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(Trimethylsilyl)acetic acid
(Trimethylsilyl)acetic acid ID: API-45561
CAS:2345-38-2
Supplier:APIchem

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SMILES:[Si](CC(=O)O)(C)(C)C	ChemMol.com
FORMULA: C5H12O2Si
MASS: 132.2331
EXACT MASS: 132.0606562
INTERATOMIC DISTANCES

             Si   1      O   2      O   3      C   4      C   5      C   6
              ------------------------------------------------------------------
  Si   1    0.0000 
   O   2    2.6458     0.0000 
   O   3    2.0000     1.7320     0.0000 
   C   4    1.0000     1.7321     1.7321     0.0000 
   C   5    1.0000     3.6055     2.6458     2.0000     0.0000 
   C   6    1.0000     3.1196     2.9093     1.4142     1.4142     0.0000 
   C   7    1.0000     2.5036     1.2394     1.4142     1.4142     2.0000 
   C   8    1.7321     1.0000     1.0000     1.0001     2.6458     2.3942 
   H   9    1.5968     1.4155     2.0295     0.6200     2.5913     1.7680 
   H  10    1.0812     2.1829     2.3451     0.6199     1.9884     0.9736 
   H  11    1.1766     3.8024     3.0874     2.0939     0.6200     1.0698 
   H  12    1.6199     4.2100     3.1408     2.6199     0.6200     1.9037 
   H  13    1.1766     3.5086     2.2884     2.0938     0.6200     1.9037 
   H  14    1.1766     2.6488     2.7583     1.0697     1.9038     0.6201 
   H  15    1.6200     3.5257     3.4981     1.9038     1.9038     0.6201 
   H  16    1.1766     3.6354     3.1762     1.9037     1.0697     0.6200 
   H  17    1.1766     3.1229     1.7777     1.9037     1.0698     2.0939 
   H  18    1.6200     2.6113     1.0063     1.9038     1.9038     2.6200 
   H  19    1.1766     1.8847     0.8248     1.0698     1.9038     2.0939 
   H  20    3.1408     0.6200     1.8396     2.2901     4.0601     3.6973 

              C   7      C   8      H   9      H  10      H  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    1.5060     0.0000 
   H   9    1.9934     1.0812     0.0000 
   H  10    1.8412     1.5968     0.7971     0.0000 
   H  11    1.9037     2.9083     2.6146     1.8923     0.0000 
   H  12    1.9037     3.2380     3.2096     2.5854     0.8768     0.0000 
   H  13    1.0697     2.5121     2.7133     2.2572     1.2399     0.8768 
   H  14    2.0938     2.0631     1.2440     0.4752     1.6640     2.4531 
   H  15    2.6200     2.9036     2.1183     1.3473     1.4143     2.2910 
   H  16    2.0938     2.8243     2.3393     1.5616     0.5374     1.4142 
   H  17    0.6200     2.1242     2.5140     2.2093     1.6639     1.4142 
   H  18    0.6201     1.6789     2.4210     2.4024     2.4531     2.2910 
   H  19    0.6201     0.8901     1.5477     1.6334     2.2910     2.4531 
   H  20    2.8387     1.4157     2.0284     2.7806     4.3137     4.6468 

              H  13      H  14      H  15      H  16      H  17      H  18
              ------------------------------------------------------------------
   H  13    0.0000 
   H  14    2.2910     0.0000 
   H  15    2.4531     0.8769     0.0000 
   H  16    1.6639     1.2400     0.8769     0.0000 
   H  17    0.5374     2.3532     2.6924     2.0000     0.0000 
   H  18    1.4142     2.6924     3.2401     2.6923     0.8768     0.0000 
   H  19    1.6640     2.0000     2.6924     2.3532     1.2400     0.8769 
   H  20    3.8896     3.2511     4.1273     4.1879     3.4535     2.8184 

              H  19      H  20
              ----------------------
   H  19    0.0000 
   H  20    2.2267     0.0000 



ATOMIC CHARGES
  Si   1    0.0000000000
   O   2    0.0000000000
   O   3    0.0000000000
   C   4    0.0000000000
   C   5    0.0000000000
   C   6    0.0000000000
   C   7    0.0000000000
   C   8    0.0000000000
   H   9    0.0000000000
   H  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


BOND ANGLES
   4    1    5   C3   Si   C3    179.974
   4    1    6   C3   Si   C3     90.000
   4    1    7   C3   Si   C3     90.000
   5    1    6   C3   Si   C3     90.000
   5    1    7   C3   Si   C3     90.000
   6    1    7   C3   Si   C3    179.974
   8    2   20   C2   O3   HO    119.998
   1    4    8   Si   C3   C2    120.001
   1    4    9   Si   C3   HC    160.009
   1    4   10   Si   C3   HC     80.000
   8    4    9   C2   C3   HC     79.990
   8    4   10   C2   C3   HC    159.999
   9    4   10   HC   C3   HC     80.009
   1    5   11   Si   C3   HC     90.001
   1    5   12   Si   C3   HC    179.974
   1    5   13   Si   C3   HC     89.999
  11    5   12   HC   C3   HC     90.000
  11    5   13   HC   C3   HC    179.974
  12    5   13   HC   C3   HC     90.000
   1    6   14   Si   C3   HC     89.996
   1    6   15   Si   C3   HC    179.974
   1    6   16   Si   C3   HC     89.999
  14    6   15   HC   C3   HC     90.000
  14    6   16   HC   C3   HC    179.974
  15    6   16   HC   C3   HC     90.005
   1    7   17   Si   C3   HC     90.001
   1    7   18   Si   C3   HC    179.974
   1    7   19   Si   C3   HC     90.004
  17    7   18   HC   C3   HC     89.995
  17    7   19   HC   C3   HC    179.974
  18    7   19   HC   C3   HC     90.000
   2    8    3   O3   C2   O2    120.001
   2    8    4   O3   C2   C3    120.001
   3    8    4   O2   C2   C3    119.998


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