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2-Amino-6-methoxy-1,2,3,4-tetrahydro-naphthalen-1-ol 1HCl salt
2-Amino-6-methoxy-1,2,3,4-tetrahydro-naphthalen-1-ol 1HCl salt ID: B204029
CAS:88628-32-4
Supplier:BEYOND PHARMATECH CORPORATION LIMITED

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SMILES:c1c(cc2c(c1)C(C(CC2)N)O)OC	
FORMULA: C11H15NO2
MASS: 193.2423
EXACT MASS: 193.1102787
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.5315     0.0000 
   C   3    0.9206     0.5315     0.0000 
   C   4    1.0630     0.9206     0.5315     0.0000 
   C   5    0.9206     1.0630     0.9206     0.5315     0.0000 
   C   6    0.5315     0.9205     1.0630     0.9205     0.5315     0.0000 
   C   7    1.5945     1.4062     0.9206     0.5315     0.9206     1.4062 
   C   8    1.9164     1.8412     1.4062     0.9206     1.0630     1.5945 
   C   9    1.8412     1.9164     1.5945     1.0630     0.9206     1.4062 
   C  10    1.4062     1.5945     1.4062     0.9205     0.5315     0.9206 
   O  11    1.5945     1.9163     1.8412     1.4062     0.9205     1.0630 
   N  12    2.3168     2.4357     2.1260     1.5945     1.4062     1.8412 
   O  13    0.9172     0.5291     0.9197     1.4047     1.5921     1.4031 
   C  14    1.0595     0.5280     0.5291     1.0607     1.4031     1.4026 

              C   7      C   8      C   9      C  10      O  11      N  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    0.5315     0.0000 
   C   9    0.9206     0.5315     0.0000 
   C  10    1.0630     0.9205     0.5315     0.0000 
   O  11    1.5945     1.4062     0.9205     0.5315     0.0000 
   N  12    1.4062     0.9205     0.5315     0.9206     1.0630     0.0000 
   O  13    1.8403     2.3155     2.4337     2.1235     2.4328     2.9572 
   C  14    1.4049     1.9147     2.1237     1.9134     2.3135     2.6552 

              O  13      C  14
              ----------------------
   O  13    0.0000 
   C  14    0.5313     0.0000 



ATOMIC CHARGES
   C   1    0.0366357346
   C   2    0.1384016736
   C   3    0.0324046125
   C   4   -0.0206832381
   C   5    0.0053788582
   C   6    0.0010074757
   C   7    0.0277959860
   C   8    0.0266474658
   C   9    0.1266322457
   C  10    0.1913472799
   O  11   -0.2167437190
   N  12   -0.1298532431
   O  13   -0.4714375091
   C  14    0.2524663772


BOND ANGLES
   2    1    6  Car  Car  Car    119.995
   3    2   13  Car  Car   O3    120.262
   1    2    3  Car  Car  Car    120.004
   1    2   13  Car  Car   O3    119.734
   2    3    4  Car  Car  Car    119.991
   3    4    5  Car  Car  Car    120.004
   3    4    7  Car  Car   C3    119.991
   5    4    7  Car  Car   C3    120.004
   4    5    6  Car  Car  Car    119.995
   4    5   10  Car  Car   C3    119.995
   6    5   10  Car  Car   C3    120.010
   1    6    5  Car  Car  Car    120.010
   4    7    8  Car   C3   C3    119.991
   7    8    9   C3   C3   C3    120.004
   8    9   10   C3   C3   C3    119.995
   8    9   12   C3   C3   N3    119.995
  10    9   12   C3   C3   N3    120.010
   5   10    9  Car   C3   C3    120.010
   9   10   11   C3   C3   O3    119.995
   5   10   11  Car   C3   O3    119.995
   2   13   14  Car   O3   C3     59.731


TORSION ANGLES
  13    2    3    4    179.974
   1    2    3    4      0.026
   2    3    4    5      0.026
   2    3    4    7    179.974
   3    4    5    6      0.026
   3    4    5   10    179.974
   7    4    5    6    179.974
   7    4    5   10      0.026
   4    5    6    1      0.026
  10    5    6    1    179.974
   5    6    1    2      0.026
   3    4    7    8    179.974
   5    4    7    8      0.026
   4    7    8    9      0.026
   7    8    9   10      0.026
   7    8    9   12    179.974
   8    9   10    5      0.026
   8    9   10   11    179.974
  12    9   10    5    179.974
  12    9   10   11      0.026
   9   10    5    4      0.026
   9   10    5    6    179.974
  11   10    5    4    179.974
  11   10    5    6      0.026
   3    2   13   14      0.026
   1    2   13   14    179.974
   6    1    2    3      0.026
   6    1    2   13    179.974


CHIRAL ATOMS
   6    1    2   13    179.974
   6    1    2   13    179.974