Accuracy

Pr_(DUCHAK) r   6570 Praseodymium complex, CCDC: DUCHAK (Geo)

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    #  Species Formula
  6560 Praseodymium complex, CCDC: PELGOC (Geo)C27H29N2O6Pr
  6561 Praseodymium complex, CCDC: VELRUZ (Geo)C16H38N2O7Pr
  6562 Praseodymium complex, CCDC: ZULRED (Geo)C34H34N5O7Pr
  6563 Praseodymium complex, CCDC: KAWBIT (Geo)C31H30N8O7Pr
  6564 Praseodymium complex, CCDC: CAZGUF (Geo)C15H25O8Pr
  6565 Praseodymium complex, CCDC: BUVWIY01 (Geo)H18O9Pr
  6566 Praseodymium complex, CCDC: BAFYOX (Geo)C20H20N5O9Pr
  6567 Praseodymium complex, CCDC: KAHGEF (Geo)C16H18N7O9Pr
  6568 Praseodymium complex, CCDC: ECABAL (Geo)C24H16N7O9Pr
  6569 Praseodymium complex, CCDC: FEDYAO (Geo)C18H33N6O10Pr
  6570 Praseodymium complex, CCDC: DUCHAK (Geo) C13H12N9O10Pr
  6571 Praseodymium complex, CCDC: BIFYUK (Geo)C10H18N2O11Pr
  6572 Praseodymium complex, CCDC: QIMRIN (Geo)C18H32N11O11Pr
  6573 Praseodymium complex, CCDC: QOZVEG (Geo)C12H24N2O12Pr
  6574 Praseodymium complex, CCDC: XOKYIF (Geo)C6H24O13Pr
  6575 Praseodymium complex, CCDC: FATWOM (Geo)C12H16N3O13Pr
  6576 Praseodymium complex, CCDC: JEXXUF (Geo)C12H24N5O13Pr
  6577 Praseodymium complex, CCDC: XAVWUM (Geo)C10H20N3O14Pr
  6578 Praseodymium complex, CCDC: PEHXIJ (Geo)C13H26N3O14Pr
  6579 Praseodymium complex, CCDC: RUGQUF (Geo)C22H26N3O14Pr
  6580 Praseodymium complex, CCDC: QOVXII (Geo)C8H20O15Pr


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
Praseodymium complex, CCDC: DUCHAK
 <Pr-O2> <Pr-O3> <> <Pr-N4> <> <> <Pr-O5> <> <> <> <> <> <Pr-O7> <> <> <Pr-N8> GR=CCDC
 Pr     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.43979971 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.47773669 +1   90.7166501 +1    0.0000000 +0     1     2     0
  N     2.51674154 +1  158.5438021 +1  -87.2342565 +1     1     2     3
  O     2.52425157 +1   65.0605107 +1  101.5555886 +1     1     2     3
  O     2.14608985 +1  123.6772749 +1  122.2526598 +1     3     1     2
  O     2.55540011 +1   97.3890290 +1 -156.2531546 +1     1     2     3
  N     2.57960986 +1  134.4591753 +1   79.3829622 +1     1     2     3
  O     2.15104705 +1  179.9964494 +1  176.3938556 +1     5     1     2
  O     2.14726432 +1  117.5425933 +1  153.4643265 +1     7     1     2
  N     3.29735461 +1   99.6187175 +1  -89.1960883 +1     1     2     3
  C     1.34331434 +1  131.5553886 +1   -7.7943608 +1    11     1     2
  C     1.40245503 +1  122.5859476 +1 -144.9529803 +1    12    11     1
  C     1.39074487 +1  118.6293642 +1    0.4628725 +1    13    12    11
  C     1.39628757 +1  119.3297723 +1   -0.9086739 +1    14    13    12
  C     1.35265238 +1  103.2963350 +1 -157.6759196 +1    11     1     2
  C     1.39565339 +1  127.7430871 +1  -17.3904065 +1     4     1     2
  N     1.22316627 +1   33.0161393 +1 -174.9721261 +1     6     3     1
  C     2.32954835 +1   92.3993884 +1 -175.7246242 +1    17     4     1
  N     1.20007484 +1   31.4620840 +1 -168.9978340 +1     9     5     1
  C     1.39094438 +1  118.2036587 +1  166.2410850 +1     4     1     2
  C     1.37274616 +1  117.6490363 +1 -163.7017041 +1     8     1     2
  C     1.38877128 +1  123.3798415 +1  163.2077689 +1    22     8     1
  C     1.40295187 +1  118.7244536 +1    0.9041775 +1    23    22     8
  C     1.38396601 +1  118.8831552 +1    0.8555846 +1    24    23    22
  C     1.35239749 +1  123.8683243 +1    0.5995348 +1     8     1     2
  N     1.23442610 +1   32.7604831 +1  175.3938490 +1    10     7     1
  O     1.20915921 +1  125.9776901 +1  179.9888785 +1    18     6     3
  O     1.20711716 +1  124.9722135 +1  179.0524216 +1    27    10     7
  O     1.25377229 +1  125.6899223 +1 -176.4876348 +1    20     9     5
  N     1.33355809 +1  125.4183753 +1  175.8558019 +1    21     4     1
  N     1.34785647 +1  149.7423442 +1  178.3967890 +1    19    17     4
  N     1.34234554 +1  123.6745228 +1 -177.0147303 +1    17     4     1
  H     1.09676531 +1  115.8608840 +1   34.7093841 +1    12    11     1
  H     1.08822951 +1  120.3295072 +1  179.9435324 +1    13    12    11
  H     1.09193969 +1  120.7298255 +1  178.7082962 +1    14    13    12
  H     1.09381440 +1  121.0515032 +1  178.1548960 +1    15    14    13
  H     1.09406842 +1  120.8109485 +1 -179.0928096 +1    23    22     8
  H     1.09236180 +1  119.8970655 +1 -179.0026951 +1    24    23    22
  H     1.09089091 +1  121.3609184 +1  179.9881127 +1    25    24    23
  H     1.11114776 +1  116.3025710 +1   17.5215903 +1    26     8     1
  H     1.00591890 +1  120.5795117 +1 -177.8651624 +1    32    19    17
  H     1.00702469 +1  120.3499884 +1    0.2311023 +1    32    19    17
  H     0.95600807 +1  144.2210985 +1   86.0810329 +1     2     1     3
  H     1.07638919 +1  112.4792443 +1 -103.7575192 +1     2     1     3