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benzyl(dimethyl)silicon
benzyl(dimethyl)silicon ID: AN-49577
CAS:1631-70-5
Supplier:AN PharmaTech Co Ltd

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SMILES:[Si](Cc1ccccc1)(C)C	6328719
FORMULA: C9H13Si
MASS: 149.2850
EXACT MASS: 149.0786519
TOTAL SPIN: 2
INTERATOMIC DISTANCES

             Si   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
  Si   1    0.0000 
   C   2    1.0000     0.0000 
   C   3    1.7320     1.0000     0.0000 
   C   4    1.0000     1.7320     2.6457     0.0000 
   C   5    1.0001     1.7321     2.0000     1.7321     0.0000 
   C   6    2.6457     1.7320     1.0000     3.4641     3.0000     0.0000 
   C   7    2.0000     1.7320     1.0000     3.0000     1.7321     1.7320 
   C   8    3.4641     2.6457     1.7320     4.3589     3.6056     1.0000 
   C   9    3.0000     2.6457     1.7320     4.0000     2.6458     2.0000 
   C  10    3.6055     3.0000     2.0000     4.5826     3.4641     1.7320 
   H  11    1.0812     0.6200     1.5967     1.4155     2.0295     2.1829 
   H  12    1.5968     0.6200     1.0812     2.1829     2.3452     1.4155 
   H  13    1.1766     2.1114     2.9083     0.6200     1.5201     3.8121 
   H  14    1.6200     2.2901     3.2380     0.6200     2.2901     4.0130 
   H  15    1.1766     1.5200     2.5121     0.6200     2.1115     3.1995 
   H  16    1.1766     1.5201     1.4956     2.1114     0.6200     2.4825 
   H  17    1.6200     2.2901     2.3716     2.2901     0.6200     3.3533 
   H  18    1.1767     2.1115     2.5558     1.5201     0.6200     3.5505 
   H  19    2.8291     1.8396     1.4157     3.5191     3.3533     0.6200 
   H  20    1.7733     1.8397     1.4158     2.7431     1.2347     2.2901 
   H  21    4.0130     3.1407     2.2900     4.8707     4.2100     1.4158 
   H  22    3.3533     3.1408     2.2901     4.3433     2.8292     2.6200 
   H  23    4.2100     3.6200     2.6200     5.1927     4.0131     2.2901 

              C   7      C   8      C   9      C  10      H  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    2.0000     0.0000 
   C   9    1.0000     1.7320     0.0000 
   C  10    1.7320     1.0000     1.0000     0.0000 
   H  11    2.3451     3.1512     3.2657     3.5889     0.0000 
   H  12    2.0295     2.4059     2.8113     2.9561     0.7971     0.0000 
   H  13    3.0634     4.6402     4.0478     4.7390     1.9300     2.6421 
   H  14    3.6200     4.9340     4.6200     5.1927     1.8777     2.6726 
   H  15    3.0634     4.1517     4.0478     4.5067     1.0254     1.8217 
   H  16    1.1121     3.0148     2.0403     2.8442     1.9808     2.0775 
   H  17    1.8397     3.8242     2.6009     3.5192     2.6367     2.8867 
   H  18    2.3521     4.2047     3.2567     4.0841     2.2546     2.7299 
   H  19    2.2900     1.4158     2.6199     2.2900     2.1355     1.3413 
   H  20    0.6201     2.6200     1.4158     2.2901     2.3980     2.2860 
   H  21    2.6199     0.6200     2.2900     1.4157     3.5955     2.8161 
   H  22    1.4158     2.2901     0.6201     1.4158     3.7574     3.3700 
   H  23    2.2901     1.4158     1.4158     0.6200     4.2079     3.5650 

              H  13      H  14      H  15      H  16      H  17      H  18
              ------------------------------------------------------------------
   H  13    0.0000 
   H  14    0.8768     0.0000 
   H  15    1.2400     0.8768     0.0000 
   H  16    2.0379     2.7145     2.3521     0.0000 
   H  17    1.9721     2.8059     2.7145     0.8768     0.0000 
   H  18    1.1121     1.9722     2.0380     1.2399     0.8768     0.0000 
   H  19    3.9474     4.0130     3.1551     2.8995     3.7759     3.8536 
   H  20    2.6913     3.3533     2.9283     0.6534     1.2346     1.8414 
   H  21    5.1886     5.4270     4.6146     3.6260     4.4422     4.8031 
   H  22    4.3108     4.9592     4.4626     2.2732     2.6457     3.4074 
   H  23    5.3313     5.8050     5.1259     3.3953     4.0130     4.6314 

              H  19      H  20      H  21      H  22      H  23
              -------------------------------------------------------
   H  19    0.0000 
   H  20    2.8059     0.0000 
   H  21    1.6200     3.2400     0.0000 
   H  22    3.2400     1.6200     2.8059     0.0000 
   H  23    2.8059     2.8059     1.6199     1.6200     0.0000 



ATOMIC CHARGES
  Si   1    0.0000000000
   C   2    0.0000000000
   C   3    0.0000000000
   C   4    0.0000000000
   C   5    0.0000000000
   C   6    0.0000000000
   C   7    0.0000000000
   C   8    0.0000000000
   C   9    0.0000000000
   C  10    0.0000000000
   H  11    0.0000000000
   H  12    0.0000000000
   H  13    0.0000000000
   H  14    0.0000000000
   H  15    0.0000000000
   H  16    0.0000000000
   H  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


BOND ANGLES
   2    1    4   C3   Si   C3    120.001
   2    1    5   C3   Si   C3    120.001
   4    1    5   C3   Si   C3    119.998
   1    2    3   Si   C3  Car    120.001
   1    2   11   Si   C3   HC     79.995
   1    2   12   Si   C3   HC    160.002
   3    2   11  Car   C3   HC    160.004
   3    2   12  Car   C3   HC     79.997
  11    2   12   HC   C3   HC     80.007
   2    3    6   C3  Car  Car    120.001
   2    3    7   C3  Car  Car    120.001
   6    3    7  Car  Car  Car    119.999
   1    4   13   Si   C3   HC     90.000
   1    4   14   Si   C3   HC    179.974
   1    4   15   Si   C3   HC     90.000
  13    4   14   HC   C3   HC     90.000
  13    4   15   HC   C3   HC    179.974
  14    4   15   HC   C3   HC     90.000
   1    5   16   Si   C3   HC     89.996
   1    5   17   Si   C3   HC    179.974
   1    5   18   Si   C3   HC     90.004
  16    5   17   HC   C3   HC     90.000
  16    5   18   HC   C3   HC    179.974
  17    5   18   HC   C3   HC     90.000
   3    6    8  Car  Car  Car    120.001
   3    6   19  Car  Car   HC    119.998
   8    6   19  Car  Car   HC    120.002
   3    7    9  Car  Car  Car    120.001
   3    7   20  Car  Car   HC    120.002
   9    7   20  Car  Car   HC    119.997
   6    8   10  Car  Car  Car    120.001
   6    8   21  Car  Car   HC    120.002
  10    8   21  Car  Car   HC    119.998
   7    9   10  Car  Car  Car    120.001
   7    9   22  Car  Car   HC    119.997
  10    9   22  Car  Car   HC    120.002
   8   10    9  Car  Car  Car    119.999
   8   10   23  Car  Car   HC    120.001
   9   10   23  Car  Car   HC    120.001


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