Molecule FYI-1007966

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A

Molecule Summary:

ID: FYI-1007966
Names:
InChIKey: DWEOQHQRRKDSHO-UHFFFAOYSA-N
SMILES: CCCCC([Pd])CC

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

Molecule ID: FYI-1007966 Edit

Molecule Structure InChIKey: DWEOQHQRRKDSHO-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCC([Pd])CC

Download SDF Download SVG Structure in 2D SDF:

FYI-1007966
FYIcenter.com

  8  7  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.4000    0.0000 Pd  0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    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
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   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  2  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
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007966-3D
FYIcenter.com

 23 22  0  0  1  0  0  0  0  0999 V2000
    0.8818   -0.0830   -0.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4076   -0.0668   -0.0481 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9460    1.2813    0.4448 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4775    1.2962    0.4366 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0036    2.6464    0.9279 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.3106    2.9812    2.8708 Pd  0  0  0  0  0  0  0  0  0  0  0  0
    6.5330    2.6757    0.9324 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0434    4.0223    1.4323 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5197   -1.0684   -0.4083 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4870    0.7093   -0.7178 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4952    0.0831    0.9816 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7666   -0.2566   -1.0833 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7766   -0.8813    0.6128 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5827    1.4674    1.4798 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5676    2.0904   -0.2185 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8443    1.1108   -0.5972 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8574    0.4916    1.1040 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6223    3.4538    0.2640 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9163    2.5018   -0.0967 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9179    1.8751    1.6004 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6872    4.8403    0.7702 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1538    4.0230    1.4314 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6870    4.2090    2.4677 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  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 14  1  0  0  0  0
  3 15  1  0  0  0  0
  4  5  1  0  0  0  0
  4 16  1  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 18  1  0  0  0  0
  7  8  1  0  0  0  0
  7 19  1  0  0  0  0
  7 20  1  0  0  0  0
  8 21  1  0  0  0  0
  8 22  1  0  0  0  0
  8 23  1  0  0  0  0
M  END
$$$$

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