Molecule FYI-1001386

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A

Molecule Summary:

ID: FYI-1001386
SMILES: CC1CCN[Pt++]2(NC1)[O-]C(=O)C1(CCC1)C(=O)[O-]2

Received at FYIcenter.com on: 2022-06-23

Molecule ID: FYI-1001386 Edit

Molecule Structure SMILES String: CC1CCN[Pt++]2(NC1)[O-]C(=O)C1(CCC1)C(=O)[O-]2

Download SDF Download SVG Structure in 2D SDF:

FYI-1001386
FYIcenter.com

 18 20  0  0  0  0  0  0  0  0999 V2000
    3.7323    9.1081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1249    7.8467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7249    7.8467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8520    6.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1635    5.3874    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.7799    0.0000 Pt  0  2  0  0  0  0  0  0  0  0  0  0
    3.6862    5.3874    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9977    6.7522    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.0799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.6799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.9799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.9799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4349    0.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4149    0.9899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.6799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.9799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.0799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  8  2  1  0  0  0  0
  9  6  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 10  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 15 12  1  0  0  0  0
 16 12  1  0  0  0  0
 17 16  2  0  0  0  0
 18 16  1  0  0  0  0
 18  6  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001386-3D
FYIcenter.com

 36 38  0  0  1  0  0  0  0  0999 V2000
    1.7323   -0.3342    2.4970 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1192   -0.9784    2.3190 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.5004   -1.5858    3.7832 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6753   -2.4978    4.3625 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9999   -2.2646    3.7861 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3429   -2.1752    1.9165 Pt  0  2  0  0  0  0  0  0  0  0  0  0
    4.3132   -1.8446    0.2766 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0254   -1.8068    0.9586 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9167   -2.7835    0.9432 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.9068   -3.7707    0.0158 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8349   -3.7953   -0.7810 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8490   -4.8907   -0.0631 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5015   -6.2875   -0.0296 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5486   -6.7334   -1.1391 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3405   -5.2501   -1.4810 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7116   -4.8607    0.9650 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8110   -5.6842    0.9266 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7102   -4.0130    1.9989 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.4546    0.2569    1.5998 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7120    0.3545    3.3671 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9646   -1.1261    2.6462 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8288   -0.1430    2.1218 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5938   -2.1150    4.1504 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5818   -0.6692    4.4052 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4146   -3.5568    4.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7139   -2.4148    5.4716 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3146   -1.3047    4.0558 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3485   -2.6207   -0.4162 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6197   -2.8240    1.1656 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3369   -1.3192    0.2408 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5175   -6.8420    0.9340 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5183   -6.2490   -0.4819 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6249   -7.1506   -0.6853 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9385   -7.4204   -1.9181 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3249   -4.9316   -1.8024 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1084   -4.9878   -2.2443 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  2  3  1  0  0  0  0
  2  8  1  0  0  0  0
  2 22  1  0  0  0  0
  3  4  1  0  0  0  0
  3 23  1  0  0  0  0
  3 24  1  0  0  0  0
  4  5  1  0  0  0  0
  4 25  1  0  0  0  0
  4 26  1  0  0  0  0
  5  6  1  0  0  0  0
  5 27  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  1  0  0  0  0
  7 28  1  0  0  0  0
  8 29  1  0  0  0  0
  8 30  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 14  1  0  0  0  0
 13 31  1  0  0  0  0
 13 32  1  0  0  0  0
 14 15  1  0  0  0  0
 14 33  1  0  0  0  0
 14 34  1  0  0  0  0
 15 35  1  0  0  0  0
 15 36  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
M  END
$$$$

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2022-07-26, 1633👍, 0💬