9887053
  -OEChem-09272320522D

 29 27  0     1  0  0  0  0  0999 V2000
    3.3987   -0.4955    0.0000 Pt  0  2  0  0  0  0  0  0  0  0  0  0
    2.5896   -1.0833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2077   -1.0833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3109   -2.8434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4865   -2.8434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5896    0.0923    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    4.2077    0.0923    0.0000 N   0  5  0  0  0  0  0  0  0  0  0  0
    2.8987    1.0434    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.8987    1.0434    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.3640    1.9373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4333    1.9373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8779    2.8434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9195    2.8434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8987   -2.0343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8987   -2.0343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0540    0.9480    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7433    0.9480    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8850    2.3309    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8942    1.5327    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9031    1.5327    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9124    2.3309    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.0993    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7973   -0.0993    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9840    3.4542    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2942    3.0524    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5032    3.0524    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8134    3.4542    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.8917    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7973   -0.8917    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2 14  1  0  0  0  0
  2 28  1  0  0  0  0
  3 15  1  0  0  0  0
  3 29  1  0  0  0  0
  4 14  2  0  0  0  0
  5 15  2  0  0  0  0
  6  8  1  0  0  0  0
  6 22  1  0  0  0  0
  7  9  1  0  0  0  0
  7 23  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 16  1  1  0  0  0
  9 11  1  0  0  0  0
  9 17  1  6  0  0  0
 10 12  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 11 13  1  0  0  0  0
 11 20  1  0  0  0  0
 11 21  1  0  0  0  0
 12 13  1  0  0  0  0
 12 24  1  0  0  0  0
 12 25  1  0  0  0  0
 13 26  1  0  0  0  0
 13 27  1  0  0  0  0
 14 15  1  0  0  0  0
M  CHG  3   1   2   6  -1   7  -1
M  END
> <PUBCHEM_COMPOUND_CID>
9887053

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
191

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
6

> <PUBCHEM_CACTVS_HBOND_DONOR>
4

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBzOAAAAAAAAAAABAAAAAAAAWJAAAAwAAAAAAAAAFgAAAAAHgAQCAAACCjBgAQACABAAgAIAACQCAIAAAAAAAAAAIBAAAABQAIAgAAAAAAAEAABAAEQAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
[(1R,2R)-2-azanidylcyclohexyl]azanide;oxalic acid;platinum(2+)

> <PUBCHEM_IUPAC_CAS_NAME>
[(1R,2R)-2-azanidylcyclohexyl]azanide;oxalic acid;platinum(2+)

> <PUBCHEM_IUPAC_NAME_MARKUP>
[(1<I>R</I>,2<I>R</I>)-2-azanidylcyclohexyl]azanide;oxalic acid;platinum(2+)

> <PUBCHEM_IUPAC_NAME>
[(1R,2R)-2-azanidylcyclohexyl]azanide;oxalic acid;platinum(2+)

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
[(1R,2R)-2-azanidylcyclohexyl]azanide;ethanedioic acid;platinum(2+)

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
[(1R,2R)-2-amidylcyclohexyl]azanide;oxalic acid;platinum(2+)

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C6H12N2.C2H2O4.Pt/c7-5-3-1-2-4-6(5)8;3-1(4)2(5)6;/h5-8H,1-4H2;(H,3,4)(H,5,6);/q-2;;+2/t5-,6-;;/m1../s1

> <PUBCHEM_IUPAC_INCHIKEY>
DRMCATBEKSVAPL-BNTLRKBRSA-N

> <PUBCHEM_EXACT_MASS>
397.060151

> <PUBCHEM_MOLECULAR_FORMULA>
C8H14N2O4Pt

> <PUBCHEM_MOLECULAR_WEIGHT>
397.29

> <PUBCHEM_OPENEYE_CAN_SMILES>
C1CCC(C(C1)[NH-])[NH-].C(=O)(C(=O)O)O.[Pt+2]

> <PUBCHEM_OPENEYE_ISO_SMILES>
C1CC[C@H]([C@@H](C1)[NH-])[NH-].C(=O)(C(=O)O)O.[Pt+2]

> <PUBCHEM_CACTVS_TPSA>
76.6

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
397.060151

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
15

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
2

> <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  2  6
1  3  6
1  6  6
1  7  6

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
8  16  5
9  17  6

$$$$