Molecule FYI-1014528

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A

Molecule Summary:

ID: FYI-1014528
Names:
InChIKey: IAVVTXAPVCKJBU-UHFFFAOYSA-N
SMILES: c2ccc([Be]c1ccccc1)cc2

Received at FYIcenter.com on: 2025-04-25

Molecule ID: FYI-1014528 Edit

Molecule Structure InChIKey: IAVVTXAPVCKJBU-UHFFFAOYSA-N

Molecule Structure SMILES String: c2ccc([Be]c1ccccc1)cc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1014528
FYIcenter.com

 13 14  0  0  0  0  0  0  0  0999 V2000
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 Be  0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 11  6  1  0  0  0  0
 12  4  1  0  0  0  0
 13 12  2  0  0  0  0
 13  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014528-3D
FYIcenter.com

 23 24  0  0  0  0  0  0  0  0999 V2000
   -1.3846   -0.2362    0.0625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9250    1.0819    0.0272 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4421    1.3329   -0.0861 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3640    0.2847   -0.1635 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0576    0.9301   -0.3107 Be  0  0  0  0  0  0  0  0  0  0  0  0
    4.7956    0.4256   -0.4612 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3114   -0.2899   -1.5489 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6948   -0.5155   -1.6420 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5551   -0.0269   -0.6511 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0353    0.6745    0.4399 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6591    0.8983    0.5321 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9080   -1.0458   -0.1303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4724   -1.2997   -0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4466   -0.4257    0.1491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6179    1.9085    0.0810 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8058    2.3504   -0.1189 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6541   -0.6427   -2.3313 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1046   -1.0494   -2.4900 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6243   -0.1813   -0.7315 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6983    1.0618    1.2035 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2574    1.4644    1.3614 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6026   -1.8692   -0.1839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8450   -2.3155    0.0186 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3 16  1  0  0  0  0
  4  5  1  0  0  0  0
  4 12  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  2  0  0  0  0
  7  8  2  0  0  0  0
  7 17  1  0  0  0  0
  8  9  1  0  0  0  0
  8 18  1  0  0  0  0
  9 10  2  0  0  0  0
  9 19  1  0  0  0  0
 10 11  1  0  0  0  0
 10 20  1  0  0  0  0
 11 21  1  0  0  0  0
 12 13  1  0  0  0  0
 12 22  1  0  0  0  0
 13 23  1  0  0  0  0
M  END
$$$$

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2025-05-12, 471👍, 0💬