33557
 OpenBabel05082101102D

  4  2  0  0  0  0  0  0  0  0999 V2000
    0.6160    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    0.8660    3.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7320    3.5000    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000    2.5000    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>
33557

>  <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>
AAADcQADACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

>  <PUBCHEM_IUPAC_OPENEYE_NAME>
sodium;azide

>  <PUBCHEM_IUPAC_CAS_NAME>
sodium;azide

>  <PUBCHEM_IUPAC_NAME_MARKUP>
sodium;azide

>  <PUBCHEM_IUPAC_NAME>
sodium;azide

>  <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
sodium;azide

>  <PUBCHEM_IUPAC_TRADITIONAL_NAME>
sodium;azide

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

>  <PUBCHEM_IUPAC_INCHIKEY>
PXIPVTKHYLBLMZ-UHFFFAOYSA-N

>  <PUBCHEM_EXACT_MASS>
64.998991

>  <PUBCHEM_MOLECULAR_FORMULA>
N3Na

>  <PUBCHEM_MOLECULAR_WEIGHT>
65.01

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

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

>  <PUBCHEM_CACTVS_TPSA>
3

>  <PUBCHEM_MONOISOTOPIC_WEIGHT>
64.998991

>  <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

$$$$
