Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1100137 | CIF | C10 H12 Ag2 N10 O10 | P 1 21/c 1 | 10.5297; 12.6897; 6.9432 90; 94.782; 90 | 924.51 | Sawsan Salameh; Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Inorganica Chimica Acta, 2005, 358, 824-827 |
| 1100138 | CIF | Au | F m -3 m | 4.07; 4.07; 4.07 90; 90; 90 | 67.42 | J. Spreadborough; J. W. Christian High-temperature X-ray diffractometer Journal of Scientific Instruments, 1959, 36, 116-118 |
| 1100139 | CIF | C27 H37 Au Br4 N12 O9 | P -1 | 11.3215; 11.908; 16.4596 71.538; 71.675; 78.681 | 1986.6 | Esther R. Acuna-Cueva; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Structural Chemistry, 2004, 15, 159-163 |
| 1100140 | CIF | C34 H41.5 Cl2 Cu3 N9 O12.25 | P n n 2 | 17.076; 19.341; 13.481 90; 90; 90 | 4452.3 | Barea, Elisa; Quiros, Miguel; Navarro, Jorge A. R.; Salas, Juan M. Heteroleptic pyrimidine-2-olate and 4,4[prime or minute]-bipyridine copper(II) layered metal-organic frameworks with swelling properties. Dalton transactions (Cambridge, England : 2003), 2005, 1743-1746 |
| 1100141 | CIF | C18 H16 O3 | P n a 21 | 7.4026; 15.023; 12.308 90; 90; 90 | 1368.8 | no bibliography |
| 1100142 | CIF | Cl Co Cr2 H20 N6 O8 | P 1 21/c 1 | 10.0218; 9.3216; 16.2203 90; 112.962; 90 | 1395.2 | Raj Pal Sharma; Ritu Bala; Rajni Sharma; Juan M. Salas; Miguel Quiros Journal of Coordination Chemistry, 2005, 58, 217-223 |
| 1100143 | CIF | C5 H16 Co N11 S | P 1 21/c 1 | 12.195; 9.0317; 12.6017 90; 113.419; 90 | 1273.63 | Raj Pal Sharma; Rajni Sharma; Ritu Bala; Miguel Quiros; Juan M. Salas Journal of Coordination Chemistry, 2003, 56, 1581-1586 |
| 1100144 | CIF | C18 H24 Co N10 O12 | P 1 21/c 1 | 13.2319; 8.1677; 12.9061 90; 109.305; 90 | 1316.39 | Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta, 2003, 342, 209-218 |
| 1100145 | CIF | C14 H16 Cu N10 O12 | C 1 2/c 1 | 15.1701; 8.0805; 17.7233 90; 103.022; 90 | 2116.7 | Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta, 2003, 342, 209-218 |
| 1100146 | CIF | C9 H12 Cl2 Cu N4 O3 | P 1 21/n 1 | 8.8152; 10.0526; 15.344 90; 91.521; 90 | 1359.3 | Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta, 2003, 351, 356-362 |
| 1100147 | CIF | C40 H48 Cl4 Cu4 N8 O10 | P -1 | 9.2608; 10.3755; 12.9865 85.76; 75.915; 73 | 1157.4 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia; Covelo, Berta; Castineiras, Alfonso An X-Ray Study of the Crystal Structure of a new stepped- cubane tetranuclear copper(II) compound, [Cu~4~(μ~2~-OH) ~2~(μ~3~-OH)~2~Cl~2~(bipy)~4~]Cl~2~.6H~2~O Z. Anorg. Allg. Chem., 2002, 628, 907-908 |
| 1100149 | CIF | C28 H38 Co N4 O12 | P -1 | 9.556; 13.408; 14.48 108.097; 94.267; 110.194 | 1620.4 | Carballo, Rosa; Covelo, Berta; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia Unexpected formation and crystal structures of the mixed ligand complexes [Cu(OAc)(bipy)2]Cl.4H2O.1/2MeOH and [Co(OH2)2(phen)2](AcO)2. 6H2O Z. Anorg. Allg. Chem., 2003, 629, 244-248 |
| 1100150 | CIF | C22.5 H29 Cl Cu N4 O6.5 | P -1 | 8.8328; 10.5365; 14.4604 96.512; 104.786; 92.26 | 1289.5 | Carballo, Rosa; Covelo, Berta; Vazquez-Lopez, Ezequiel M.; Garcia-Martinez, Emilia Unexpected formation and crystal structures of the mixed ligand complexes [Cu(OAc)(bipy)2]Cl.4H2O.1/2MeOH and [Co(OH2)2(phen)2](AcO)2. 6H2O Z. Anorg. Allg. Chem., 2003, 629, 244-248 |
| 1100151 | CIF | C20 H26 Cu N2 O8 | C 1 2/c 1 | 29.437; 10.2477; 24.223 90; 111.758; 90 | 6786.5 | Carballo, Rosa; Covelo, Berta; VVázquez-López, Ezequiel M.; Castiñeiras, Alfonso; Niclos, Juan Synthesis and structural characterization of the mixed ligand complex [Cu(HmL)2(phen)].2H2O (H2mL = 2-methyllactic acid) Zeitschrift für Naturforschung B, 2003, 58, 151-154 |
| 1100152 | CIF | C22 H20 Cl2 Cu N16 O10 | C 1 2/c 1 | 19.666; 11.7586; 13.4808 90; 103.69; 90 | 3028.8 | Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Structure of the adduct of bis(2,2'biimidazole)copper(II) perchlorate with 4,7-dihydro-1,2,4-triazolo[1,5-a]pyrimidine-7-one Journal of Chemical Crystallography, 2004, 34, 549-552 |
| 1100153 | CIF | Ca4 F2 O7 Si2 | P 1 21/c 1 | 7.5397; 10.5338; 10.907 90; 109.557; 90 | 816.3 | Kruger, Hannes; Kahlenberg, Volker |
| 1100155 | CIF | C35 H46 Cl2 I N3 Ni O2 | P 1 21/c 1 | 12.78; 17.04; 19.13 90; 104.82; 90 | 4027.5 | no bibliography |
| 1100156 | CIF | C22 H22 N4 Ni O6 | P -1 | 9.17; 10.936; 12.717 106.91; 110.208; 90.172 | 1137.4 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100157 | CIF | C37 H34 N6 Ni O6 | P 1 21/n 1 | 9.2191; 29.972; 12.5644 90; 94.428; 90 | 3461.3 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100158 | CIF | C7 H10 Cu N2 O6 | P -1 | 5.528; 7.267; 13.626 75.045; 85.826; 75.613 | 512.2 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100159 | CIF | C9 H14 Cu N2 O6 | P 1 21/c 1 | 5.422; 13.436; 17 90; 92.324; 90 | 1237.4 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100160 | CIF | C11 H18 Cu N2 O6 | P 1 21/n 1 | 9.6623; 17.63; 9.7978 90; 118.748; 90 | 1463.3 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100161 | CIF | C12 H19 N4 O6.5 Zn | P b c n | 20.4557; 10.4408; 15.0918 90; 90; 90 | 3223.2 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100162 | CIF | C14 H22 N4 O6 Zn | P 43 21 2 | 10.7634; 10.7634; 16.442 90; 90; 90 | 1904.8 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100163 | CIF | C46 H46 N12 O6 Zn | P 1 21/c 1 | 12.9507; 9.0191; 22.209 90; 119.763; 90 | 2251.9 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100164 | CIF | C14 H22 N4 Ni O6 | C 1 2/c 1 | 19.392; 8.477; 11.412 90; 111.795; 90 | 1741.9 | Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron, 2004, 23, 1505-1518 |
| 1100165 | CIF | C10 H18 N8 O8 Zn | P b c a | 7.543; 13.1384; 17.2599 90; 90; 90 | 1710.5 | Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron, 2004, 23, 743-747 |
| 1100166 | CIF | C44.75 H32 Ag O2 P2 | C 1 2/c 1 | 17.417; 21.402; 11.298 90; 117.15; 90 | 3747.4 | Norie Momiyama; Hisashi Yamamoto Enantioselective O- and N-Nitroso Aldol Synthesis of Tin Enolates. Isolation of Three BINAP-Silver Complexes and Their Role in Regio- and Enantioselectivity Journal of the American Chemical Society, 2004, 126, 5360-5361 |
| 1100167 | CIF | La Mn O3 | P b n m | 5.53649; 5.74713; 7.69259 90; 90; 90 | 244.77 | no bibliography |
| 1100168 | CIF | C14 H12 Br2 N8 O4 Pd | P -1 | 6.5185; 7.5119; 10.7736 94.351; 106.036; 109.334 | 470.21 | Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Polyhedron, 2003, 22, 483-488 |
| 1100169 | CIF | C20 H20 N16 O8 Pd2 | C 2 2 21 | 12.864; 14.634; 30.703 90; 90; 90 | 5779.7 | Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron, 2004, 23, 2373-2379 |
| 1100170 | CIF | C34 H30 N14 O12 Pd2 | C 1 2/c 1 | 19.688; 14.219; 14.448 90; 110.02; 90 | 3800 | Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron, 2004, 23, 2373-2379 |
| 1100171 | CIF | C22 H40 N14 O11 Pd2 | P 1 21/c 1 | 10.2842; 18.92; 18.45 90; 104.117; 90 | 3481.5 | Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron, 2004, 23, 2373-2379 |
| 1100172 | CIF | C8 H10 N2 O5 | P 1 21 1 | 10.432; 5.645; 16.783 90; 94.943; 90 | 984.65 | Bouchouit, Karim; Bendheif, Leulmi; Benali-Cherif, Nouredine D-Phenylglycinium nitrate Acta Crystallographica, Section E, 2004, 60, o272-o274 |
| 1100173 | CIF | C15 H22 N2 O4 | P 21 21 21 | 9.3531; 10.5002; 15.9 90; 90; 90 | 1561.53 | Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone European Journal of Organic Chemistry, 1999, 1999, 2977-2990 |
| 1100174 | CIF | C24 H64 I2 N4 Ni P4 | P 1 21/c 1 | 19.349; 10.7833; 19.663 90; 111.04; 90 | 3829.09 | Gröb, Thorsten; Neumüller, Bernhard; Harms, Klaus; Schmock, Fritjof; Greiner, Andreas; Dehnicke, Kurt Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und [Ni(HNPEt~3~)~4~]I~2~ Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 1928-1931 |
| 1100175 | CIF | C84 H84 Hf N4 O3 P4 | P -1 | 20.0757; 20.642; 21.1595 109.193; 111.285; 96.879 | 7425.96 | Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 1801-1806 |
| 1100176 | CIF | C72 H62 Cl2 Hf N4 P4 | P -1 | 14.4397; 19.2812; 24.5579 67.273; 87.445; 87.082 | 6295.93 | Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt Phosphaniminato-Komplexe des Hafniums. Die Kristallstrukturen von [Hf(NPPh~3~)~4~] · 3 THF und [Hf(NPPh~3~)~2~Cl~2~(HNPPh~3~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 1801-1806 |
| 1100177 | CIF | C15 H15 Cl O S | P 1 21 1 | 7.685; 5.006; 18.58 90; 97.94; 90 | 707.941 | Hoffmann, Reinhard W.; Nell, Peter G.; Leo, Roland; Harms, Klaus Highly Enantiomerically Enriched α-Haloalkyl Grignard Reagents Chemistry - A European Journal, 2000, 6, 3359-3365 |
| 1100178 | CIF | C25 H24 N2 O6 | P -1 | 7.842; 12.127; 12.973 65.76; 86.43; 81.31 | 1112.04 | Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society, 2000, 122, 10218-10219 |
| 1100179 | CIF | C18 H22 O | R 3 :H | 23.056; 23.056; 7.325 90; 90; 120 | 3372.15 | Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society, 2000, 122, 10218-10219 |
| 1100180 | CIF | C17 H20 O | R 3 :H | 22.864; 22.864; 7.229 90; 90; 120 | 3272.75 | Bromm, Lars O.; Laaziri, Hamid; Lhermitte, Frédéric; Harms, Klaus; Knochel, Paul Highly Regio- and Stereoselective Thermal Migration of Organoboranes in Acyclic Molecules Journal of the American Chemical Society, 2000, 122, 10218-10219 |
| 1100181 | CIF | C34 H47 N5 O5 P S4 Sm | P -1 | 9.19; 19.6516; 24.0125 96.748; 94.827; 91.72 | 4287.81 | Gröb, Thorsten; Harms, Klaus; Dehnicke, Kurt Kristallstruktur des Isothiocyanato-Komplexes [Ph~3~PNH~2~(OEt~2~)][Sm(NCS)~4~(DME)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 125-127 |
| 1100182 | CIF | C10 H10 Cl N O2 | P 1 21/c 1 | 7.8902; 5.8375; 20.5524 90; 94.175; 90 | 944.112 | Bach, Thorsten; Schlummer, Björn; Harms, Klaus Iron(II)-catalyzed intramolecular aminochlorination of alkenes Chemical Communications (Cambridge, United Kingdom), 2000, 287-288 |
| 1100183 | CIF | C23 H39 Cl2 N O3 | P 21 21 21 | 8.52; 12.123; 24.105 90; 90; 90 | 2489.76 | T.Bach; H.Bergmann; K.Harms Angew.Chem.,Int.Ed.Engl., 2000, 39, 2302 |
| 1100184 | CIF | C12 H30 Eu I2 O6 | P 1 21 1 | 8.4889; 10.5945; 12.2789 90; 93.793; 90 | 1101.89 | T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke Z.Anorg.Allg.Chem., 2000, 626, 1361 |
| 1100185 | CIF | C102 H105 Eu2 I N5 O6 P5 | P -1 | 14.055; 16.522; 22.037 89.404; 72.958; 78.657 | 4791 | T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke Z.Anorg.Allg.Chem., 2000, 626, 1361 |
| 1100186 | CIF | C114 H144 I4 N4 O10.5 P4 Y2 | P -1 | 17.3969; 17.701; 21.538 74.929; 84.223; 64.612 | 5785.4 | T.Grob; G.Seybert; W.Massa; K.Harms; K.Dehnicke Z.Anorg.Allg.Chem., 2000, 626, 1361 |
| 1100187 | CIF | C22.17 H35.34 Cl0.34 N O4 | R 3 :H | 28.224; 28.224; 15.262 90; 90; 120 | 10528.8 | Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis, 2001, 2001, 1395-1405 |
| 1100188 | CIF | C22 H24 N2 O2 | P 1 21/c 1 | 11.372; 14.9124; 11.545 90; 111.665; 90 | 1819.54 | Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis, 2001, 2001, 1395-1405 |
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