Sign In Join Free

Products Information

2-HYDROXY-3-METHOXYPYRIDINE
2-HYDROXY-3-METHOXYPYRIDINE
ID: BP-12019
CAS:20928-63-6
Supplier:BroadPharm

Get a quote


SMILES:c1(=O)c(ccc[nH]1)OC	
FORMULA: C6H7NO2
MASS: 125.1253
EXACT MASS: 125.0476785
INTERATOMIC DISTANCES

              C   1      C   2      N   3      C   4      C   5      O   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    1.4160     0.0000 
   N   3    1.4408     2.4734     0.0000 
   C   4    2.4713     1.4337     2.8580     0.0000 
   C   5    2.4786     2.8603     1.4191     2.4825     0.0000 
   O   6    1.4429     2.4786     2.4953     3.7925     3.7934     0.0000 
   C   7    2.8646     2.4833     2.4771     1.4335     1.4398     4.3075 
   O   8    2.4683     1.4376     3.7879     2.4864     4.2980     2.8555 
   C   9    3.7757     2.4840     4.9574     2.8662     5.1647     4.2892 

              C   7      O   8      C   9
              ---------------------------------
   C   7    0.0000 
   O   8    3.7967     0.0000 
   C   9    4.2998     1.4336     0.0000 



ATOMIC CHARGES
   C   1    0.3132889123
   C   2    0.1962272663
   N   3   -0.2037415157
   C   4    0.0435041428
   C   5    0.1024025718
   O   6   -0.2618442683
   C   7    0.0240153419
   O   8   -0.4665574626
   C   9    0.2527050116


BOND ANGLES
   2    1    3  Car  Car  Nar    119.949
   2    1    6  Car  Car   O2    120.212
   3    1    6  Nar  Car   O2    119.839
   1    2    4  Car  Car  Car    120.272
   1    2    8  Car  Car   O3    119.754
   4    2    8  Car  Car   O3    119.974
   1    3    5  Car  Nar  Car    120.145
   2    4    7  Car  Car  Car    120.010
   3    5    7  Nar  Car  Car    120.093
   4    7    5  Car  Car  Car    119.532
   2    8    9  Car   O3   C3    119.790


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