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(1R)-(-)-(10-Camphorsulfonyl)oxaziridine
(1R)-(-)-(10-Camphorsulfonyl)oxaziridine ID: API-28774
CAS:104372-31-8
Supplier:APIchem

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SMILES:CC1(C)C2CCC1(CS(=O)(=O)N1CO1)C(=O)C2	ChemMol.com
FORMULA: C11H17NO4S
MASS: 259.3220
EXACT MASS: 259.0878290
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8250     0.0000 
   C   3    1.3948     0.8249     0.0000 
   C   4    1.3999     0.8309     1.4955     0.0000 
   C   5    2.0959     1.3537     1.6719     0.7827     0.0000 
   C   6    2.8493     2.1035     2.3169     1.4983     0.7548     0.0000 
   C   7    2.1554     1.5374     2.0330     0.7563     0.4912     0.8682 
   C   8    2.9449     2.3619     2.8260     1.5626     1.1691     0.8880 
   S   9    3.5707     2.8817     3.1606     2.1737     1.5375     0.8483 
   O  10    3.1553     2.3805     2.4897     1.8400     1.0684     0.3758 
   O  11    4.1115     3.5074     3.8912     2.7249     2.2242     1.6306 
   N  12    4.2648     3.5200     3.6543     2.8929     2.1730     1.4183 
   C  13    5.0898     4.3426     4.4467     3.7156     2.9976     2.2429 
   O  14    4.7362     3.9421     3.9117     3.4330     2.6613     1.9420 
   C  15    2.3972     2.0173     2.6814     1.2000     1.3082     1.5061 
   O  16    3.1886     2.8423     3.4920     2.0226     2.0006     1.9297 
   C  17    1.7958     1.5979     2.3703     0.9216     1.4359     1.9132 

              C   7      C   8      S   9      O  10      O  11      N  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    0.8250     0.0000 
   S   9    1.4290     0.8250     0.0000 
   O  10    1.2424     1.1667     0.8250     0.0000 
   O  11    1.9752     1.1667     0.8250     1.6500     0.0000 
   N  12    2.1827     1.6500     0.8249     1.1667     1.1667     0.0000 
   C  13    2.9970     2.4002     1.5937     1.9752     1.5938     0.8251 
   O  14    2.7933     2.4001     1.5937     1.5937     1.9752     0.8250 
   C  15    0.8190     0.8615     1.6863     1.8643     1.8900     2.5111 
   O  16    1.5233     1.0510     1.7165     2.2170     1.5293     2.4798 
   C  17    1.0568     1.4903     2.2933     2.2890     2.5766     3.1077 

              C  13      O  14      C  15      O  16      C  17
              -------------------------------------------------------
   C  13    0.0000 
   O  14    0.8250     0.0000 
   C  15    3.2556     3.2481     0.0000 
   O  16    3.0902     3.2920     0.8250     0.0000 
   C  17    3.8843     3.7931     0.6915     1.4061     0.0000 



ATOMIC CHARGES
   C   1    0.0004744941
   C   2    0.0082293071
   C   3    0.0004744941
   C   4    0.0077804499
   C   5    0.0009178630
   C   6    0.0087099609
   C   7    0.0751263013
   C   8    0.1782550830
   S   9    0.0676775892
   O  10   -0.1553351321
   O  11   -0.1553351321
   N  12   -0.0121916952
   C  13    0.2930466135
   O  14   -0.2378998147
   C  15    0.1515608666
   O  16   -0.2960276434
   C  17    0.0645363946


BOND ANGLES
   1    2    3   C3   C3   C3    115.427
   1    2    4   C3   C3   C3    115.431
   1    2    7   C3   C3   C3    129.146
   3    2    4   C3   C3   C3    129.142
   3    2    7   C3   C3   C3    115.427
   4    2    7   C3   C3   C3     13.715
   2    4    5   C3   C3   C3    114.010
   2    4   17   C3   C3   C3    131.426
   5    4   17   C3   C3   C3    114.565
   4    5    6   C3   C3   C3    154.057
   5    6    7   C3   C3   C3     34.339
   2    7    6   C3   C3   C3    119.329
   6    7    8   C3   C3   C3     63.201
   6    7   15   C3   C3   C2    126.403
   2    7    8   C3   C3   C3    177.470
   2    7   15   C3   C3   C2    114.268
   8    7   15   C3   C3   C2     63.202
   7    8    9   C3   C3  So2    120.001
   8    9   10   C3  So2   O2     89.994
   8    9   11   C3  So2   O2     89.997
   8    9   12   C3  So2  Nox    179.974
  10    9   11   O2  So2   O2    179.974
  10    9   12   O2  So2  Nox     90.003
  11    9   12   O2  So2  Nox     90.006
   9   12   13  So2  Nox   C3    150.001
   9   12   14  So2  Nox   O3    150.001
  13   12   14   C3  Nox   O3     59.997
  12   13   14  Nox   C3   O3     59.998
  12   14   13  Nox   O3   C3     60.005
   7   15   16   C3   C2   O2    135.808
   7   15   17   C3   C2   C3     88.380
  16   15   17   O2   C2   C3    135.812
   4   17   15   C3   C3   C2     95.063


TORSION ANGLES
   1    2    4    5    179.974
   1    2    4   17      0.026
   3    2    4    5      0.026
   3    2    4   17    179.974
   7    2    4    5      0.026
   7    2    4   17    179.974
   2    4    5    6    179.974
  17    4    5    6      0.026
   4    5    6    7      0.026
   5    6    7    2      0.026
   5    6    7    8    179.974
   5    6    7   15    179.974
   1    2    7    6    179.974
   1    2    7    8      0.026
   1    2    7   15      0.026
   3    2    7    6      0.026
   3    2    7    8    179.974
   3    2    7   15    179.974
   4    2    7    6    179.974
   4    2    7    8      0.026
   4    2    7   15      0.026
   6    7    8    9      0.026
   2    7    8    9    179.974
  15    7    8    9    179.974
   7    8    9   10      0.026
   7    8    9   11    179.974
   7    8    9   12      0.026
   8    9   12   13    179.974
   8    9   12   14      0.026
  10    9   12   13    179.974
  10    9   12   14      0.026
  11    9   12   13      0.026
  11    9   12   14    179.974
   9   12   13   14    179.974
  14   12   13   14      0.026
  12   13   14   12      0.026
   9   12   14   13    179.974
  13   12   14   13      0.026
   6    7   15   16      0.026
   6    7   15   17    179.974
   2    7   15   16    179.974
   2    7   15   17      0.026
   8    7   15   16      0.026
   8    7   15   17    179.974
   7   15   17    4      0.026
  16   15   17    4    179.974
   2    4   17   15    179.974
   5    4   17   15      0.026


CHIRAL ATOMS
   5    4   17   15      0.026
   5    4   17   15      0.026