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(R)-(-)-Glycidyl phthalimide
(R)-(-)-Glycidyl phthalimide
ID: BP-12186
CAS:181140-34-1
Supplier:BroadPharm

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SMILES:c1cc2c(cc1)C(=O)N(C2=O)CC1OC1	
FORMULA: C11H9NO3
MASS: 203.1941
EXACT MASS: 203.0582432
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.9054     0.0000 
   C   3    1.5608     1.8041     0.0000 
   C   4    0.9000     1.5643     0.9034     0.0000 
   C   5    1.5623     0.9017     1.5586     1.8030     0.0000 
   C   6    1.8035     1.5614     0.9021     1.5640     0.8981     0.0000 
   C   7    2.6886     2.3076     1.6448     2.4342     1.4532     0.8981 
   N   8    2.9788     2.3419     2.3431     2.9799     1.4532     1.4532 
   C   9    2.4320     1.6420     2.3064     2.6883     0.8981     1.4531 
   O  10    2.9207     2.0258     3.1322     3.3736     1.6003     2.3238 
   O  11    3.3749     3.1344     2.0310     2.9241     2.3240     1.6005 
   C  12    3.8655     3.1859     3.1879     3.8668     2.3206     2.3207 
   C  13    4.5961     3.9897     3.6961     4.4724     3.0986     2.9103 
   O  14    5.0813     4.5862     3.9592     4.8115     3.6847     3.3017 
   C  15    5.4857     4.8733     4.5454     5.3438     3.9855     3.7863 

              C   7      N   8      C   9      O  10      O  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   N   8    0.8981     0.0000 
   C   9    1.4531     0.8981     0.0000 
   O  10    2.3238     1.6003     0.8980     0.0000 
   O  11    0.8981     1.6004     2.3239     3.1613     0.0000 
   C  12    1.5975     0.8947     1.5973     1.9516     1.9521     0.0000 
   C  13    2.0528     1.6478     2.4586     2.8338     2.0117     0.8897 
   O  14    2.4036     2.2993     3.1792     3.6654     2.0036     1.7189 
   C  15    2.9127     2.5328     3.3149     3.5908     2.7284     1.7189 

              C  13      O  14      C  15
              ---------------------------------
   C  13    0.0000 
   O  14    0.8898     0.0000 
   C  15    0.8898     0.8898     0.0000 



ATOMIC CHARGES
   C   1    0.0001499880
   C   2    0.0046728666
   C   3    0.0046728666
   C   4    0.0001499880
   C   5    0.0583553153
   C   6    0.0583553153
   C   7    0.2551667259
   N   8   -0.2202875963
   C   9    0.2551667259
   O  10   -0.2694883928
   O  11   -0.2694883928
   C  12    0.1335124530
   C  13    0.1649701657
   O  14   -0.3492667770
   C  15    0.1733587486


BOND ANGLES
   2    1    4  Car  Car  Car    120.102
   1    2    5  Car  Car  Car    119.659
   4    3    6  Car  Car  Car    120.059
   1    4    3  Car  Car  Car    119.877
   6    5    9  Car  Car   C2    107.998
   2    5    9  Car  Car   C2    131.655
   2    5    6  Car  Car  Car    120.348
   5    6    7  Car  Car   C2    107.999
   3    6    7  Car  Car   C2    132.046
   3    6    5  Car  Car  Car    119.955
   6    7    8  Car   C2  Nam    108.000
   6    7   11  Car   C2   O2    126.002
   8    7   11  Nam   C2   O2    125.998
   7    8    9   C2  Nam   C2    107.997
   7    8   12   C2  Nam   C3    126.018
   9    8   12   C2  Nam   C3    125.985
   5    9    8  Car   C2  Nam    108.007
   8    9   10  Nam   C2   O2    126.001
   5    9   10  Car   C2   O2    125.992
   8   12   13  Nam   C3   C3    134.872
  12   13   14   C3   C3   O3    150.000
  12   13   15   C3   C3   C3    150.000
  14   13   15   O3   C3   C3     60.000
  13   14   15   C3   O3   C3     60.000
  13   15   14   C3   C3   O3     60.000


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


CHIRAL ATOMS
   4    3    6    5      0.026