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triacetoxysilyl acetate
triacetoxysilyl acetate ID: AN-45939
CAS:562-90-3
Supplier:AN PharmaTech Co Ltd

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SMILES:[Si](OC(=O)C)(OC(=O)C)(OC(=O)C)OC(=O)C	68419
FORMULA: C8H12O8Si
MASS: 264.2616
EXACT MASS: 264.0301439
INTERATOMIC DISTANCES

             Si   1      O   2      O   3      O   4      O   5      O   6
              ------------------------------------------------------------------
  Si   1    0.0000 
   O   2    1.0000     0.0000 
   O   3    1.0001     2.0000     0.0000 
   O   4    1.0000     1.4142     1.4142     0.0000 
   O   5    1.0000     1.4142     1.4143     2.0000     0.0000 
   O   6    2.0000     1.7320     2.6458     2.9093     1.2393     0.0000 
   O   7    2.0000     2.6458     1.7320     1.2394     2.9093     4.0000 
   O   8    2.0000     1.2393     2.9093     1.7320     2.6457     2.8284 
   O   9    2.0000     2.9093     1.2393     2.6457     1.7320     2.8284 
   C  10    1.7320     2.3941     1.5060     2.6457     1.0000     1.8803 
   C  11    1.7320     1.5059     2.3941     1.0000     2.6457     3.2348 
   C  12    1.7321     2.6458     1.0000     1.5060     2.3942     3.6055 
   C  13    1.7320     1.0000     2.6458     2.3941     1.5059     1.0000 
   C  14    2.6458     1.7321     3.6056     3.1196     2.5036     1.7321 
   C  15    2.6458     3.1196     2.5036     3.6055     1.7321     2.0179 
   C  16    2.6458     2.5036     3.1197     1.7321     3.6055     4.2342 
   C  17    2.6458     3.6055     1.7320     2.5036     3.1196     4.3589 
   H  18    2.9083     3.8024     2.1114     2.5468     3.5257     4.7545 
   H  19    3.2380     4.2100     2.2900     3.1229     3.6354     4.8707 
   H  20    2.5121     3.5086     1.5200     2.6112     2.7933     4.0203 
   H  21    2.9083     2.5468     3.5257     2.1115     3.8024     4.2599 
   H  22    3.2380     3.1229     3.6354     2.2901     4.2100     4.8539 
   H  23    2.5121     2.6113     2.7933     1.5201     3.5087     4.2987 
   H  24    2.9083     3.5257     2.5468     3.8024     2.1115     2.6020 
   H  25    3.2380     3.6354     3.1229     4.2100     2.2901     2.3256 
   H  26    2.5121     2.7933     2.6113     3.5086     1.5201     1.4637 
   H  27    2.9083     2.1115     3.8025     3.5257     2.5468     1.5201 
   H  28    3.2380     2.2901     4.2101     3.6354     3.1229     2.2901 
   H  29    2.5121     1.5201     3.5087     2.7933     2.6112     2.1114 

              O   7      O   8      O   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   O   7    0.0000 
   O   8    2.8285     0.0000 
   O   9    2.8284     3.9999     0.0000 
   C  10    3.2348     3.6055     1.0000     0.0000 
   C  11    1.8804     1.0000     3.6055     3.4640     0.0000 
   C  12    1.0000     3.2348     1.8804     2.4495     2.4495     0.0000 
   C  13    3.6055     1.8803     3.2348     2.4494     2.4494     3.4641 
   C  14    4.3590     2.0179     4.2342     3.4252     2.8754     4.3590 
   C  15    4.2342     4.3589     1.7321     1.0001     4.3589     3.4253 
   C  16    2.0179     1.7321     4.3589     4.3589     1.0001     2.8754 
   C  17    1.7320     4.2342     2.0179     2.8754     3.4252     1.0000 
   H  18    1.5200     4.2599     2.6019     3.4038     3.3661     1.1766 
   H  19    2.2900     4.8539     2.3256     3.2678     4.0361     1.6199 
   H  20    2.1114     4.2987     1.4637     2.3914     3.5920     1.1766 
   H  21    2.6020     1.5201     4.7545     4.6402     1.1767     3.4039 
   H  22    2.3256     2.2901     4.8707     4.9339     1.6200     3.2678 
   H  23    1.4637     2.1115     4.0203     4.1517     1.1767     2.3914 
   H  24    4.2599     4.7546     1.5201     1.1767     4.6402     3.3661 
   H  25    4.8539     4.8707     2.2901     1.6200     4.9339     4.0361 
   H  26    4.2987     4.0203     2.1114     1.1766     4.1517     3.5920 
   H  27    4.7546     2.6019     4.2599     3.3661     3.4038     4.6403 
   H  28    4.8708     2.3256     4.8539     4.0361     3.2678     4.9340 
   H  29    4.0204     1.4637     4.2987     3.5920     2.3914     4.1518 

              C  13      C  14      C  15      C  16      C  17      H  18
              ------------------------------------------------------------------
   C  13    0.0000 
   C  14    1.0001     0.0000 
   C  15    2.8754     3.7417     0.0000 
   C  16    3.4252     3.7417     5.2915     0.0000 
   C  17    4.3589     5.2915     3.7417     3.7417     0.0000 
   H  18    4.6402     5.5256     4.3079     3.5155     0.6200     0.0000 
   H  19    4.9339     5.8809     4.0510     4.3079     0.6200     0.8768 
   H  20    4.1517     5.1222     3.1954     4.0510     0.6200     1.2399 
   H  21    3.3661     3.5155     5.5256     0.6200     4.3079     4.1130 
   H  22    4.0361     4.3079     5.8809     0.6200     4.0510     3.7417 
   H  23    3.5920     4.0511     5.1222     0.6201     3.1954     2.9273 
   H  24    3.4039     4.3080     0.6201     5.5256     3.5154     4.1129 
   H  25    3.2678     4.0510     0.6200     5.8809     4.3079     4.8873 
   H  26    2.3914     3.1954     0.6200     5.1222     4.0510     4.5792 
   H  27    1.1767     0.6200     3.5155     4.3079     5.5256     5.8167 
   H  28    1.6200     0.6200     4.3079     4.0510     5.8809     6.0924 
   H  29    1.1766     0.6200     4.0510     3.1954     5.1222     5.2915 

              H  19      H  20      H  21      H  22      H  23      H  24
              ------------------------------------------------------------------
   H  19    0.0000 
   H  20    0.8768     0.0000 
   H  21    4.8873     4.5792     0.0000 
   H  22    4.5792     4.4260     0.8768     0.0000 
   H  23    3.7416     3.5526     1.2400     0.8768     0.0000 
   H  24    3.7416     2.9273     5.8167     6.0923     5.2915     0.0000 
   H  25    4.5792     3.7417     6.0924     6.4759     5.7290     0.8769 
   H  26    4.4260     3.5526     5.2915     5.7290     5.0242     1.2400 
   H  27    6.0924     5.2915     4.1130     4.8873     4.5792     4.1131 
   H  28    6.4759     5.7290     3.7417     4.5792     4.4261     4.8873 
   H  29    5.7290     5.0242     2.9273     3.7417     3.5527     4.5792 

              H  25      H  26      H  27      H  28      H  29
              -------------------------------------------------------
   H  25    0.0000 
   H  26    0.8768     0.0000 
   H  27    3.7417     2.9273     0.0000 
   H  28    4.5792     3.7417     0.8768     0.0000 
   H  29    4.4260     3.5526     1.2399     0.8768     0.0000 



ATOMIC CHARGES
  Si   1    0.0000000000
   O   2    0.0000000000
   O   3    0.0000000000
   O   4    0.0000000000
   O   5    0.0000000000
   O   6    0.0000000000
   O   7    0.0000000000
   O   8    0.0000000000
   O   9    0.0000000000
   C  10    0.0000000000
   C  11    0.0000000000
   C  12    0.0000000000
   C  13    0.0000000000
   C  14    0.0000000000
   C  15    0.0000000000
   C  16    0.0000000000
   C  17    0.0000000000
   H  18    0.0000000000
   H  19    0.0000000000
   H  20    0.0000000000
   H  21    0.0000000000
   H  22    0.0000000000
   H  23    0.0000000000
   H  24    0.0000000000
   H  25    0.0000000000
   H  26    0.0000000000
   H  27    0.0000000000
   H  28    0.0000000000
   H  29    0.0000000000


BOND ANGLES
   2    1    3   O3   Si   O3    179.974
   2    1    4   O3   Si   O3     90.000
   2    1    5   O3   Si   O3     90.000
   3    1    4   O3   Si   O3     89.997
   3    1    5   O3   Si   O3     90.003
   4    1    5   O3   Si   O3    179.974
   1    2   13   Si   O3   C2    119.999
   1    3   12   Si   O3   C2    120.001
   1    4   11   Si   O3   C2    119.999
   1    5   10   Si   O3   C2    119.999
   5   10    9   O3   C2   O2    120.001
   5   10   15   O3   C2   C3    120.001
   9   10   15   O2   C2   C3    119.998
   4   11    8   O3   C2   O2    120.001
   4   11   16   O3   C2   C3    120.001
   8   11   16   O2   C2   C3    119.998
   3   12    7   O3   C2   O2    120.001
   3   12   17   O3   C2   C3    119.999
   7   12   17   O2   C2   C3    120.001
   2   13    6   O3   C2   O2    120.001
   2   13   14   O3   C2   C3    120.001
   6   13   14   O2   C2   C3    119.998
  13   14   27   C2   C3   HC     90.004
  13   14   28   C2   C3   HC    179.974
  13   14   29   C2   C3   HC     89.996
  27   14   28   HC   C3   HC     90.000
  27   14   29   HC   C3   HC    179.974
  28   14   29   HC   C3   HC     90.000
  10   15   24   C2   C3   HC     89.999
  10   15   25   C2   C3   HC    179.974
  10   15   26   C2   C3   HC     89.996
  24   15   25   HC   C3   HC     90.005
  24   15   26   HC   C3   HC    179.974
  25   15   26   HC   C3   HC     90.000
  11   16   21   C2   C3   HC     90.004
  11   16   22   C2   C3   HC    179.974
  11   16   23   C2   C3   HC     90.001
  21   16   22   HC   C3   HC     90.000
  21   16   23   HC   C3   HC    179.974
  22   16   23   HC   C3   HC     89.995
  12   17   18   C2   C3   HC     90.001
  12   17   19   C2   C3   HC    179.974
  12   17   20   C2   C3   HC     89.999
  18   17   19   HC   C3   HC     90.000
  18   17   20   HC   C3   HC    179.974
  19   17   20   HC   C3   HC     90.000


TORSION ANGLES
   3    1    2   13    179.974
   4    1    2   13    179.974
   5    1    2   13      0.026
   2    1    3   12      0.026
   4    1    3   12      0.026
   5    1    3   12    179.974
   2    1    4   11      0.026
   3    1    4   11    179.974
   5    1    4   11    180.000
   2    1    5   10    179.974
   3    1    5   10      0.026
   4    1    5   10    180.000
   1    2   13    6      0.026
   1    2   13   14    179.974
   1    3   12    7      0.026
   1    3   12   17    179.974
   1    4   11    8      0.026
   1    4   11   16    179.974
   1    5   10    9      0.026
   1    5   10   15    179.974
   5   10   15   24    179.974
   5   10   15   25      0.026
   5   10   15   26      0.026
   9   10   15   24      0.026
   9   10   15   25    179.974
   9   10   15   26    179.974
   4   11   16   21    179.974
   4   11   16   22      0.026
   4   11   16   23      0.026
   8   11   16   21      0.026
   8   11   16   22    179.974
   8   11   16   23    179.974
   3   12   17   18    179.974
   3   12   17   19      0.026
   3   12   17   20      0.026
   7   12   17   18      0.026
   7   12   17   19    179.974
   7   12   17   20    179.974
   2   13   14   27    179.974
   2   13   14   28      0.026
   2   13   14   29      0.026
   6   13   14   27      0.026
   6   13   14   28    179.974
   6   13   14   29    179.974