Molecule FYI-1004706

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A

Molecule Summary:

ID: FYI-1004706
Names:
InChIKey: WKSOWQFLFIHTDO-UHFFFAOYSA-N
SMILES: CCC[Sn](CC)(CCC)CCC

Received at FYIcenter.com on: 2023-09-22

Molecule ID: FYI-1004706 Edit

Molecule Structure InChIKey: WKSOWQFLFIHTDO-UHFFFAOYSA-N

Molecule Structure SMILES String: CCC[Sn](CC)(CCC)CCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1004706
FYIcenter.com

 12 11  0  0  0  0  0  0  0  0999 V2000
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 Sn  0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    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
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    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  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  3  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  3  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004706-3D
FYIcenter.com

 38 37  0  0  0  0  0  0  0  0999 V2000
    0.8999   -0.1789    2.4157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   -0.1374    2.3935 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9733   -0.8097    1.1379 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1195   -0.7691    1.1461 Sn  0  0  0  0  0  0  0  0  0  0  0  0
    5.8367   -1.7359   -0.6290 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3556   -1.7140   -0.6583 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8779    1.2374    1.2311 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3975    2.0447    0.0284 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9529    3.4660    0.0677 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8366   -1.8350    2.8622 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3571   -3.2829    2.8139 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8546   -4.0664    4.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5261    0.3175    3.3363 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5429   -1.2314    2.4108 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4848    0.3506    1.5319 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8135   -0.6612    3.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7620    0.9213    2.4213 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6095   -0.2840    0.2297 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6475   -1.8711    1.0995 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4359   -1.2057   -1.5181 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4746   -2.7857   -0.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7195   -0.6650   -0.6583 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7191   -2.2207   -1.5769 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7610   -2.2427    0.2298 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9877    1.1862    1.2378 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5300    1.7092    2.1745 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2869    2.0852    0.0323 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7353    1.5505   -0.9081 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6173    3.9859    0.9905 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5870    4.0345   -0.8133 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0630    3.4470    0.0429 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4540   -1.3319    3.7756 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9467   -1.7973    2.8618 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7369   -3.7663    1.8879 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2460   -3.3039    2.7992 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9653   -4.0725    4.0490 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4939   -5.1146    3.9621 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4702   -3.6117    4.9619 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  7  1  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6 22  1  0  0  0  0
  6 23  1  0  0  0  0
  6 24  1  0  0  0  0
  7  8  1  0  0  0  0
  7 25  1  0  0  0  0
  7 26  1  0  0  0  0
  8  9  1  0  0  0  0
  8 27  1  0  0  0  0
  8 28  1  0  0  0  0
  9 29  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
 12 36  1  0  0  0  0
 12 37  1  0  0  0  0
 12 38  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-09-25, 2786👍, 0💬