Accuracy

Lu_(POHDIZ) r   7174 Lutetium complex, CCDC: POHDIZ (Geo)

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    #  Species Formula
  7164 Lutetium complex, CCDC: BAGBUH (Geo)C20H18N5O8Lu
  7165 Lu(III)O8(3+) (QAKXAB) (Geo)C32H64N8O8Lu
  7166 Lu(III)(H2O)9(3+) (BUVVUJ) (Geo)H18O9Lu
  7167 Lu(III)(H2O)9(3+) (BUVVUJ)H18O9Lu
  7168 Lutetium complex, CCDC: BUVVUJ (Geo)H18O9Lu
  7169 Lutetium complex, CCDC: PUDTIR (Geo)C28H36N5O9Lu
  7170 Lutetium complex, CCDC: EFIZEY (Geo)C15H11N6O9Lu
  7171 Lutetium complex, CCDC: RADRIX (Geo)C20H16N7O9Lu
  7172 Lutetium complex, CCDC: RADROD (Geo)C24H16N7O9Lu
  7173 Lutetium complex, CCDC: EFIZOI (Geo)C17H17N6O10Lu
  7174 Lutetium complex, CCDC: POHDIZ (Geo) C2H7N4O11Lu
  7175 Lu(III)O8(-) (OGEYEE) (Geo)C8H12O12Lu
  7176 Lu(III)O8(-) (OGEYEE)C8H12O12Lu
  7177 Lutetium complex, CCDC: HELGUA (Geo)H6N3O12Lu
  7178 Lutetium complex, CCDC: XONZOP (Geo)C46H48NO4Si2Lu
  7179 Lutetium complex, CCDC: SUDDOK (Geo)C14H26O12S2Lu
  7180 Lutetium complex, CCDC: FEWKEX (Geo)C36H30N3O12S3Lu
  7181 Lu(III)N6(3-) (PUKRUI) (Geo)C6N6S6Lu
  7182 Lu(III)N6(3-) (PUKRUI)C6N6S6Lu
  7183 Lu(Cp)2N2Cl (BIVBIR)a (Geo)C18H28N2ClLu
  7184 Lu(Cp)2N2Cl (BIVBIR)aC18H28N2ClLu


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7 SPARKLES
Lutetium complex, CCDC: POHDIZ
 <Lu-O2> <Lu-O3> <> <Lu-O4> <> <> <Lu-O5> <> <> <Lu-O6> GR=CCDC
 Lu     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.28820012 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.29220011 +1  170.7512029 +1    0.0000000 +0     1     2     0
  O     2.36529963 +1   64.4339634 +1  127.6735982 +1     1     2     3
  O     2.36794439 +1  109.1062668 +1  -61.7200116 +1     1     2     3
  O     2.37804170 +1  122.4171349 +1 -135.5865403 +1     1     2     3
  O     2.16694578 +1   64.0600693 +1   97.1557600 +1     5     1     2
  O     2.16249442 +1   58.9791594 +1  174.6910001 +1     4     1     2
  O     2.16555049 +1   55.4613097 +1   13.7307921 +1     6     1     2
  N     2.26468988 +1   73.2471877 +1   55.7604848 +1     1     2     3
  N     1.26690636 +1   30.8220242 +1  -78.7673016 +1     7     5     1
  N     1.28958246 +1   31.6359886 +1  163.6873974 +1     9     6     1
  N     1.26394502 +1   64.8754098 +1  138.4824195 +1     4     1     2
  O     1.24624394 +1  120.2288036 +1  172.4912825 +1    11     7     5
  O     1.22344204 +1  122.5054042 +1 -105.5458930 +1    13     4     1
  O     1.20889726 +1  120.8556097 +1  179.9572516 +1    12     9     6
  C     1.17332016 +1   90.6233370 +1  170.7021851 +1    10     1     2
  C     1.44382971 +1  178.2453940 +1 -132.9821854 +1    17    10     1
  H     1.11496787 +1  111.1607033 +1   74.4372834 +1    18    17    10
  H     1.10953346 +1  111.7983064 +1  -46.2560646 +1    18    17    10
  H     1.11360865 +1  111.0945216 +1 -167.0981663 +1    18    17    10
  H     0.99461513 +1  114.2441289 +1 -178.8722782 +1     3     1     2
  H     0.99031045 +1  122.0347367 +1  -55.1325998 +1     3     1     2
  H     0.98268468 +1  129.9209468 +1  -98.8564966 +1     2     1     3
  H     0.98605983 +1  125.9438563 +1   95.4524192 +1     2     1     3