Crystallography Open Database
Search results
Result: there are 3786 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching space group like 'P b c n'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4083731 | CIF | C19 H26 N2 O2 | P b c n | 16.657; 8.0848; 27.9824 90; 90; 90 | 3768.35 | Li, Jing; Noyori, Shintaro; Nakajima, Kiyohiko; Nishihara, Yasushi New Entry to the Synthesis of α-Iminonitriles by Lewis Acid Mediated Isomerization of Cyano-Substituted Iminoisobenzofurans Prepared by Palladium-Catalyzed Three-Component Coupling of Arynes, Isocyanides, and Cyanoformates Organometallics, 2014, 140623114450000 |
| 4083817 | CIF | C14 H23 I O2 P2 Pd | P b c n | 29.0236; 14.3539; 13.7154 90; 90; 90 | 5713.9 | Kimura, Tsutomu; Uozumi, Yasuhiro PCP Pincer Palladium Complexes and Their Catalytic Properties: Synthesis via the Electrophilic Ligand Introduction Route Organometallics, 2006, 25, 4883 |
| 4083987 | CIF | C86 H103 Al2 Li9 N12 | P b c n | 19.546; 16.098; 26.168 90; 90; 90 | 8234 | Boss, Sally R.; Cole, Jacqueline M.; Haigh, Robert; Snaith, Ronald; Wheatley, Andrew E. H.; McIntyre, Garry J.; Raithby, Paul R. Hydride Encapsulation by a Molecular Main-Group-Metal Cluster: Single-Crystal Neutron Diffraction Structure of [{Ph(2-C5H4N)N}6HLi8]+ Organometallics, 2004, 23, 4527 |
| 4083988 | CIF | C86 H103 Al2 Li9 N12 | P b c n | 19.546; 16.098; 26.168 90; 90; 90 | 8234 | Boss, Sally R.; Cole, Jacqueline M.; Haigh, Robert; Snaith, Ronald; Wheatley, Andrew E. H.; McIntyre, Garry J.; Raithby, Paul R. Hydride Encapsulation by a Molecular Main-Group-Metal Cluster: Single-Crystal Neutron Diffraction Structure of [{Ph(2-C5H4N)N}6HLi8]+ Organometallics, 2004, 23, 4527 |
| 4084286 | CIF | C17 H20 Ir N O3 | P b c n | 14.7898; 15.8754; 13.8691 90; 90; 90 | 3256.4 | Chen, Jeffrey; Campos, Jesús; Mercado, Brandon Q.; Crabtree, Robert H.; Balcells, David Distortional Effects of Noncovalent Interactions in the Crystal Lattice of a Cp*Ir(III) Acylhydroxamic Acid Complex: A Joint Experimental‒Computational Study Organometallics, 2014, 33, 4417 |
| 4084436 | CIF | C32 H28 S Sn | P b c n | 31.347; 9.5789; 17.9303 90; 90; 90 | 5383.9 | Athukorala Arachchige, Kasun S.; Diamond, Louise M.; Knight, Fergus R.; Lechner, Marie-Luise; Slawin, Alexandra M. Z.; Woollins, J. Derek Synthetic, Structural, and Spectroscopic Studies of Sterically Crowded Tin‒Chalcogen Acenaphthenes Organometallics, 2014, 33, 6089 |
| 4085135 | CIF | C32 H30 Au F6 N3 O4 S2 | P b c n | 20.8574; 19.1864; 16.4672 90; 90; 90 | 6589.8 | Brill, Marcel; Collado, Alba; Cordes, David B.; Slawin, Alexandra M. Z.; Vogt, Matthias; Grützmacher, Hansjörg; Nolan, Steven P. Synthesis and Characterization of Gold(I) Complexes of Dibenzotropylidene-Functionalized NHC Ligands (Trop-NHCs) Organometallics, 2015, 34, 263 |
| 4085391 | CIF | C58.5 H42 N3 O15 Re3 S3 | P b c n | 10.6581; 35.7402; 30.3489 90; 90; 90 | 11560.6 | Nagarajaprakash, R.; Ashok Kumar, Chowan; Mobin, Shaikh M.; Manimaran, Bala. Multicomponent Self-Assembly of Thiolato- and Selenato-Bridged Ester-Functionalized Rhenium(I)-Based Trigonal Metallaprisms: Synthesis and Structural Characterization Organometallics, 2015, 34, 724 |
| 4085682 | CIF | C35 H37 N2 O3 P Pd S | P b c n | 17.86211; 17.52994; 21.0147 90; 90; 90 | 6580.16 | Burns, Christopher T.; Shang, Suisheng; Mashuta, Mark S. Synthesis and Reactivity of Neutral Palladium(II) Alkyl Complexes that Contain Phosphinimine-Arenesulfonate Ligands Organometallics, 2015, 34, 1844 |
| 4085697 | CIF | C26 H58 Cl Sb Si8 Zr | P b c n | 41.589; 13.058; 15.11 90; 90; 90 | 8206 | Zitz, Rainer; Baumgartner, Judith; Marschner, Christoph Metalated Oligosilanylstibines. Organometallics, 2015, 34, 1431-1439 |
| 4085698 | CIF | C26 H49 Cl Hf Sb Si8 | P b c n | 41.538; 13.038; 15.117 90; 90; 90 | 8187 | Zitz, Rainer; Baumgartner, Judith; Marschner, Christoph Metalated Oligosilanylstibines. Organometallics, 2015, 34, 1431-1439 |
| 4085724 | CIF | C26 H34 Cl2 O4 P2 Ru | P b c n | 21.5619; 13.5371; 19.8932 90; 90; 90 | 5806.5 | Graux, Lionel V.; Giorgi, Michel; Buono, Gérard; Clavier, Hervé Ruthenium Carbonyl Complexes Bearing Secondary Phosphine Oxides and Phosphinous Acids: Synthesis, Characterization, and Application in Catalysis Organometallics, 2015, 34, 1864 |
| 4085840 | CIF | C27 H51 N Os P2 S | P b c n | 8.3427; 18.809; 18.266 90; 90; 90 | 2866.3 | Eguillor, Beatriz; Esteruelas, Miguel A.; Fernández, Israel; Gómez-Gallego, Mar; Lledós, Agustí; Martín-Ortiz, Mamen; Oliván, Montserrat; Oñate, Enrique; Sierra, Miguel A. Azole Assisted C‒H Bond Activation Promoted by an Osmium-Polyhydride: Discerning between N and NH Organometallics, 2015, 34, 1898 |
| 4085887 | CIF | C24.5 H34 Cl2 N4 Ru | P b c n | 33.7429; 7.9777; 19.4794 90; 90; 90 | 5243.67 | Menéndez-Rodr\?íguez, Luc\?ía; Tomás-Mendivil, Eder; Francos, Javier; Crochet, Pascale; Cadierno, Victorio; Antiñolo, Antonio; Fernández-Galán, Rafael; Carrillo-Hermosilla, Fernando Reactivity of the Dimer [{RuCl(μ-Cl)(η3:η3-C10H16)}2] (C10H16= 2,7-Dimethylocta-2,6-diene-1,8-diyl) toward Guanidines: Access to Ruthenium(IV) and Ruthenium(II) Guanidinate Complexes Organometallics, 2015, 34, 2796 |
| 4085980 | CIF | C24 H22 N2 O2 P2 S | P b c n | 26.023; 9.7154; 9.065 90; 90; 90 | 2291.8 | Oldenhof, Sander; Terrade, Frederic G.; Lutz, Martin; van der Vlugt, Jarl Ivar; Reek, Joost N. H. Formation and Site-Selective Reactivity of a Nonsymmetric Dinuclear Iridium BisMETAMORPhos Complex Organometallics, 2015, 34, 3209 |
| 4086051 | CIF | C21 H18.92 Br3 Cu2.08 N2 | P b c n | 20.664; 14.8519; 6.9524 90; 90; 90 | 2133.7 | Williams, Thomas J.; Bray, Joshua T. W.; Lake, Benjamin R. M.; Willans, Charlotte E.; Rajabi, Nasir A.; Ariafard, Alireza; Manzini, Chiara; Bellina, Fabio; Whitwood, Adrian C.; Fairlamb, Ian J. S. Mechanistic Elucidation of the Arylation of Non-SpectatorN-Heterocyclic Carbenes at Copper Using a Combined Experimental and Computational Approach Organometallics, 2015, 34, 3497 |
| 4086054 | CIF | C21 H18.91 Br3 Cu2.09 N2 | P b c n | 20.7826; 14.9253; 6.9568 90; 90; 90 | 2157.91 | Williams, Thomas J.; Bray, Joshua T. W.; Lake, Benjamin R. M.; Willans, Charlotte E.; Rajabi, Nasir A.; Ariafard, Alireza; Manzini, Chiara; Bellina, Fabio; Whitwood, Adrian C.; Fairlamb, Ian J. S. Mechanistic Elucidation of the Arylation of Non-SpectatorN-Heterocyclic Carbenes at Copper Using a Combined Experimental and Computational Approach Organometallics, 2015, 34, 3497 |
| 4086194 | CIF | C59 H70 La N2 O P | P b c n | 38.374; 12.664; 21.6208 90; 90; 90 | 10507 | Liu, Bo; Sun, Guangping; Li, Shihui; Liu, Dongtao; Cui, Dongmei Isoprene Polymerization with Iminophosphonamide Rare-Earth-Metal Alkyl Complexes: Influence of Metal Size on the Regio- and Stereoselectivity Organometallics, 2015, 34, 4063 |
| 4086405 | CIF | C13 H13 N3 O4 S | P b c n | 7.2086; 14.8189; 24.7866 90; 90; 90 | 2647.8 | Ruff, Andrew; Kirby, Christopher; Chan, Benny C.; O'Connor, Abby R. Base-Free Transfer Hydrogenation of Ketones Using Cp*Ir(pyridinesulfonamide)Cl Precatalysts Organometallics, 2016, 35, 327-335 |
| 4086737 | CIF | C18 H22 B N | P b c n | 21.983; 15.019; 9.2362 90; 90; 90 | 3049.4 | Smith, Mallory F.; Cassidy, S. Joel; Adams, Ian A.; Vasiliu, Monica; Gerlach, Deidra L.; Dixon, David A.; Rupar, Paul A. Substituent Effects on the Properties of Borafluorenes Organometallics, 2016, 35, 3182 |
| 4086766 | CIF | C18.71 H32 Co N5.29 O2 | P b c n | 9.3622; 14.3857; 16.751 90; 90; 90 | 2256.1 | Hering, Florian; Berthel, Johannes H. J.; Lubitz, Katharina; Paul, Ursula S. D.; Härterich, Heidi Schneider Marcel; Radius, Udo Correction to Synthesis and Thermal Properties of Novel NHC-Stabilized Cobalt Carbonyl Nitrosyl Complexes Organometallics, 2016 |
| 4087071 | CIF | C21 H13 N O5 Ru2 | P b c n | 15.946; 16.474; 15.387 90; 90; 90 | 4042.1 | Gong, Dawei; Hu, Bowen; Shi, Jing; Ma, Peipei; Wang, Baiquan; Chen, Dafa Synthesis of Diruthenium Complexes Derived from Pyridyl-Substituted Indenes Organometallics, 2017 |
| 4087138 | CIF | C22 H20 N2 Si | P b c n | 27.4912; 12.6235; 11.0362 90; 90; 90 | 3829.95 | Lei, Hu; Aly, Shawkat M.; Karsenti, Paul-Ludovic; Fortin, Daniel; Harvey, Pierre D. Luminescent Organometallic Complexes Built upon the Nonemissive Azophenine Organometallics, 2017, 36, 572 |
| 4087176 | CIF | C82 H104 N4 O4 U2 | P b c n | 11.7962; 16.9274; 36.1586 90; 90; 90 | 7220.1 | Zhang, Lei; Zhang, Congcong; Hou, Guohua; Zi, Guofu; Walter, Marc D. Small-Molecule Activation Mediated by a Uranium Bipyridyl Metallocene Organometallics, 2017 |
| 4087473 | CIF | C94 H112 Mg2 N4 O4 | P b c n | 13.79; 18.241; 33.719 90; 90; 90 | 8482 | Han, Tomasz; Petrus, Rafał; Bykowski, Dominik; Jerzykiewicz, Lucjan; Sobota, Piotr Synthesis and Structural Characterization of Magnesium Drug Complexes: Efficient Initiators for Forming Polylactide‒Drug Conjugates Organometallics, 2015, 34, 4871 |
| 4087478 | CIF | C59 H73 N O3 P W | P b c n | 35.692; 14.3559; 20.764 90; 90; 90 | 10639.3 | VenkatRamani, Sudarsan; Huff, Nicholas B.; Jan, Muhammad Tariq; Ghiviriga, Ion; Abboud, Khalil A.; Veige, Adam S. New Alkylidyne Complexes Featuring a Flexible Trianionic ONO3‒ Pincer-Type Ligand: Inorganic Enamine Effect versus Sterics in Electrophilic Additions Organometallics, 2015, 34, 2841 |
| 4087503 | CIF | C23 H40 P2 Pd S | P b c n | 25.061; 15.4141; 19.272 90; 90; 90 | 7444.6 | Munjanja, Lloyd; Brennessel, William W.; Jones, William D. Room-Temperature Carbon‒Sulfur Bond Activation by a Reactive (dippe)Pd Fragment Organometallics, 2015, 34, 1716 |
| 4087519 | CIF | C32 H36 O4 U | P b c n | 19.8917; 7.5254; 18.6598 90; 90; 90 | 2793.24 | Johnson, Sara A.; Kiernicki, John J.; Fanwick, Phillip E.; Bart, Suzanne C. New Benzylpotassium Reagents and Their Utility for the Synthesis of Homoleptic Uranium(IV) Benzyl Derivatives Organometallics, 2015, 34, 2889 |
| 4087533 | CIF | C19 H14 Fe2 O7 S2 | P b c n | 21.663; 12.539; 15.187 90; 90; 90 | 4125.3 | Song, Li-Cheng; Tan, Hao; Zhu, An-Guo; Hu, Yuan-Yuan; Chen, Hao Palladium-Catalyzed Reactions of [Et3NH]+Salts of [(μ-RS)(μ-CO)Fe2(CO)6]−Anions with Iodo-Aromatic Compounds To Give the Corresponding Butterfly μ-Acyl Fe/S Cluster Complexes Organometallics, 2015, 34, 1730 |
| 4087671 | CIF | C24 H45 Cl Ir N O2 P2 | P b c n | 34.451; 11.035; 14.4669 90; 90; 90 | 5499.8 | Mucha, Neil T.; Waterman, Rory Iridium Pincer Catalysts for Silane Dehydrocoupling: Ligand Effects on Selectivity and Activity Organometallics, 2015, 34, 3865 |
| 4087705 | CIF | C66 H54 Cl4 Fe4 O4 P2 W | P b c n | 12.0616; 17.2266; 27.9283 90; 90; 90 | 5802.95 | Miesel, Dominique; Hildebrandt, Alexander; Korb, Marcus; Schaarschmidt, Dieter; Lang, Heinrich Transition-Metal Carbonyl Complexes of 2,5-Diferrocenyl-1-phenyl-1H-phosphole Organometallics, 2015, 34, 4293 |
| 4088061 | CIF | C32.5 H85 Cl2 O0.5 Si8 Sn2 | P b c n | 28.4631; 23.2026; 16.3645 90; 90; 90 | 10807.4 | Wagner, Michael; Zobel, Bernhard; Dietz, Christina; Schollmeyer, Dieter; Jurkschat, Klaus Cyclic Dinuclear Organotin Cations Stabilized by Bulky Substituents Organometallics, 2015, 34, 5602 |
| 4088152 | CIF | C55 H42 B F15 N O P Si | P b c n | 30.7946; 17.3685; 19.8227 90; 90; 90 | 10602.3 | Liedtke, René; Eller, Christina; Daniliuc, Constantin G.; Williams, Kamille; Warren, Timothy H.; Tesch, Matthias; Studer, Armido; Kehr, Gerald; Erker, Gerhard FLPNO Nitroxide Radical Formation by a 1,1-Carboboration Route Organometallics, 2015, 35, 55 |
| 4088390 | CIF | C54 H100 K2 N2 O2 P4 | P b c n | 14.232; 24.476; 20.231 90; 90; 90 | 7047 | Simler, Thomas; Karmazin, Lydia; Bailly, Corinne; Braunstein, Pierre; Danopoulos, Andreas A. Potassium and Lithium Complexes with Monodeprotonated, Dearomatized PNP and PNCNHC Pincer-Type Ligands Organometallics, 2016, 35, 903 |
| 4088546 | CIF | C66 H84 B22 Cl4 | P b c n | 14.5822; 13.5478; 38.859 90; 90; 90 | 7676.9 | Choi, Byung Hoon; Lee, Ji Hye; Hwang, Hyonseok; Lee, Kang Mun; Park, Myung Hwan Novel Dimeric o-Carboranyl Triarylborane: Intriguing Ratiometric Color-Tunable Sensor via Aggregation-Induced Emission by Fluoride Anions Organometallics, 2016, 35, 1771 |
| 4088737 | CIF | C18.71 H32 Co N5.29 O2 | P b c n | 9.3622; 14.3857; 16.751 90; 90; 90 | 2256.1 | Hering, Florian; Berthel, Johannes H. J.; Lubitz, Katharina; Paul, Ursula S. D.; Schneider, Heidi; Härterich, Marcel; Radius, Udo Synthesis and Thermal Properties of Novel NHC-Stabilized Cobalt Carbonyl Nitrosyl Complexes Organometallics, 2016, 35, 2806 |
| 4088892 | CIF | C24.5 H15 F3 N5 O6 Re S | P b c n | 20.9198; 14.1928; 18.5858 90; 90; 90 | 5518.3 | Coe, Benjamin J.; Foxon, Simon P.; Pilkington, Rachel A.; Sánchez, Sergio; Whittaker, Daniel; Clays, Koen; Van Steerteghem, Nick; Brunschwig, Bruce S. Rhenium(I) Tricarbonyl Complexes with Peripheral N-Coordination Sites: A Foundation for Heterotrimetallic Nonlinear Optical Chromophores Organometallics, 2016, 35, 3014 |
| 4088918 | CIF | C36 H56 F K N8 O18 Si8 | P b c n | 15.177; 19.121; 18.807 90; 90; 90 | 5457.8 | El Aziz, Youssef; Taylor, Peter G.; Bassindale, Alan R.; Coles, Simon J.; Pitak, Mateusz B. Synthesis and Structures of Novel Molecular Ionic Compounds Based on Encapsulation of Anions and Cations Organometallics, 2016, 35, 4004 |
| 4088920 | CIF | C36 H56 F N8 O18 Rb Si8 | P b c n | 15.1086; 19.1296; 18.9252 90; 90; 90 | 5469.8 | El Aziz, Youssef; Taylor, Peter G.; Bassindale, Alan R.; Coles, Simon J.; Pitak, Mateusz B. Synthesis and Structures of Novel Molecular Ionic Compounds Based on Encapsulation of Anions and Cations Organometallics, 2016, 35, 4004 |
| 4089007 | CIF | C152.5 H196 Li4 N4 O24 P4 Pd4 S8 | P b c n | 33.568; 30.197; 35.307 90; 90; 90 | 35789 | Wei, Jia; Shen, Zhongliang; Filatov, Alexander S.; Liu, Qian; Jordan, Richard F. Self-Assembled Cage Structures and Ethylene Polymerization Behavior of Palladium Alkyl Complexes That Contain Phosphine-Bis(arenesulfonate) Ligands Organometallics, 2016, 35, 3557 |
| 4089059 | CIF | C24 H28 Au2 Cl2 N6 | P b c n | 8.2491; 11.6481; 27.725 90; 90; 90 | 2664 | Hettmanczyk, Lara; Schulze, Dennis; Suntrup, Lisa; Sarkar, Biprajit Mono- and Digold(I) Complexes with Mesoionic Carbenes: Structural Characterization and Use in Catalytic Silver-Free Oxazoline Formation Organometallics, 2016, 35, 3828 |
| 4089197 | CIF | C72 H66 Cl4 F4 Ir2 N6 O6 | P b c n | 28.5229; 15.4584; 15.6649 90; 90; 90 | 6906.9 | Congrave, Daniel G.; Hsu, Yu-ting; Batsanov, Andrei S.; Beeby, Andrew; Bryce, Martin R. Synthesis, Diastereomer Separation, and Optoelectronic and Structural Properties of Dinuclear Cyclometalated Iridium(III) Complexes with Bridging Diarylhydrazide Ligands Organometallics, 2017, 36, 981 |
| 4089259 | CIF | C52 H66 Cl2 O2 Si Ti | P b c n | 17.0174; 13.5503; 20.5662 90; 90; 90 | 4742.4 | Machat, Martin R.; Jandl, Christian; Rieger, Bernhard Titanocenes in Olefin Polymerization: Sustainable Catalyst System or an Extinct Species? Organometallics, 2017, 36, 1408 |
| 4089261 | CIF | C54 H72 O2 Si Ti | P b c n | 17.0522; 13.6012; 20.6542 90; 90; 90 | 4790.3 | Machat, Martin R.; Jandl, Christian; Rieger, Bernhard Titanocenes in Olefin Polymerization: Sustainable Catalyst System or an Extinct Species? Organometallics, 2017, 36, 1408 |
| 4089362 | CIF | C50 H64 Ir2 Mo O P2 S2 | P b c n | 24.372; 22.53; 17.977 90; 90; 90 | 9871 | Kajitani, Hidenobu; Seino, Hidetake; Mizobe, Yasushi Synthesis of a Sulfido-Capped Trinuclear Cluster [{(η5-C5Me5)Ir}2{Mo(CO)3}(μ3-S)2] and Its Reactions at the Molybdenum Site Forming a Series of Ir2MoS2Clusters Organometallics, 2007, 26, 3499 |
| 4089419 | CIF | C24 H34 P2 Pd | P b c n | 11.5722; 15.5202; 13.4168 90; 90; 90 | 2409.7 | Choi, Jun-Chul; Shiraishi, Kouichi; Takenaka, Yasumasa; Yasuda, Hiroyuki; Sakakura, Toshiyasu Synthesis and Reactivity of Five-Membered Palladalactones from Arylallenes and Carbon Dioxide: Relevance to Catalytic Lactone Synthesis Organometallics, 2013, 32, 3411 |
| 4089487 | CIF | C55 H59 B F24 O4 P2 Pd | P b c n | 15.5722; 21.561; 36.5134 90; 90; 90 | 12259.5 | Plessow, Philipp N.; Weigel, Laura; Lindner, Ronald; Schäfer, Ansgar; Rominger, Frank; Limbach, Michael; Hofmann, Peter Mechanistic Details of the Nickel-Mediated Formation of Acrylates from CO2, Ethylene and Methyl Iodide Organometallics, 2013, 32, 3327 |
| 4089488 | CIF | C55 H59 B F24 Ni O4 P2 | P b c n | 15.5152; 21.4383; 36.5536 90; 90; 90 | 12158.4 | Plessow, Philipp N.; Weigel, Laura; Lindner, Ronald; Schäfer, Ansgar; Rominger, Frank; Limbach, Michael; Hofmann, Peter Mechanistic Details of the Nickel-Mediated Formation of Acrylates from CO2, Ethylene and Methyl Iodide Organometallics, 2013, 32, 3327 |
| 4089665 | CIF | C61 H52 B F24 N4 O4 Rh | P b c n | 16.4704; 22.8734; 16.2804 90; 90; 90 | 6133.4 | Chaplin, Adrian B. Rhodium(I) Complexes of the Conformationally Rigid IBioxMe4 Ligand: Preparation of Mono-, Bis-, and Tris-ligated NHC Complexes Organometallics, 2014, 33, 3069 |
| 4100125 | CIF | ? | P b c n | 11.89; 14.086; 17.87 90; 90; 90 | 2992.9 | Akiba, Kin-ya; Moriyama, Yuji; Mizozoe, Mitsuhiro; Inohara, Hideki; Nishii, Takako; Yamamoto, Yohsuke; Minoura, Mao; Hashizume, Daisuke; Iwasaki, Fujiko; Takagi, Nozomi; Ishimura, Kazuya; Nagase, Shigeru Synthesis and Characterization of Stable Hypervalent Carbon Compounds (10-C-5) Bearing a 2,6-Bis(p-substituted phenyloxymethyl)benzene Ligand Journal of the American Chemical Society, 2005, 127, 5893-5901 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!