60210021
  -OEChem-05102420512D

 16 13  0     0  0  0  0  0  0999 V2000
    3.4030    0.2500    0.0000 Y   0  0  0  0  0  0  0  0  0  0  0  0
    6.8671    0.2500    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -0.2500    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    5.1350    0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0010   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5369   -0.2500    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
    5.5335    0.7249    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7365    0.7249    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6025   -0.7249    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3996   -0.7249    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690   -0.8700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4040   -0.0600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8671    0.8700    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.5600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2269    0.2869    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8469   -0.7869    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  5  1  0  0  0  0
  2 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
M  CHG  2   3  -1   6  -1
M  END
> <PUBCHEM_COMPOUND_CID>
60210021

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
14.8

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
1

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBCAAIAAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHAgQAAAQAADJAAQCAABAAAAAAAAAAAAAAAAAAAAAAIAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
carbanide;2-phosphanylethylazanide;yttrium

> <PUBCHEM_IUPAC_CAS_NAME>
carbanide;2-phosphinoethylazanide;yttrium

> <PUBCHEM_IUPAC_NAME_MARKUP>
carbanide;2-phosphanylethylazanide;yttrium

> <PUBCHEM_IUPAC_NAME>
carbanide;2-phosphanylethylazanide;yttrium

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
carbanide;2-phosphanylethylazanide;yttrium

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
carbanide;2-phosphinoethylazanide;yttrium

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C2H7NP.CH3.Y/c3-1-2-4;;/h3H,1-2,4H2;1H3;/q2*-1;

> <PUBCHEM_IUPAC_INCHIKEY>
KCKWZQNCLOQKGC-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
179.960924

> <PUBCHEM_MOLECULAR_FORMULA>
C3H10NPY-2

> <PUBCHEM_MOLECULAR_WEIGHT>
180.00

> <PUBCHEM_OPENEYE_CAN_SMILES>
[CH3-].C(CP)[NH-].[Y]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[CH3-].C(CP)[NH-].[Y]

> <PUBCHEM_CACTVS_TPSA>
1

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
179.960924

> <PUBCHEM_TOTAL_CHARGE>
-2

> <PUBCHEM_HEAVY_ATOM_COUNT>
6

> <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>
3

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_NONSTANDARDBOND>
1  3  6
1  6  6

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$