Molecule FYI-1007971

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A

Molecule Summary:

ID: FYI-1007971
Names:
InChIKey: DPABCZVCOUPUES-UHFFFAOYSA-N
SMILES: CCCCCCCCCCC[La]

Received at FYIcenter.com on: 2024-03-22

Molecule ID: FYI-1007971 Edit

Molecule Structure InChIKey: DPABCZVCOUPUES-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCC[La]

Download SDF Download SVG Structure in 2D SDF:

FYI-1007971
FYIcenter.com

 12 11  0  0  0  0  0  0  0  0999 V2000
    0.8230   12.0579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2536   10.7789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0765    9.6463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5070    8.3674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3299    7.2346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7605    5.9557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5834    4.8231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0139    3.5441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8368    2.4115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2675    1.1326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0904    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   13.1905    0.0000 La  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
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
  1 12  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007971-3D
FYIcenter.com

 35 34  0  0  0  0  0  0  0  0999 V2000
    0.9204   -0.0855    0.0648 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4458   -0.0865    0.0486 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9806   -0.5026   -1.3259 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5128   -0.5051   -1.3405 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0446   -0.9223   -2.7158 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5765   -0.9279   -2.7324 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1061   -1.3448   -4.1085 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6383   -1.3505   -4.1263 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1679   -1.7655   -5.5032 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6986   -1.7683   -5.5216 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2180   -2.1890   -6.8897 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3374   -4.6130   -7.4510 La  0  0  0  0  0  0  0  0  0  0  0  0
    0.5591    0.2187    1.0696 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5322   -1.1014   -0.1613 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5276    0.6313   -0.6875 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8132   -0.7952    0.8228 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8092    0.9346    0.2976 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6071    0.2084   -2.0960 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6098   -1.5228   -1.5705 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8864   -1.2165   -0.5710 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8848    0.5146   -1.0965 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6714   -0.2103   -3.4852 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6714   -1.9416   -2.9603 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9500   -1.6403   -1.9636 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9505    0.0912   -2.4879 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7324   -0.6320   -4.8768 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7318   -2.3637   -4.3531 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0119   -2.0635   -3.3583 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0116   -0.3316   -3.8810 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7921   -1.0528   -6.2706 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7961   -2.7851   -5.7485 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0795   -2.4840   -4.7612 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0818   -0.7518   -5.2839 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3281   -2.1988   -6.8833 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8691   -1.4809   -7.6714 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3 18  1  0  0  0  0
  3 19  1  0  0  0  0
  4  5  1  0  0  0  0
  4 20  1  0  0  0  0
  4 21  1  0  0  0  0
  5  6  1  0  0  0  0
  5 22  1  0  0  0  0
  5 23  1  0  0  0  0
  6  7  1  0  0  0  0
  6 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8  9  1  0  0  0  0
  8 28  1  0  0  0  0
  8 29  1  0  0  0  0
  9 10  1  0  0  0  0
  9 30  1  0  0  0  0
  9 31  1  0  0  0  0
 10 11  1  0  0  0  0
 10 32  1  0  0  0  0
 10 33  1  0  0  0  0
 11 12  1  0  0  0  0
 11 34  1  0  0  0  0
 11 35  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2024-04-14, 135👍, 0💬