Sign In Join Free

Products Information

2-Fluoro-6-hydroxybenzoic acid
2-Fluoro-6-hydroxybenzoic acid ID: API-33117
CAS:67531-86-6
Supplier:APIchem

Get a quote


SMILES:c1ccc(c(c1O)C(=O)O)F	ChemMol.com
FORMULA: C7H5FO3
MASS: 156.1112
EXACT MASS: 156.0222722
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    1.4000     0.0000 
   C   3    2.4249     1.4000     0.0000 
   C   4    2.8000     2.4249     1.4001     0.0000 
   C   5    2.4249     2.8000     2.4249     1.4000     0.0000 
   C   6    1.4000     2.4249     2.8000     2.4249     1.4001     0.0000 
   F   7    4.2000     3.7040     2.4249     1.4000     2.4249     3.7041 
   O   8    2.4249     3.7040     4.2000     3.7041     2.4249     1.4000 
   C   9    3.7040     4.2000     3.7041     2.4249     1.4000     2.4249 
   O  10    4.8498     5.0478     4.2001     2.8000     2.4249     3.7041 
   O  11    4.2000     5.0478     4.8498     3.7040     2.4249     2.8000 

              F   7      O   8      C   9      O  10      O  11
              -------------------------------------------------------
   F   7    0.0000 
   O   8    4.8498     0.0000 
   C   9    2.8000     2.8000     0.0000 
   O  10    2.4249     4.2001     1.4001     0.0000 
   O  11    4.2000     2.4249     1.4000     2.4249     0.0000 



ATOMIC CHARGES
   C   1    0.0423985074
   C   2    0.0055917661
   C   3    0.0300652946
   C   4    0.1496048514
   C   5    0.1458630329
   C   6    0.2042486128
   F   7   -0.2038442073
   O   8   -0.2862698494
   C   9    0.3930523220
   O  10   -0.2403551653
   O  11   -0.2403551653


BOND ANGLES
   2    1    6  Car  Car  Car    120.001
   1    2    3  Car  Car  Car    120.001
   2    3    4  Car  Car  Car    120.001
   3    4    5  Car  Car  Car    119.999
   3    4    7  Car  Car    F    120.001
   5    4    7  Car  Car    F    120.001
   4    5    6  Car  Car  Car    119.999
   4    5    9  Car  Car  Cac    120.001
   6    5    9  Car  Car  Cac    120.001
   1    6    5  Car  Car  Car    120.001
   5    6    8  Car  Car   O3    119.999
   1    6    8  Car  Car   O3    120.001
   5    9   10  Car  Cac O.co2    120.001
   5    9   11  Car  Cac O.co2    120.001
  10    9   11 O.co2  Cac O.co2    119.999


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