Molecule FYI-1002611

A

Molecule Summary:

ID: FYI-1002611
Names:
InChIKey: VIGKXSZWCIUYJE-UHFFFAOYSA-N
SMILES: CC(C)[SiH](CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(C)C

Received at FYIcenter.com on: 2023-04-12

Molecule ID: FYI-1002611 Edit

Molecule Structure InChIKey: VIGKXSZWCIUYJE-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(C)[SiH](CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1002611
FYIcenter.com

 28 27  0  0  0  0  0  0  0  0999 V2000
    1.3903    1.2863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9430    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2279    2.4081    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    3.6182    2.2435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4558    3.3654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8461    3.2009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2364    3.0364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6267    2.8720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0170    2.7074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4073    2.5430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7977    2.3784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1879    2.2140    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.6331    0.9881    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.9621    3.7687    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   11.5718    3.9332    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   11.2428    1.1527    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.8525    1.3171    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.1815    4.0977    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.7912    4.2622    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.4622    1.4816    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.0719    1.6461    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.4009    4.4267    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.0106    4.5912    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.6817    1.8106    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.6752    3.6943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5128    4.8162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2849    3.8589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
  9 20  1  0  0  0  0
  9 21  1  0  0  0  0
  8 22  1  0  0  0  0
  8 23  1  0  0  0  0
  7 24  1  0  0  0  0
  7 25  1  0  0  0  0
  4 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002611-3D
FYIcenter.com

 47 46  0     0  0  0  0  0  0999 V2000
   -4.4258    0.3481   -0.7160 Si  0  0  0  0  0  0  0  0  0  0  0  0
    0.0254   -0.2545   -1.8124 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6263   -2.3147   -1.5989 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.2706   -2.4630    0.9150 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.7635   -1.9600   -0.5784 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.1031   -0.8402    1.8613 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.1434    0.0761    1.7899 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.0684    1.8005    1.3595 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.7999    1.5339   -0.3812 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.7146    0.0471   -1.6226 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.3175    2.0334   -0.9847 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.6134    0.9992    1.1754 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.2851    0.1628   -0.7159 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.0180   -1.0209    0.6094 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8253   -0.3995   -1.3274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1127    2.0117    0.0490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2542   -0.7930    0.4932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7243   -0.6837   -0.2932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4071   -1.1648   -0.9042 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6991   -1.4528    0.1021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3342    2.9585   -0.8735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3959    2.7012    0.5305 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2302   -2.2602    0.0457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6842   -0.6781    1.9130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1822   -0.3217    1.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7708    0.9246    0.3547 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0050    0.7876   -0.5239 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2400    0.2223    0.1332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3203    0.5198   -1.8892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0602   -1.3345   -1.8503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4201    0.2723   -2.0936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4835    1.8542    0.9339 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3077   -0.4904    0.5472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5450    0.2389    0.2685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0765   -1.4423    0.4134 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8819    3.1635   -1.8009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3555    2.5469   -1.1445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1525    3.9182   -0.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0688    2.9273   -0.3054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9523    2.0876    1.2467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1593    3.6477    1.0297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2143   -2.6702    0.0279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6611   -2.3835   -0.9547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8197   -2.8784    0.7324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6261   -0.9513    1.9641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7876    0.3322    2.3213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2246   -1.3478    2.5924 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  1 29  1  0  0  0  0
  2 19  1  0  0  0  0
  3 19  1  0  0  0  0
  4 20  1  0  0  0  0
  5 20  1  0  0  0  0
  6 25  1  0  0  0  0
  7 25  1  0  0  0  0
  8 26  1  0  0  0  0
  9 26  1  0  0  0  0
 10 27  1  0  0  0  0
 11 27  1  0  0  0  0
 12 28  1  0  0  0  0
 13 28  1  0  0  0  0
 14 28  1  0  0  0  0
 15 18  1  0  0  0  0
 15 30  1  0  0  0  0
 15 31  1  0  0  0  0
 16 21  1  0  0  0  0
 16 22  1  0  0  0  0
 16 32  1  0  0  0  0
 17 23  1  0  0  0  0
 17 24  1  0  0  0  0
 17 33  1  0  0  0  0
 18 19  1  0  0  0  0
 18 34  1  0  0  0  0
 18 35  1  0  0  0  0
 19 20  1  0  0  0  0
 20 25  1  0  0  0  0
 21 36  1  0  0  0  0
 21 37  1  0  0  0  0
 21 38  1  0  0  0  0
 22 39  1  0  0  0  0
 22 40  1  0  0  0  0
 22 41  1  0  0  0  0
 23 42  1  0  0  0  0
 23 43  1  0  0  0  0
 23 44  1  0  0  0  0
 24 45  1  0  0  0  0
 24 46  1  0  0  0  0
 24 47  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-04-17, 2106👍, 0💬