22764821
  -OEChem-04252400592D

  4  2  0     0  0  0  0  0  0999 V2000
    4.5981    0.0000    0.0000 Tl  0  3  0  0  0  0  0  0  0  0  0  0
    2.8660    0.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.5000    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    3.7320    0.5000    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  2  4  2  0  0  0  0
M  CHG  4   1   1   2   1   3  -1   4  -1
M  END
> <PUBCHEM_COMPOUND_CID>
22764821

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
15.5

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQADAAAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
thallium(1+);azide

> <PUBCHEM_IUPAC_CAS_NAME>
thallium(1+);azide

> <PUBCHEM_IUPAC_NAME_MARKUP>
thallium(1+);azide

> <PUBCHEM_IUPAC_NAME>
thallium(1+);azide

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
thallium(1+);azide

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
thallium(1+);azide

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/N3.Tl/c1-3-2;/q-1;+1

> <PUBCHEM_IUPAC_INCHIKEY>
GMUSFHMEMWCQIE-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
246.98365

> <PUBCHEM_MOLECULAR_FORMULA>
N3Tl

> <PUBCHEM_MOLECULAR_WEIGHT>
246.40

> <PUBCHEM_OPENEYE_CAN_SMILES>
[N-]=[N+]=[N-].[Tl+]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[N-]=[N+]=[N-].[Tl+]

> <PUBCHEM_CACTVS_TPSA>
3

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
246.98365

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
4

> <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>
2

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$