Sign In Join Free

Products Information

CYCLOHEXANEMETHYLAMINE
CYCLOHEXANEMETHYLAMINE
ID: BP-10455
CAS:3218-02-8
Supplier:BroadPharm

Get a quote


SMILES:NCC1CCCCC1	
FORMULA: C7H15N
MASS: 113.2007
EXACT MASS: 113.1204495
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    2.4952     0.0000 
   C   3    1.4237     1.4467     0.0000 
   C   4    3.7934     1.4308     2.4866     0.0000 
   C   5    2.8676     1.4224     2.4741     2.4866     0.0000 
   C   6    4.2939     2.4588     3.7776     2.8640     1.4264     0.0000 
   C   7    4.9606     2.4655     3.7874     1.4273     2.8662     2.4825 
   C   8    5.1720     2.8499     4.2966     2.4771     2.4906     1.4477 

              C   7      C   8
              ----------------------
   C   7    0.0000 
   C   8    1.4257     0.0000 



ATOMIC CHARGES
   N   1   -0.1313879553
   C   2    0.0190632718
   C   3    0.1092597388
   C   4    0.0014848495
   C   5    0.0014848495
   C   6    0.0000470315
   C   7    0.0000470315
   C   8    0.0000011827


BOND ANGLES
   8    7    4   C3   C3   C3    120.513
   7    4    2   C3   C3   C3    119.228
   4    7    8   C3   C3   C3    120.513
   7    8    6   C3   C3   C3    119.524


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


CHIRAL ATOMS
   C     2 is chiral: counterclockwise