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2-(Fmoc-amino)ethanol
2-(Fmoc-amino)ethanol ID: API-28862
CAS:105496-31-9
Supplier:APIchem

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SMILES:OCCNC(=O)OCC1c2ccccc2c2ccccc12	ChemMol.com
FORMULA: C17H17NO3
MASS: 283.3218
EXACT MASS: 283.1208434
INTERATOMIC DISTANCES

              O   1      C   2      C   3      N   4      C   5      O   6
              ------------------------------------------------------------------
   O   1    0.0000 
   C   2    0.8250     0.0000 
   C   3    1.4289     0.8249     0.0000 
   N   4    2.1827     1.4289     0.8250     0.0000 
   C   5    2.8579     2.1827     1.4290     0.8250     0.0000 
   O   6    2.9746     2.4750     1.6501     1.4290     0.8250     0.0000 
   O   7    3.5960     2.8578     2.1827     1.4289     0.8249     1.4289 
   C   8    4.2868     3.5960     2.8579     2.1827     1.4289     1.6500 
   C   9    5.0183     4.2868     3.5961     2.8579     2.1827     2.4750 
   C  10    5.7555     5.0517     4.3268     3.6271     2.8981     3.0343 
   C  11    6.0514     5.4126     4.6353     4.0255     3.2305     3.1542 
   C  12    6.8734     6.2376     5.4593     4.8487     4.0554     3.9594 
   C  13    7.3737     6.6889     5.9460     5.2694     4.5188     4.5455 
   C  14    7.1329     6.4004     5.7087     4.9717     4.2876     4.4631 
   C  15    6.3446     5.5994     4.9267     4.1728     3.5174     3.7672 
   C  16    6.0595     5.2741     4.6813     3.8801     3.3457     3.7672 
   C  17    6.5274     5.7179     5.2034     4.3823     3.9530     4.4630 
   C  18    6.2596     5.4363     5.0228     4.2001     3.9188     4.5455 
   C  19    5.4652     4.6404     4.2685     3.4536     3.2642     3.9593 
   C  20    4.8968     4.0811     3.6137     2.7888     2.4945     3.1542 
   C  21    5.2348     4.4493     3.8608     3.0563     2.5478     3.0342 

              O   7      C   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   O   7    0.0000 
   C   8    0.8250     0.0000 
   C   9    1.4290     0.8250     0.0000 
   C  10    2.2083     1.4702     0.8250     0.0000 
   C  11    2.6827     1.8628     1.5074     0.8251     0.0000 
   C  12    3.4923     2.6785     2.2282     1.4290     0.8250     0.0000 
   C  13    3.8568     3.0936     2.4629     1.6500     1.4289     0.8250 
   C  14    3.5433     2.8744     2.1154     1.4289     1.6500     1.4289 
   C  15    2.7487     2.1348     1.3349     0.8249     1.4289     1.6500 
   C  16    2.5252     2.1348     1.3349     1.3348     2.1154     2.4629 
   C  17    3.1301     2.8743     2.1153     2.1486     2.9002     3.1401 
   C  18    3.1324     3.0935     2.4629     2.7298     3.5341     3.8781 
   C  19    2.5306     2.6785     2.2282     2.7298     3.5542     4.0529 
   C  20    1.7271     1.8628     1.5074     2.1487     2.9489     3.5542 
   C  21    1.7231     1.4702     0.8250     1.3349     2.1488     2.7299 

              C  13      C  14      C  15      C  16      C  17      C  18
              ------------------------------------------------------------------
   C  13    0.0000 
   C  14    0.8250     0.0000 
   C  15    1.4289     0.8250     0.0000 
   C  16    2.2282     1.5074     0.8250     0.0000 
   C  17    2.7414     1.9291     1.5074     0.8250     0.0000 
   C  18    3.5430     2.7414     2.2282     1.4289     0.8250     0.0000 
   C  19    3.8782     3.1401     2.4630     1.6500     1.4289     0.8250 
   C  20    3.5341     2.9002     2.1154     1.4289     1.6499     1.4289 
   C  21    2.7299     2.1488     1.3349     0.8250     1.4289     1.6500 

              C  19      C  20      C  21
              ---------------------------------
   C  19    0.0000 
   C  20    0.8250     0.0000 
   C  21    1.4289     0.8250     0.0000 



ATOMIC CHARGES
   O   1   -0.2184354322
   C   2    0.2055362536
   C   3    0.1541043630
   N   4   -0.1659223263
   C   5    0.4212190855
   O   6   -0.2245625174
   O   7   -0.4328244140
   C   8    0.2187326987
   C   9    0.0883906204
   C  10   -0.0148013613
   C  11   -0.0038379889
   C  12   -0.0003110332
   C  13   -0.0000197602
   C  14   -0.0003110332
   C  15   -0.0038379889
   C  16   -0.0038379889
   C  17   -0.0003110332
   C  18   -0.0000197602
   C  19   -0.0003110332
   C  20   -0.0038379889
   C  21   -0.0148013613


BOND ANGLES
   1    2    3   O3   C3   C3    119.999
   2    3    4   C3   C3  Nam    119.999
   3    4    5   C3  Nam   C2    120.002
   4    5    6  Nam   C2   O2    119.999
   4    5    7  Nam   C2   O3    119.999
   6    5    7   O2   C2   O3    120.002
   5    7    8   C2   O3   C3    119.999
   7    8    9   O3   C3   C3    120.002
   8    9   10   C3   C3  Car    126.005
   8    9   21   C3   C3  Car    125.996
  10    9   21  Car   C3  Car    107.998
   9   10   11   C3  Car  Car    131.991
   9   10   15   C3  Car  Car    108.007
  11   10   15  Car  Car  Car    120.002
  10   11   12  Car  Car  Car    119.993
  11   12   13  Car  Car  Car    120.000
  12   13   14  Car  Car  Car    120.004
  13   14   15  Car  Car  Car    119.996
  10   15   14  Car  Car  Car    120.005
  14   15   16  Car  Car  Car    131.997
  10   15   16  Car  Car  Car    107.998
  15   16   17  Car  Car  Car    132.003
  15   16   21  Car  Car  Car    108.001
  17   16   21  Car  Car  Car    119.996
  16   17   18  Car  Car  Car    120.004
  17   18   19  Car  Car  Car    120.000
  18   19   20  Car  Car  Car    119.996
  19   20   21  Car  Car  Car    120.004
   9   21   20   C3  Car  Car    132.005
  16   21   20  Car  Car  Car    120.000
   9   21   16   C3  Car  Car    107.995


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