Accuracy

k(i)o5ni (dughoc) r   5888 K(I)O5NI (DUGHOC) (Geo)

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    #  Species Formula
  5878 Iodomethyl methyl sulfideC2H5SI
  5879 Iodine chloride (Geo)ClI
  5880 Iodine chlorideClI
  5881 Iodine monochlorideClI
  5882 1,2-ChloroiodoethaneC2H4ClI
  5883 1-Chloro-4-iodobutadieneC4H4ClI
  5884 Potassium iodide (Geo)KI
  5885 Potassium iodideKI
  5886 K(+)(H2O)5.I (Geo)H10O5KI
  5887 K(+)(H2O)5.IH10O5KI
  5888 K(I)O5NI (DUGHOC) (Geo) C13H27NO5KI
  5889 K(I)O5NI (DUGHOC)C13H27NO5KI
  5890 Calcium monoiodide (Geo)CaI
  5891 Calcium monoiodideCaI
  5892 Ca(++)(H2O)5.IH10O5CaI
  5893 Ca(++)(H2O)5.I (Geo)H10O5CaI
  5894 Scandium(I) iodideScI
  5895 Scandium(I) iodide (Geo)ScI
  5896 Scandium NH2 CH3 I (Geo)CH5NScI
  5897 Scandium(III) oxide iodideOScI
  5898 Scandium(III) oxide iodide (Geo)OScI


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7
K(I)O5NI (DUGHOC)
 <K-I> <K-O> <O-K-I> GR=CCDC
  I     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  K     3.47014200 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.70221700 +1  120.9709330 +1    0.0000000 +0     2     1     0
  O     3.41624741 +1    1.6834815 +1    2.5334299 +1     0     0     0
  O     2.25771445 +1    0.5818825 +1    4.7999182 +1     0     0     0
  O     2.49664426 +1   -1.3481659 +1    2.7020313 +1     0     0     0
  O     2.19189092 +1    3.0253762 +1   -2.9224705 +1     0     0     0
  N     4.58903043 +1    0.9266366 +1   -2.8107066 +1     0     0     0
  C     5.61052206 +1    1.8137849 +1   -2.1941593 +1     0     0     0
  C     4.93542033 +1    2.8780403 +1   -1.3173207 +1     0     0     0
  C     4.29150562 +1    3.2572136 +1    0.9170732 +1     0     0     0
  C     4.43987882 +1    2.6248397 +1    2.3028737 +1     0     0     0
  C     2.17031124 +1    2.1968910 +1    2.9740514 +1     0     0     0
  C     2.05629696 +1    1.9415085 +1    4.4796235 +1     0     0     0
  C     1.20672728 +1   -0.3015837 +1    4.4305470 +1     0     0     0
  C     1.91677145 +1   -1.5849735 +1    4.0153201 +1     0     0     0
  C     3.60391322 +1   -0.8140532 +1    2.5202440 +1     0     0     0
  C     5.23418917 +1   -0.2891874 +1   -3.3602984 +1     0     0     0
  C     3.81808299 +1    1.6278887 +1   -3.8745688 +1     0     0     0
  C     2.33043723 +1    1.7274927 +1   -3.4862243 +1     0     0     0
  C     1.01042531 +1    3.1809450 +1   -2.1558842 +1     0     0     0
  H     6.25570772 +1    2.3105205 +1   -2.9503675 +1     0     0     0
  H     6.29959704 +1    1.2038741 +1   -1.5644777 +1     0     0     0
  H     3.91002203 +1    3.1291035 +1   -1.6639988 +1     0     0     0
  H     5.54645476 +1    3.7959347 +1   -1.2729220 +1     0     0     0
  H     3.23299496 +1    3.4329234 +1    0.6460009 +1     0     0     0
  H     4.84758778 +1    4.2093497 +1    0.8522265 +1     0     0     0
  H     4.47310079 +1    3.3861503 +1    3.0991554 +1     0     0     0
  H     5.35726167 +1    2.0013517 +1    2.3673139 +1     0     0     0
  H     1.42974818 +1    1.5990420 +1    2.3987898 +1     0     0     0
  H     2.03284849 +1    3.2591818 +1    2.7228425 +1     0     0     0
  H     1.09102880 +1    2.2984317 +1    4.8801737 +1     0     0     0
  H     2.88682301 +1    2.4174061 +1    5.0377434 +1     0     0     0
  H     0.58193233 +1    0.0955333 +1    3.6072544 +1     0     0     0
  H     0.57759181 +1   -0.4473603 +1    5.3277772 +1     0     0     0
  H     1.21314630 +1   -2.4156851 +1    3.8346048 +1     0     0     0
  H     2.69602705 +1   -1.8872882 +1    4.7278934 +1     0     0     0
  H     4.28586927 +1   -0.5354851 +1    3.3072932 +1     0     0     0
  H     5.81850442 +1   -0.7991479 +1   -2.5786405 +1     0     0     0
  H     4.44415200 +1   -0.9862115 +1   -3.6927602 +1     0     0     0
  H     5.90700405 +1   -0.1017255 +1   -4.2104112 +1     0     0     0
  H     3.89982348 +1    1.1039142 +1   -4.8503027 +1     0     0     0
  H     4.20229027 +1    2.6569797 +1   -4.0580526 +1     0     0     0
  H     2.00796358 +1    0.9413426 +1   -2.7864122 +1     0     0     0
  H     1.68386448 +1    1.6867590 +1   -4.3828251 +1     0     0     0
  H     0.89921188 +1    4.2676910 +1   -2.0771268 +1     0     0     0
  H     0.13687515 +1    2.7409884 +1   -2.6484299 +1     0     0     0
  H     1.14804153 +1    2.7293070 +1   -1.1678007 +1     0     0     0