Crystallography Open Database
Search results
Result: there are 227 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 'R -3'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7049156 | CIF | C90 H112 N O4 Ti | R -3 | 23.4039; 23.4039; 24.9083 90; 90; 120 | 11815.5 | Bae, Dae Young; Park, Gyeong Su; Ko, Nakeun; Son, Kyung-sun; Lee, Eunsung First-row early transition metal complexes with a highly sterically demanding triisopropylphenyl amino triphenolate ligand: synthesis and applications Dalton Transactions, 2019 |
| 7054489 | CIF | C9 H17 Cl N2 | R -3 | 19.8873; 19.8873; 14.4048 90; 90; 120 | 4933.9 | Maton, C.; Van Hecke, K.; Stevens, C. V. Peralkylated imidazolium carbonate ionic liquids: synthesis using dimethyl carbonate, reactivity and structure New J. Chem., 2015, 39, 461 |
| 7054498 | CIF | C29.33 H26 N3 O6.17 | R -3 | 28.3533; 28.3533; 15.9781 90; 90; 120 | 11124.1 | Haddad, Saoussen; Boudriga, Sarra; Akhaja, Tarunkumar Nanjibhai; Raval, Jignesh Priyakant; Porzio, François; Soldera, Armand; Askri, Moheddine; Knorr, Michael; Rousselin, Yoann; Kubicki, Marek M.; Rajani, Dhanji A strategic approach to the synthesis of functionalized spirooxindole pyrrolidine derivatives: in vitro antibacterial, antifungal, antimalarial and antitubercular studies New J. Chem., 2015, 39, 520 |
| 7054597 | CIF | C51 H76 Cl2 P2 Ru | R -3 | 46.1591; 46.1591; 13.9447 90; 90; 120 | 25730.9 | Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols New J. Chem., 2015, 39, 1858 |
| 7054601 | CIF | C53 H80 Cl2 P2 Ru | R -3 | 47.1514; 47.1514; 13.6692 90; 90; 120 | 26318.6 | Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols New J. Chem., 2015, 39, 1858 |
| 7054602 | CIF | C55 H78 Cl2 P2 Ru | R -3 | 46.042; 46.042; 14.0313 90; 90; 120 | 25759.5 | Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols New J. Chem., 2015, 39, 1858 |
| 7054603 | CIF | C51 H75 Cl2 F P2 Ru | R -3 | 45.479; 45.479; 14.179 90; 90; 120 | 25398 | Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols New J. Chem., 2015, 39, 1858 |
| 7054884 | CIF | C45 H33 Cl6 N9 Zn3 | R -3 | 18.1422; 18.1422; 25.8426 90; 90; 120 | 7366.3 | Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand New J. Chem., 2015, 39, 6016 |
| 7054885 | CIF | C92 H68 Cd6 Cl18 N18 O0.5 | R -3 | 16.1561; 16.1561; 31.8535 90; 90; 120 | 7200.5 | Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand New J. Chem., 2015, 39, 6016 |
| 7054886 | CIF | C45 H33 Br8 Hg4 N9 | R -3 | 17.976; 17.976; 27.338 90; 90; 120 | 7650.4 | Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand New J. Chem., 2015, 39, 6016 |
| 7054887 | CIF | C45 H33 Hg4 I8 N9 | R -3 | 18.3083; 18.3083; 29.1307 90; 90; 120 | 8456.2 | Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand New J. Chem., 2015, 39, 6016 |
| 7057423 | CIF | C15 H19 Br2 N3 O | R -3 | 36.6338; 36.6338; 6.4707 90; 90; 120 | 7520.5 | Il’in, Mikhail; Bolotin, Dmitrii S.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu. Facile Selective Synthesis of 2-Methyl-5-amino-1,2,4-oxadiazolium Bromides as Further Targets for Nucleophilic Additions New Journal of Chemistry, 2018, 42, 9373-9376 |
| 7057869 | CIF | C44 H60 Co4 N16 O8 | R -3 | 32.2276; 32.2276; 13.8386 90; 90; 120 | 12447.4 | Das, Avijit; Goswami, Soumyabrata; Ghosh, Ashutosh Rare azido and hydroxido bridged tetranuclear Co(II) complexes of a polynucleating Mannich base ligand with defect dicubane core: Structures, magnetism and phenoxazinone synthase like activity New Journal of Chemistry, 2018, 42, 19377-19389 |
| 7108619 | CIF | C16 H10 Cu N4 O4 | R -3 | 33.6525; 33.6525; 4.80132 90; 90; 120 | 4708.97 | Chris S. Hawes; Ravichandar Babarao; Matthew R. Hill; Keith F. White; Brendan F. Abrahams; Paul E. Kruger Hysteretic carbon dioxide sorption in a novel copper(II)-indazole-carboxylate porous coordination polymer Chem.Commun., 2012, 48, 11558 |
| 7108620 | CIF | C16 H10 Cu N4 O4 | R -3 | 33.6966; 33.6966; 4.78817 90; 90; 120 | 4708.4 | Chris S. Hawes; Ravichandar Babarao; Matthew R. Hill; Keith F. White; Brendan F. Abrahams; Paul E. Kruger Hysteretic carbon dioxide sorption in a novel copper(II)-indazole-carboxylate porous coordination polymer Chem.Commun., 2012, 48, 11558 |
| 7110090 | CIF | C258 H414 B240 Cu24 N6 O120 | R -3 | 31.498; 31.498; 81.077 90; 90; 120 | 69662 | Daniel J. Clingerman; Robert D. Kennedy; Joseph E. Mondloch; Amy A. Sarjeant; Joseph T. Hupp; Omar K. Farha; Chad A. Mirkin An exceptionally high boron content supramolecular cuboctahedron Chem.Commun., 2013, 49, 11485 |
| 7115755 | CIF | C32 H34 N2 | R -3 | 23.567; 23.567; 12.095 90; 90; 120 | 5817.6 | Di Wu; Yongxin Li; Rakesh Ganguly; Rei Kinjo Synthesis and structural characterization of a C4 cumulene including 4-pyridylidene units, and its reactivity towards ammonia-borane Chem.Commun., 2014, 50, 12378 |
| 7115756 | CIF | C32 H36 N2 | R -3 | 23.7045; 23.7045; 11.91 90; 90; 120 | 5795.7 | Di Wu; Yongxin Li; Rakesh Ganguly; Rei Kinjo Synthesis and structural characterization of a C4 cumulene including 4-pyridylidene units, and its reactivity towards ammonia-borane Chem.Commun., 2014, 50, 12378 |
| 7117019 | CIF | C36 H24 Co3 Mn3 N17 Na O19 | R -3 | 17.343; 17.343; 31.6652 90; 90; 120 | 8248.2 | Jiang Liu; Mei Qu; Rodolphe Clerac; Xian Ming Zhang A two-dimensional honeycomb coordination network based on fused triacontanuclear heterometallic {Co12Mn18} wheels Chem.Commun., 2015, 51, 7356 |
| 7117210 | CIF | C67.99 H56.99 F11.99 N14 O P2 Ru | R -3 | 17.6408; 17.6408; 44.355 90; 90; 120 | 11953.9 | E. Rousset; D. Chartrand; I. Ciofini; V. Marvaud; G. S. Hanan Red-light-driven photocatalytic hydrogen evolution using a ruthenium quaterpyridine complex Chem.Commun., 2015, 51, 9261 |
| 7117766 | CIF | C168 H162 Ag3 F18 N18 P3 | R -3 | 35.4661; 35.4661; 26.194 90; 90; 120 | 28534 | Mejuto, Carmen; Guisado-Barrios, Gregorio; Gusev, Dmitry; Peris, Eduardo First homoleptic MIC and heteroleptic NHC-MIC coordination cages from 1,3,5-triphenylbenzene-bridged tris-MIC and tris-NHC ligands. Chemical communications (Cambridge, England), 2015, 51, 13914-13917 |
| 7118344 | CIF | C184 H162 Co6 Mn6 N24 O32 S8 | R -3 | 23.1209; 23.1209; 27.281 90; 90; 120 | 12629.9 | Jeon, Ie-Rang; David Harris, T. An S = 12 semiquinoid radical-bridged Mn6 wheel complex assembled from an asymmetric redox-active bridging ligand. Chemical communications (Cambridge, England), 2016, 52, 1006-1008 |
| 7120318 | CIF | C67 H87 Al K N6 P3 | R -3 | 18.394; 18.394; 33.9598 90; 90; 120 | 9950.6 | Lemp, Otfried; Balmer, Markus; Reiter, Kevin; Weigend, Florian; von Hänisch, Carsten An NHC‒phosphinidenyl as a synthon for new group 13/15 compounds Chem. Commun., 2017 |
| 7120357 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 26.055; 26.055; 14.824 90; 90; 120 | 8715.2 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120358 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.68; 25.68; 14.745 90; 90; 120 | 8421 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120359 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.963; 25.963; 14.808 90; 90; 120 | 8644 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120360 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.585; 25.585; 14.734 90; 90; 120 | 8353 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120361 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.473; 25.473; 14.735 90; 90; 120 | 8280 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120362 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.514; 25.514; 14.737 90; 90; 120 | 8308 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120363 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.999; 25.999; 14.815 90; 90; 120 | 8673 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120364 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.94; 25.94; 14.801 90; 90; 120 | 8625 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120365 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.543; 25.543; 14.731 90; 90; 120 | 8324 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120366 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.5; 25.5; 14.736 90; 90; 120 | 8298 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120367 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.3984; 25.3984; 14.7341 90; 90; 120 | 8231.3 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120368 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 26.01; 26.01; 14.817 90; 90; 120 | 8681 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120369 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.9; 25.9; 14.79 90; 90; 120 | 8592 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120370 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.525; 25.525; 14.733 90; 90; 120 | 8313 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120371 | CIF | C108 H84 Fe3 N42 S6 | R -3 | 25.986; 25.986; 14.814 90; 90; 120 | 8663 | Pittala, Narsimhulu; Thétiot, Franck; Charles, Catherine; Triki, Smail; Boukheddaden, Kamel; Chastanet, Guillaume; Marchivie, Mathieu Unprecedented trinuclear FeII triazole-based complex exhibiting a concerted and complete sharp spin transition above room temperature Chem. Commun., 2017 |
| 7120622 | CIF | C74 H118 Ca2 I2 N4 O4 | R -3 | 29.2848; 29.2848; 23.2122 90; 90; 120 | 17239.8 | Causero, Andrea; Elsen, Holger; Ballmann, Gerd; Escalona, Ana; Harder, Sjoerd Calcium stilbene complexes: structures and dual reactivity Chem. Commun., 2017 |
| 7121005 | CIF | C36 H33 Cl Cu N7 | R -3 | 13.2938; 13.2938; 31.3861 90; 90; 120 | 4803.6 | Dahl, E. W.; Dong, H. T.; Szymczak, N. K. Phenylamino derivatives of tris(2-pyridylmethyl)amine: hydrogen-bonded peroxodicopper complexes Chemical Communications, 2018 |
| 7121141 | CIF | C2.5 H4.25 Mn0.5 N0.5 O2.75 P0.5 | R -3 | 28.9848; 28.9848; 5.5266 90; 90; 120 | 4021 | Yang, Yang; Gao, Chaoying; Tian, Hong-Rui; Ai, Jing; Min, Xue; Sun, Zhong-Ming A highly stable MnII phosphonate as highly efficient catalyst for CO2 fixation under ambient conditions Chemical Communications, 2018 |
| 7121550 | CIF | C26 H23 B | R -3 | 33.652; 33.652; 8.379 90; 90; 120 | 8218 | Ando, Naoki; Kushida, Tomokatsu; Yamaguchi, Shigehiro A planarized B-phenyldibenzoborepin: Impacts of the structural constraint on its electronic properties and Lewis acidity Chemical Communications, 2018 |
| 7121900 | CIF | C12 H12 N2 O2 | R -3 | 28.7013; 28.7013; 6.9232 90; 90; 120 | 4939 | Bao, Wen; Wang, Jun-Qi; Xu, Xuetao; Zhang, Bang-Hong; Liu, Wei-Ting; Lei, Lin-Sheng; Liang, Huan; Zhang, Kun; Wang, Shao-Hua Copper-Catalyzed Cyclization of 2-Cyanobenzaldehydes and 2-Isocyanoacetates: an Efficient Strategy for the Synthesis of Substituted 1-Aminoisoquinolines Chemical Communications, 2018 |
| 7122876 | CIF | C38 H46 Mo N16 Ni2 O | R -3 | 33.6548; 33.6548; 24.819 90; 90; 120 | 24345 | Kempe, David Kenneth; Dolinar, Brian; Vignesh, Kuduva R.; Woods, Toby; Saber, Mohamed R.; Dunbar, Kim R. A cyanide-bridged wheel featuring a seven-coordinate Mo(III) center Chemical Communications, 2019 |
| 7123263 | CIF | C78 H90 Li6 O6 Si6 | R -3 | 12.1176; 12.1176; 44.8866 90; 90; 120 | 5707.96 | Weisheim, Eugen; Weigel, Simon; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Trifunctional organometallic frameworks and cages based on all-cis-1,3,5-triethynyl-1,3,5-trisilacyclohexanes Chemical Communications, 2019 |
| 7155317 | CIF | C128 H82 F12 N10 O8 P2 | R -3 | 31.334; 31.334; 27.064 90; 90; 120 | 23012 | Wang, Han-Xiao; Hu, Shu-Zhen; Shi, Qiang; Chen, Chuan-Feng Complexation between a triptycene-derived oxacalixarene and π-extended viologens: linker-length-dependent orientation of the macrocycles in pseudo[3]rotaxanes. Organic & biomolecular chemistry, 2016, 14, 10481-10488 |
| 7155953 | CIF | C28.33 H30 N2 S | R -3 | 35.4337; 35.4337; 9.6326 90; 90; 120 | 10473.9 | He, Wei; Zhuang, Junpeng; Du, Hongguang; Yang, Zhanhui; Xu, Jiaxi Stereochemistry and mechanistic insights in the [2t + 2i + 2i] annulations of thioketenes and imines Org. Biomol. Chem., 2017 |
| 7156032 | CIF | C23 H17 Cl N2 O3 S2 | R -3 | 31.822; 31.822; 13.3046 90; 90; 120 | 11667.8 | Ma, Fanghui; Qian, Jing; Lu, Ping; Wang, Yanguang Convenient Synthesis of 2-Amino-3-(arylthio)indoles via Rh-Catalyzed Reaction of 3-Diazoindol-2-imines with Thioesters Organic & Biomolecular Chemistry, 2017 |
| 7214268 | CIF | C162 H84 Br12 F30 N18 Zn6 | R -3 | 38.394; 38.394; 11.5576 90; 90; 120 | 14755 | Constable, Edwin C.; Housecroft, Catherine E.; Vujovic, Srboljub; Zampese, Jennifer A. Metallohexacycles containing 4′-aryl-4,2′:6′,4′′-terpyridines: conformational preferences and fullerene capture CrystEngComm, 2014, 16, 328 |
| 7223522 | CIF | C122 H130 Dy2 N4 Ni2 O24 | R -3 | 38.159; 38.159; 18.7654 90; 90; 120 | 23664 | Griffiths, Kieran; Dokorou, Vassiliki N.; Spencer, John; Abdul-Sada, Alaa; Vargas, Alfredo; Kostakis, George E. Isoskeletal Schiff base polynuclear coordination clusters: synthetic and theoretical aspects CrystEngComm, 2016, 18, 704 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!