Accuracy

Er_(KITGUP) r   7016 Erbium complex, CCDC: KITGUP (Geo)

(Previous)     (Back)     (Next)        

   

    #  Species Formula
  7006 Erbium complex, CCDC: ZADWUW (Geo)C30H39O3Er
  7007 Erbium complex, CCDC: VEQFOM (Geo)C27H27N4O3Er
  7008 Erbium complex, CCDC: TUMJEQ (Geo)C53H53N6O4Er
  7009 Erbium complex, CCDC: UFIRIK (Geo)C48H66N8O5Er
  7010 Erbium complex, CCDC: TMHDER (Geo)C33H57O6Er
  7011 Erbium complex, CCDC: XEWVOK (Geo)C10H20N2O6Er
  7012 Erbium complex, CCDC: XEWWUR (Geo)C10H20N2O6Er
  7013 Erbium complex, CCDC: BAGBER (Geo)C20H18N5O8Er
  7014 Erbium complex, CCDC: AERETS02 (Geo)H18O9Er
  7015 Erbium complex, CCDC: GINRIE (Geo)C8H26O9Er
  7016 Erbium complex, CCDC: KITGUP (Geo) C8H26O9Er
  7017 Erbium complex, CCDC: HANCOO (Geo)C10H28O9Er
  7018 Erbium complex, CCDC: HENAEB (Geo)C10H19N2O9Er
  7019 Erbium complex, CCDC: KOZBUW (Geo)C21H24N3O9Er
  7020 Erbium complex, CCDC: SEGVAB (Geo)C6H6O12Er
  7021 Erbium complex, CCDC: VUSGUL (Geo)C12H24N3O12Er
  7022 Erbium complex, CCDC: YICCIW (Geo)C10H36O13Er
  7023 Erbium complex, CCDC: BOWXOA (Geo)N5O15Er
  7024 Erbium complex, CCDC: LEYJII (Geo)C12H30N3O18Er
  7025 Erbium complex, CCDC: SOKBID (Geo)C24H38N3O20Er
  7026 Erbium complex, CCDC: TEPKOO (Geo)C48H54N7O20Er


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 CHARGE=3.0
Erbium complex, CCDC: KITGUP
 <Er-O2> <Er-O3> <> <Er-O4> <> <> <Er-O5> <> <> <Er-O6> <> <> <Er-O7> GR=CCDC
 Er     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.34319998 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.35580001 +1   71.3644977 +1    0.0000000 +0     1     2     0
  O     2.36630005 +1  105.2377686 +1   61.7957496 +1     1     2     3
  O     2.36750002 +1   73.3739217 +1 -135.7231012 +1     1     2     3
  O     2.39560000 +1  128.0228459 +1  -67.1457516 +1     1     2     3
  O     2.46059998 +1  124.8295820 +1  166.6233613 +1     1     2     3
  O     3.52337768 +1   91.7059989 +1  118.1852473 +1     1     2     3
  O     3.51646125 +1  179.9949956 +1  -80.0747606 +1     1     2     3
  O     4.38611629 +1   85.8074355 +1   79.5883395 +1     1     2     3
  C     1.51078485 +1  130.9222276 +1  142.7844794 +1     6     1     2
  C     1.42372450 +1  103.8567607 +1    8.1875092 +1     9     1     2
  C     1.41135335 +1  100.5343711 +1 -111.8877716 +1     9     1     2
  C     1.47340822 +1  122.6096205 +1  141.6792438 +1     7     1     2
  C     1.47500925 +1  126.7077533 +1  -41.7416131 +1     7     1     2
  C     1.41933037 +1   96.8543675 +1  150.3147073 +1     8     1     2
  C     1.41612184 +1  141.9430479 +1  -56.6347519 +1     8     1     2
  C     1.45577157 +1  111.2307235 +1  116.2784253 +1    10     1     2
  H     0.99464050 +1  123.5290431 +1  -42.6219945 +1     6     1     2
  H     0.99835544 +1  127.0082259 +1 -104.4828925 +1    10     1     2
  H     1.00242660 +1  121.9746187 +1  103.8873384 +1     3     1     2
  H     0.99931990 +1  135.8999762 +1  -88.8374030 +1     3     1     2
  H     1.00177247 +1  132.5154577 +1  164.0148835 +1     2     1     3
  H     1.00529031 +1  127.2637640 +1  -18.6362173 +1     2     1     3
  H     1.17972905 +1  127.9150675 +1   47.4811010 +1     4     1     2
  H     0.96427917 +1  131.2371156 +1 -149.1378982 +1     4     1     2
  H     1.00330524 +1  126.1213006 +1 -126.4268736 +1     5     1     2
  H     1.00370510 +1  133.9566084 +1   54.1922509 +1     5     1     2
  H     1.10916910 +1  106.4072322 +1 -159.0978877 +1    11     6     1
  H     1.10302076 +1  102.6046710 +1  -42.4828023 +1    11     6     1
  H     1.12222400 +1  106.5496266 +1  153.8118701 +1    12     9     1
  H     1.10426686 +1  112.8238876 +1  -87.8048654 +1    12     9     1
  H     1.11502343 +1  111.5196958 +1  155.0164891 +1    13     9     1
  H     1.11154211 +1  102.4623345 +1  -90.5450826 +1    13     9     1
  H     1.11026771 +1  109.1416167 +1 -157.5930242 +1    14     7     1
  H     1.10334356 +1  103.0770691 +1  -42.3662112 +1    14     7     1
  H     1.10697073 +1  103.3903090 +1   54.9137056 +1    15     7     1
  H     1.10997386 +1  109.6228550 +1  170.9684052 +1    15     7     1
  H     1.10490478 +1  108.2301633 +1   71.9747619 +1    16     8     1
  H     1.11528872 +1  111.3314527 +1 -168.6844177 +1    16     8     1
  H     1.11513616 +1  102.2204510 +1   57.1329909 +1    17     8     1
  H     1.11155576 +1  112.0987441 +1  172.6362084 +1    17     8     1
  H     1.10284420 +1  108.3931555 +1   75.6261481 +1    18    10     1
  H     1.11661388 +1  106.6454816 +1 -165.1012454 +1    18    10     1