79079
  -OEChem-05092410562D

  7  6  0     0  0  0  0  0  0999 V2000
    3.7320    0.5000    0.0000 N   0  0  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
    4.5981    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2881   -0.5369    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1350   -0.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9081    0.5369    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  4  1  0  0  0  0
  2  3  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
M  CHG  2   2   1   3  -1
M  END
> <PUBCHEM_COMPOUND_CID>
79079

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
41.2

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQADAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAFAAIAAAAAAAAAAQCAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
azidomethane

> <PUBCHEM_IUPAC_CAS_NAME>
azidomethane

> <PUBCHEM_IUPAC_NAME_MARKUP>
azidomethane

> <PUBCHEM_IUPAC_NAME>
azidomethane

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
azidomethane

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
azidomethane

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/CH3N3/c1-3-4-2/h1H3

> <PUBCHEM_IUPAC_INCHIKEY>
PBTHJVDBCFJQGG-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3_AA>
1.2

> <PUBCHEM_EXACT_MASS>
57.032697108

> <PUBCHEM_MOLECULAR_FORMULA>
CH3N3

> <PUBCHEM_MOLECULAR_WEIGHT>
57.055

> <PUBCHEM_OPENEYE_CAN_SMILES>
CN=[N+]=[N-]

> <PUBCHEM_OPENEYE_ISO_SMILES>
CN=[N+]=[N-]

> <PUBCHEM_CACTVS_TPSA>
14.4

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
57.032697108

> <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>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$