Molecule FYI-1004167

A

Molecule Summary:

ID: FYI-1004167
Names:
InChIKey: WSPQKTNPCLFKTB-UHFFFAOYSA-N
SMILES: C[Si](C)(C)OCCCCCCCC#CCCCCC#CCCCCCCCO[Si](C)(C)C

Received at FYIcenter.com on: 2023-08-19

Molecule ID: FYI-1004167 Edit

Molecule Structure InChIKey: WSPQKTNPCLFKTB-UHFFFAOYSA-N

Molecule Structure SMILES String: C[Si](C)(C)OCCCCCCCC#CCCCCC#CCCCCCCCO[Si](C)(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1004167
FYIcenter.com

 32 31  0  0  0  0  0  0  0  0999 V2000
   10.3995    8.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    7.0000    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9995    5.7876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    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
    1.2124    0.7000    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
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    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
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3369    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.1000    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
   15.0617    3.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4617    0.8876    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  2  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
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  3  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  3  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 29  1  0  0  0  0
 32 29  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004167-3D
FYIcenter.com

 86 85  0  0  0  0  0  0  0  0999 V2000
    3.1326   -1.5489   -0.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0016   -1.4606   -0.1744 Si  0  0  0  0  0  0  0  0  0  0  0  0
    5.7155   -3.1704   -0.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6718   -0.3503   -1.5349 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4287   -0.8244    1.3214 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9672    0.4930    1.5999 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4515    0.9544    2.9628 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9760    0.9571    2.9763 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5022    1.4248    4.3197 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0230    1.4254    4.3312 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5354    1.8943    5.6872 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0578    1.9043    5.7197 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5402    2.3551    7.0292 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9735    2.7553    8.1919 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4786    3.2219    9.5475 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8401    4.5554    9.8998 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3415    5.0370   11.2606 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7127    6.3810   11.6446 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2107    6.8405   12.9748 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6216    7.2103   14.0614 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1161    7.6766   15.3809 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5138    6.4907   16.2848 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0244    6.9551   17.6492 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4036    5.7515   18.5025 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9112    6.1984   19.8607 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2886    4.9972   20.7183 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8052    5.4823   22.0594 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8132    6.2420   22.7427 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2470    6.8417   24.2523 Si  0  0  0  0  0  0  0  0  0  0  0  0
   13.8374    7.8098   24.9941 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6655    5.4012   25.3838 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7554    7.9546   24.1186 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8584   -1.9522   -1.3201 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6820   -0.5559   -0.2441 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7078   -2.1971    0.4301 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4557   -3.5858   -1.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3332   -3.8383    0.3996 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8052   -3.1385   -0.2967 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4111   -0.7448   -2.5196 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7612   -0.2853   -1.4644 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2630    0.6613   -1.4459 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8741    0.5041    1.5904 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3499    1.1876    0.8444 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0636    0.2920    3.7453 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0631    1.9599    3.1656 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3516    1.6126    2.1800 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3530   -0.0501    2.7620 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1254    0.7659    5.1111 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1292    2.4343    4.5300 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4004    2.0845    3.5388 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3967    0.4156    4.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1480    1.2354    6.4750 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1494    2.8998    5.8992 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4398    2.5662    4.9341 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4385    0.8985    5.5087 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5699    3.3129    9.5063 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.2310    2.4627   10.2978 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7479    4.4511    9.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0777    5.2963    9.1260 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4345    5.1295   11.2312 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1055    4.2820   12.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6222    6.2681   11.6516 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9480    7.1136   10.8637 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3556    8.2643   15.9138 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9930    8.3300   15.2787 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2928    5.8959   15.7926 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6505    5.8301   16.4297 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2517    7.5419   18.1619 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.8974    7.6080   17.5236 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1784    5.1656   17.9940 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5319    5.0993   18.6324 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.1401    6.7904   20.3677 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.7841    6.8519   19.7362 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0656    4.4008   20.2238 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4209    4.3416   20.8612 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6861    6.1088   21.8856 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0835    4.6126   22.6611 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9527    7.1754   25.0930 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5805    8.6603   24.3565 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.1036    8.1843   25.9862 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.8008    4.7390   25.4837 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.9454    5.7581   26.3773 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4971    4.8176   24.9763 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.5445    8.8125   23.4736 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.6089    7.4111   23.7009 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.0400    8.3274   25.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  1 35  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3 36  1  0  0  0  0
  3 37  1  0  0  0  0
  3 38  1  0  0  0  0
  4 39  1  0  0  0  0
  4 40  1  0  0  0  0
  4 41  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 42  1  0  0  0  0
  6 43  1  0  0  0  0
  7  8  1  0  0  0  0
  7 44  1  0  0  0  0
  7 45  1  0  0  0  0
  8  9  1  0  0  0  0
  8 46  1  0  0  0  0
  8 47  1  0  0  0  0
  9 10  1  0  0  0  0
  9 48  1  0  0  0  0
  9 49  1  0  0  0  0
 10 11  1  0  0  0  0
 10 50  1  0  0  0  0
 10 51  1  0  0  0  0
 11 12  1  0  0  0  0
 11 52  1  0  0  0  0
 11 53  1  0  0  0  0
 12 13  1  0  0  0  0
 12 54  1  0  0  0  0
 12 55  1  0  0  0  0
 13 14  3  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 56  1  0  0  0  0
 15 57  1  0  0  0  0
 16 17  1  0  0  0  0
 16 58  1  0  0  0  0
 16 59  1  0  0  0  0
 17 18  1  0  0  0  0
 17 60  1  0  0  0  0
 17 61  1  0  0  0  0
 18 19  1  0  0  0  0
 18 62  1  0  0  0  0
 18 63  1  0  0  0  0
 19 20  3  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 64  1  0  0  0  0
 21 65  1  0  0  0  0
 22 23  1  0  0  0  0
 22 66  1  0  0  0  0
 22 67  1  0  0  0  0
 23 24  1  0  0  0  0
 23 68  1  0  0  0  0
 23 69  1  0  0  0  0
 24 25  1  0  0  0  0
 24 70  1  0  0  0  0
 24 71  1  0  0  0  0
 25 26  1  0  0  0  0
 25 72  1  0  0  0  0
 25 73  1  0  0  0  0
 26 27  1  0  0  0  0
 26 74  1  0  0  0  0
 26 75  1  0  0  0  0
 27 28  1  0  0  0  0
 27 76  1  0  0  0  0
 27 77  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
 30 78  1  0  0  0  0
 30 79  1  0  0  0  0
 30 80  1  0  0  0  0
 31 81  1  0  0  0  0
 31 82  1  0  0  0  0
 31 83  1  0  0  0  0
 32 84  1  0  0  0  0
 32 85  1  0  0  0  0
 32 86  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-08-25, 1625👍, 0💬