Sign In Join Free

Products Information

2-(AMINOMETHYL)PYRIDINE
2-(AMINOMETHYL)PYRIDINE
ID: BP-12086
CAS:3731-51-9
Supplier:BroadPharm

Get a quote


SMILES:n1c(CN)cccc1	
FORMULA: C6H8N2
MASS: 108.1411
EXACT MASS: 108.0687483
INTERATOMIC DISTANCES

              N   1      C   2      N   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    1.4339     0.0000 
   N   3    3.7971     2.4980     0.0000 
   C   4    1.4372     2.4722     4.9701     0.0000 
   C   5    2.4841     1.4494     1.4327     3.7938     0.0000 
   C   6    2.4785     1.4104     2.8698     2.8597     2.4741     0.0000 
   C   7    2.4802     2.8531     5.1804     1.4166     4.3024     2.4921 
   C   8    2.8664     2.4620     4.3061     2.4744     3.7890     1.4363 

              C   7      C   8
              ----------------------
   C   7    0.0000 
   C   8    1.4449     0.0000 



ATOMIC CHARGES
   N   1   -0.2466583526
   C   2    0.0782233191
   N   3   -0.1245115641
   C   4    0.0985000121
   C   5    0.1546940783
   C   6    0.0162438330
   C   7    0.0206583336
   C   8    0.0028503405


BOND ANGLES
   2    1    4  Car  Nar  Car    118.867
   1    2    5  Nar  Car   C3    118.978
   1    2    6  Nar  Car  Car    121.237
   5    2    6   C3  Car  Car    119.785
   1    4    7  Nar  Car  Car    120.706
   2    5    3  Car   C3   N3    120.159
   2    6    8  Car  Car  Car    119.734
   4    7    8  Car  Car  Car    119.700
   6    8    7  Car  Car  Car    119.758


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