> <PUBCHEM_IUPAC_CAS_NAME>
titanium dihydride

> <PUBCHEM_IUPAC_NAME_MARKUP>
titanium dihydride

> <PUBCHEM_IUPAC_NAME>
titanium dihydride

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
titanium dihydride

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
titanium dihydride

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/Ti.2H

> <PUBCHEM_IUPAC_INCHIKEY>
COEYXIBLSAIEKV-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
49.9635907

> <PUBCHEM_MOLECULAR_FORMULA>
H2Ti

> <PUBCHEM_MOLECULAR_WEIGHT>
49.883

> <PUBCHEM_OPENEYE_CAN_SMILES>
[TiH2]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[TiH2]

> <PUBCHEM_CACTVS_TPSA>
0

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
49.9635907

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
1

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$