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 |
|---|---|---|---|---|---|---|
| 7150608 | CIF | C22 H12 N2 S2 | P b c n | 21.4777; 10.0334; 7.525 90; 90; 90 | 1621.6 | Rahanyan, Nelli; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S. Diels–Alder reactions of 3,6-disubstituted 1,2,4,5-tetrazines. Synthesis and X-ray crystal structures of diazafluoranthene derivatives Organic & Biomolecular Chemistry, 2009, 7, 2082-2092 |
| 7151034 | CIF | C18 H18 O | P b c n | 8.8975; 12.1847; 24.8677 90; 90; 90 | 2696 | Iqbal, Mazhar; Duffy, Patricia; Evans, Paul; Cloughley, George; Allan, Bernard; Lledó, Agustí; Verdaguer, Xavier; Riera, Antoni The conjugate addition–Peterson olefination reaction for the preparation of cross-conjugated cyclopentenone, PPAR-γ ligands Organic & Biomolecular Chemistry, 2008, 6, 4649-4661 |
| 7151120 | CIF | C24 H28 F2 O9 | P b c n | 13.7696; 8.3551; 20.4951 90; 90; 90 | 2357.89 | Wallner, Fredrik K.; Spjut, Sara; Boström, Dan; Elofsson, Mikael Synthesis and evaluation of 2-(2-fluoro-4-hydroxymethyl-5-methoxy-phenoxy)acetic acid as a linker in solid-phase synthesis monitored by gel-phase (19)F NMR spectroscopy. Organic & biomolecular chemistry, 2007, 5, 2464-2471 |
| 7151139 | CIF | C19 H21 N O6 | P b c n | 14.913; 15.95; 14.25 90; 90; 90 | 3389.5 | Boyd, Derek R.; Sharma, Narain D.; Loke, Pui L.; Malone, John F.; McRoberts, W. Colin; Hamilton, John T. G. Synthesis, structure and stereochemistry of quinoline alkaloids from Choisya ternata. Organic & biomolecular chemistry, 2007, 5, 2983-2991 |
| 7151159 | CIF | C12 H12 Br N O2 S | P b c n | 16.5525; 10.1393; 14.0826 90; 90; 90 | 2363.49 | Harling, John D.; Steel, Patrick G.; Woods, Tom M.; Yufit, Dmitry S. One-pot synthesis of benzothiazolines and napthathiazolines via cascade ortho-lithiation, cyclisation and elimination of N-arylsulfonyl lactams. Organic & biomolecular chemistry, 2007, 5, 3472-3476 |
| 7151215 | CIF | C20 H14 I3 N O | P b c n | 17.213; 14.912; 15.658 90; 90; 90 | 4019.1 | Clayden, Jonathan; Vallverdú, Lluís; Helliwell, Madeleine Conformational communication between the Ar-CO and Ar-N axes in 2,2'-disubstituted benzanilides and their derivatives. Organic & biomolecular chemistry, 2006, 4, 2106-2118 |
| 7151252 | CIF | C24 H18 N6 O | P b c n | 13.111; 10.123; 14.928 90; 90; 90 | 1981.3 | Skene, W. G.; Berl, Volker; Risler, Hélène; Khoury, Richard; Lehn, Jean-Marie Selective product amplification of thymine photodimer by recognition-directed supramolecular assistance. Organic & biomolecular chemistry, 2006, 4, 3652-3663 |
| 7151332 | CIF | C45 H30 N4 Ni O2 | P b c n | 17.0768; 14.1377; 27.7514 90; 90; 90 | 6699.9 | Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski Photochemical preparation of pyrrole ring-contracted chlorins by the Wolff rearrangement Organic & Biomolecular Chemistry, 2006, 4, 4059 |
| 7151333 | CIF | C45 H30 Cu N4 O2 | P b c n | 17.074; 14.209; 27.882 90; 90; 90 | 6764.3 | Tillmann Köpke; Maren Pink; Jeffrey M. Zaleski Photochemical preparation of pyrrole ring-contracted chlorins by the Wolff rearrangement Organic & Biomolecular Chemistry, 2006, 4, 4059 |
| 7151968 | CIF | C32 H42 N O2 P Si | P b c n | 46.284; 12.2793; 11.1201 90; 90; 90 | 6319.9 | Oberg, Elisabet; Geng, Xue-Li; Santoni, Marie-Pierre; Ott, Sascha C,C-Diacetylenic phosphaalkenes in palladium-catalyzed cross-coupling reactions. Organic & biomolecular chemistry, 2011, 9, 6246-6255 |
| 7152234 | CIF | C66 H100 Ag2 F12 O16 P2 | P b c n | 14.6967; 21.036; 23.8819 90; 90; 90 | 7383.3 | Helttunen, Kaisa; Moridi, Negar; Shahgaldian, Patrick; Nissinen, Maija Resorcinarene bis-crown silver complexes and their application as antibacterial Langmuir-Blodgett films. Organic & biomolecular chemistry, 2012, 10, 2019-2025 |
| 7152330 | CIF | C59 H78 Cl2 O10 | P b c n | 42.526; 15.758; 16.686 90; 90; 90 | 11182 | Shu, Xiaoyan; Fan, Jiazeng; Li, Jian; Wang, Xiaoyang; Chen, Wei; Jia, Xueshun; Li, Chunju Complexation of neutral 1,4-dihalobutanes with simple pillar[5]arenes that is dominated by dispersion forces. Organic & biomolecular chemistry, 2012, 10, 3393-3397 |
| 7152601 | CIF | C28 H30 O | P b c n | 7.6851; 16.8705; 16.3611 90; 90; 90 | 2121.24 | Posavec, Damir; Zabel, Manfred; Bogner, Udo; Bernhardt, Günther; Knör, Günther Functionalized derivatives of 1,4-dimethylnaphthalene as precursors for biomedical applications: synthesis, structures, spectroscopy and photochemical activation in the presence of dioxygen. Organic & biomolecular chemistry, 2012, 10, 7062-7069 |
| 7152904 | CIF | C14 H20 N2 O2 | P b c n | 15.663; 8.2891; 21.056 90; 90; 90 | 2733.7 | Li, Guang; Zhang, Xun; Li, Qi; Feng, Pengju; Shi, Yian A concise approach to the spiroiminal fragment of marineosins. Organic & biomolecular chemistry, 2013, 11, 2936-2938 |
| 7152925 | CIF | C11 H19 N O2 | P b c n | 9.7809; 11.4606; 20.8757 90; 90; 90 | 2340.06 | Jones, Roderick C.; Herasymchuk, Khrystyna; Mahdi, Tayseer; Petrov, Anna; Resanović, Sanja; Vaughan, Douglas G.; Lough, Alan J.; Quail, J. Wilson; Koivisto, Bryan D.; Wylie, R. Stephen; Gossage, Robert A. Tautomerism and metal complexation of 2-acylmethyl-2-oxazolines: a combined synthetic, spectroscopic, crystallographic and theoretical treatment. Organic & biomolecular chemistry, 2013, 11, 3484-3493 |
| 7153432 | CIF | C7 H5 N O2 | P b c n | 5.1445; 14.134; 8.0639 90; 90; 90 | 586.35 | McNab, Hamish; Montgomery, James; Parsons, Simon; Tredgett, David G. Pyrrolizine-1,3-dione. Organic & biomolecular chemistry, 2010, 8, 4383-4387 |
| 7153511 | CIF | C18 H29 N O9 | P b c n | 15.652; 10.174; 28.07 90; 90; 90 | 4470 | Girard, Emeline; Desvergnes, Valérie; Tarnus, Céline; Landais, Yannick Desymmetrization of 7-dimethylphenylsilylcycloheptatriene. Towards the synthesis of new aminocycloheptitols. Organic & biomolecular chemistry, 2010, 8, 5628-5634 |
| 7153712 | CIF | C38 H28 N4 O4 | P b c n | 23.3123; 14.7753; 18.256 90; 90; 90 | 6288.21 | Ueta, Shoko; Hida, Kazuo; Nishiuchi, Masaki; Kawamura, Yasuhiko Regioisomeric allene dimer formation by the reaction of tetraarylbutatrienes with tetracyanoethene. Organic & biomolecular chemistry, 2014, 12, 2784-2791 |
| 7154509 | CIF | C17 H11 Cl2 N | P b c n | 21.3422; 8.1975; 8.0145 90; 90; 90 | 1402.16 | Reimann, Sebastian; Parpart, Silvio; Ehlers, Peter; Sharif, Muhammad; Spannenberg, Anke; Langer, Peter Synthesis of tetraarylpyridines by chemo-selective Suzuki-Miyaura reactions of 3,5-dibromo-2,6-dichloropyridine. Organic & biomolecular chemistry, 2015, 13, 6832-6838 |
| 7154549 | CIF | C19 H17 B Br Cl2 F2 N3 O2 | P b c n | 14.8291; 12.6719; 21.3493 90; 90; 90 | 4011.81 | Kand, Dnyaneshwar; Saha, Tanmoy; Lahiri, Mayurika; Talukdar, Pinaki Lysosome targeting fluorescence probe for imaging intracellular thiols. Organic & biomolecular chemistry, 2015, 13, 8163-8168 |
| 7154826 | CIF | C8 H12 F4 O | P b c n | 18.859; 10.647; 8.927 90; 90; 90 | 1792 | Bykova, Tetiana; Al-Maharik, Nawaf; Slawin, Alexandra M. Z.; O'Hagan, David Multicomponent reactions of methyl substituted all-cis tetrafluorocyclohexane aldehydes. Organic & biomolecular chemistry, 2016, 14, 1117-1123 |
| 7155036 | CIF | C20 H14 N4 | P b c n | 11.1295; 11.4081; 12.1912 90; 90; 90 | 1547.9 | Maroń, Anna; Szlapa, Agata; Klemens, Tomasz; Kula, Slawomir; Machura, Barbara; Krompiec, Stanisław; Małecki, Jan Grzegorz; Switlicka-Olszewska, Anna; Erfurt, Karol; Chrobok, Anna Tuning the photophysical properties of 4'-substituted terpyridines - an experimental and theoretical study. Organic & biomolecular chemistry, 2016, 14, 3793-3808 |
| 7155403 | CIF | C16 H10 Cl2 N2 O2 | P b c n | 13.5987; 7.2344; 13.7418 90; 90; 90 | 1351.9 | Pereira, Raul; Pfeifer, Lukas; Fournier, Jean; Gouverneur, Véronique; Cvengroš, Ján Twisting the ethano-Tröger's base: the bisamide. Organic & biomolecular chemistry, 2017, 15, 628-633 |
| 7155507 | CIF | C17 H12 N2 O3 | P b c n | 25.356; 6.9395; 7.4967 90; 90; 90 | 1319.1 | Jeppesen, Anne; Nielsen, Bjarne E.; Larsen, Dennis; Akselsen, Olivia M.; Sølling, Theis I; Brock-Nannestad, Theis; Pittelkow, Michael Croconamides: a new dual hydrogen bond donating motif for anion recognition and organocatalysis. Organic & biomolecular chemistry, 2017, 15, 2784-2790 |
| 7155549 | CIF | C18 H18 N2 O3 | P b c n | 13.8048; 15.2327; 15.2102 90; 90; 90 | 3198.47 | Bai, Siyi; Chen, Xun; Hu, Xinwei; Deng, Yuanfu; Jiang, Huanfeng; Zeng, Wei An Ir(iii)-catalyzed aryl C-H bond carbenoid functionalization cascade: access to 1,3-dihydroindol-2-ones. Organic & biomolecular chemistry, 2017, 15, 3638-3647 |
| 7155630 | CIF | C16 H16 O2 | P b c n | 15.81826; 9.23296; 8.32936 90; 90; 90 | 1216.5 | Del Grosso, Alessandro; Galanopoulos, Lavrentis-Dimitrios; Chiu, Cookson K. C.; Clarkson, Guy J.; O′ Connor, Peter B.; Wills, Martin Strained alkynes derived from 2,2′-dihydroxy-1,1′-biaryls; synthesis and copper-free cycloaddition with azides Org. Biomol. Chem., 2017 |
| 7155970 | CIF | C24 H22 N2 O4 | P b c n | 19.2545; 15.5146; 13.4314 90; 90; 90 | 4012.3 | Secci, Francesco; Guillot, Régis; Aitken, David J.; Frongia, Angelo; Arca, Massimiliano; Sarais, Giorgia; Luridiana, Alberto; Martis, Alberto Acid-Catalyzed Reaction of 2-Hydroxycyclobutanone with Benzylic Alcohols Organic & Biomolecular Chemistry, 2017 |
| 7156283 | CIF | C10 H10 F2 N4 O8 | P b c n | 12.1505; 10.471; 10.2881 90; 90; 90 | 1308.9 | Zhang, Jian; Ling, Yi-Fei; Wang, Gui-Xiang; Zhang, Lin; Luo, Jun Synthesis of two new gem-fluoronitro containing tetranitroadamantanes and property comparison with their nitro and gem-dinitro analogues. Organic & biomolecular chemistry, 2018, 16, 4784-4788 |
| 7156359 | CIF | C23 H14 O2 | P b c n | 9.1068; 13.5461; 26.1677 90; 90; 90 | 3228.1 | Addepalli, Yesu; Yu, Zhimei; Ji, Jie; Zou, Cheng; Wang, Zhen; He, Yun Tandem Diels-Alder/oxidation-aromatization reactions involving 2-styrylchromones and arynes. Organic & biomolecular chemistry, 2018, 16, 6077-6085 |
| 7156506 | CIF | C6 H6 N8 O2 | P b c n | 8.0308; 7.8229; 12.8172 90; 90; 90 | 805.23 | Sun, Qi; Li, Xin; Lin, Qiuhan; Lu, Ming Tetracyclic pyrazine-fused furazans as insensitive energetic materials: syntheses, structures, and properties. Organic & biomolecular chemistry, 2018, 16, 8034-8037 |
| 7156599 | CIF | C16 H12 Br N | P b c n | 13.856; 6.4827; 28.807 90; 90; 90 | 2587.6 | Gattu, Radhakrishna; Mondal, Santa; Ali, Saghir; Khan, Abu T. Iodine monobromide catalysed regioselective synthesis of 3-arylquinolines from α-aminoacetophenones and trans-β-nitrostyrenes. Organic & biomolecular chemistry, 2019, 17, 347-353 |
| 7156601 | CIF | C16 H12 Br N | P b c n | 13.856; 6.4827; 28.807 90; 90; 90 | 2587.6 | Carlos, Andressa M. M.; Stieler, Rafael; Lüdtke, Diogo S Catalytic asymmetric synthesis of 3-aryl phthalides enabled by arylation-lactonization of 2-formylbenzoates. Organic & biomolecular chemistry, 2019, 17, 283-289 |
| 7156918 | CIF | C26 H24 O4 | P b c n | 11.9937; 11.8843; 30.2028 90; 90; 90 | 4305 | Sun, Wenxi; Peng, Cheng; Yao, Zhigang; Xu, Fan Diastereoselective synthesis of α-dicarbonyl cyclopropanes via a lanthanide amide-catalysed reaction. Organic & biomolecular chemistry, 2019, 17, 6620-6628 |
| 7157529 | CIF | C17 H17 F3 O2 | P b c n | 24.336; 7.1684; 16.7513 90; 90; 90 | 2922.3 | Terashima, Kyu; Kawasaki-Takasuka, Tomoko; Agou, Tomohiro; Kubota, Toshio; Yamazaki, Takashi Syntheses of α-CF<sub>3</sub>-α-quaternary ketones via p-quinone methides and their derivatization to compounds with successively congested stereogenic centers. Organic & biomolecular chemistry, 2020, 18, 4638-4644 |
| 7157644 | CIF | C21 H16 N2 O4 | P b c n | 17.6367; 13.5661; 14.5573 90; 90; 90 | 3483 | Sharma, Suraj; Dutta, Nibedita Baruah; Bhuyan, Mayurakhi; Das, Babulal; Baishya, Gakul <i>tert</i>-Butylhydroperoxide (TBHP) mediated oxidative cross-dehydrogenative coupling of quinoxalin-2(1<i>H</i>)-ones with 4-hydroxycoumarins, 4-hydroxy-6-methyl-2-pyrone and 2-hydroxy-1,4-naphthoquinone under metal-free conditions. Organic & biomolecular chemistry, 2020, 18, 6537-6548 |
| 7157735 | CIF | C40 H52 O11 | P b c n | 17.1752; 8.82114; 24.8611 90; 90; 90 | 3766.58 | Choo, Yvonne S. L.; Giamberini, Marta; Antonio, José; Waddell, Paul G.; Benniston, Andrew C. Functionalized fluorescent terephthalate monomers and their attempted polyester formation. Organic & biomolecular chemistry, 2020, 18, 8735-8745 |
| 7157812 | CIF | C8 H10 O4 S2 | P b c n | 10.1116; 12.9234; 7.4954 90; 90; 90 | 979.47 | Ichikawa, Yuki; Hiramatsu, Michiaki; Mita, Yusuke; Makishima, Makoto; Matsumoto, Yotaro; Masumoto, Yui; Muranaka, Atsuya; Uchiyama, Masanobu; Hashimoto, Yuichi; Ishikawa, Minoru <i>meta</i>-Non-flat substituents: a novel molecular design to improve aqueous solubility in small molecule drug discovery. Organic & biomolecular chemistry, 2021, 19, 446-456 |
| 7157910 | CIF | C22 H19 Br N4 O4 | P b c n | 23.3635; 9.5879; 17.6817 90; 90; 90 | 3960.82 | Conboy, Darren; Kielty, Patrick; Bear, Joseph C.; Cockcroft, Jeremy K.; Farràs, Pau; McArdle, Patrick; Singer, Richard J.; Smith, Dennis A.; Aldabbagh, Fawaz Ring-fused dimethoxybenzimidazole-benzimidazolequinone (DMBBQ): tunable halogenation and quinone formation using NaX/Oxone. Organic & biomolecular chemistry, 2021, 19, 2716-2724 |
| 7158011 | CIF | C23 H26 N2 | P b c n | 14.1551; 9.5932; 13.369 90; 90; 90 | 1815.41 | Jin, Jiang; Li, Yinghua; Xiang, Shiqun; Fan, Weibin; Guo, Shiwei; Huang, Deguang Selectfluor facilitated bridging of indoles to bis(indolyl)methanes using methyl <i>tert</i>-butyl ether as a new methylene precursor. Organic & biomolecular chemistry, 2021, 19, 4076-4081 |
| 7158045 | CIF | C42 H20 Cl8 F4 O4 Sb2 | P b c n | 11.179; 18.388; 19.517 90; 90; 90 | 4011.9 | You, Di; Zhou, Benyu; Hirai, Masato; Gabbaï, François P Distiboranes based on <i>ortho</i>-phenylene backbones as bidentate Lewis acids for fluoride anion chelation. Organic & biomolecular chemistry, 2021, 19, 4949-4957 |
| 7158262 | CIF | C33 H32 O | P b c n | 36.302; 17.985; 8.873 90; 90; 90 | 5793 | Feng, Yi-Man; Nie, Xiao-Di; Sun, Jian-Ting; Xu, Wen-Ke; Wei, Bang-Guo TMSOTf-mediated synthesis of skipped dienes through the addition of olefins to imines and semicyclic <i>N</i>,<i>O</i>-acetals. Organic & biomolecular chemistry, 2021, 19, 7883-7893 |
| 7158511 | CIF | C20 H14 Br N3 O | P b c n | 19.5352; 14.0585; 13.9778 90; 90; 90 | 3838.8 | Wang, Wang; Zou, Pei-Sen; Pang, Li; Lei, Yao; Huang, Zi-Yi; Chen, Nan-Ying; Mo, Dong-Liang; Pan, Cheng-Xue; Su, Gui-Fa Synthesis of spiroindolenine-3,3'-pyrrolo[2,1-<i>b</i>]quinazolinones through gold(I)-catalyzed dearomative cyclization of <i>N</i>-alkynyl quinazolinone-tethered indoles. Organic & biomolecular chemistry, 2022, 20, 2069-2074 |
| 7158917 | CIF | C34 H28 N2 O4 S | P b c n | 13.785; 14.0217; 29.4717 90; 90; 90 | 5696.6 | Dehghanpour Kalan, Reza; Amiri, Kamran; Rominger, Frank -; Balalaie, Saeed; Bijanzadeh, Hamid Reza Regio- and diastereoselective transition metal-free hydroalkylation of N-allenyl sulfonamides by push-pull 2-alkynylquinolines Organic & Biomolecular Chemistry, 2022 |
| 7158923 | CIF | C28 H24 N2 O5 | P b c n | 7.4851; 11.8514; 25.8916 90; 90; 90 | 2296.82 | Chaudhry, Mohammad T.; Patrick, Brian O.; Akine, Shigehisa; MacLachlan, Mark J. Noncooperative guest binding by metal-free [2 + 2] Schiff-base macrocycles Organic & Biomolecular Chemistry, 2022 |
| 7158926 | CIF | C52 H50 N6 O10 | P b c n | 17.0998; 18.8164; 29.2275 90; 90; 90 | 9404.1 | Chaudhry, Mohammad T.; Patrick, Brian O.; Akine, Shigehisa; MacLachlan, Mark J. Noncooperative guest binding by metal-free [2 + 2] Schiff-base macrocycles Organic & Biomolecular Chemistry, 2022 |
| 7159080 | CIF | C245.7 H233.7 Cl23.69 N40 O42 | P b c n | 25.12; 27.45; 40.02 90; 90; 90 | 27596 | Menke, Friedericke S.; Mazzier, Daniela; Wicher, Barbara; Allmendinger, Lars; Kauffmann, Brice; Maurizot, Victor; Huc, Ivan Molecular torsion springs: alteration of helix curvature in frustrated tertiary folds. Organic & biomolecular chemistry, 2023, 21, 1275-1283 |
| 7159717 | CIF | C11 H16 O3 | P b c n | 13.5552; 7.1623; 23.1013 90; 90; 90 | 2242.82 | Hussain, Akram; Sravanthi, Revoju; Katta, Sunitha; Ramachary, Dhevalapally B. Two-step, high-yielding total synthesis of antibiotic pyrones. Organic & biomolecular chemistry, 2024, 22, 554-560 |
| 7159735 | CIF | C28 H31 F2 N Si | P b c n | 19.9358; 15.8356; 15.2943 90; 90; 90 | 4828.34 | Trojan, Michal; Kučnirová, Kateřina; Bouzková, Šárka; Cvačka, Josef; Čejka, Jan; Tavčar, Gašper; Rybáčková, Markéta; Kvíčala, Jaroslav Quaternary ammonium fluorides and difluorosilicates as nucleophilic fluorination reagents. Organic & biomolecular chemistry, 2024, 22, 1047-1056 |
| 7159861 | CIF | C24 H20 N2 O7 S2 | P b c n | 15.7; 11.2137; 13.4533 90; 90; 90 | 2368.5 | Panday, Surabhi; Maity, Tapas; Bhatti, Pratibha; Laha, Joydev K. Direct access to pyrrole anhydrides <i>via</i> oxidative self-coupling of pyrrole carboxaldehydes. Organic & biomolecular chemistry, 2024, 22, 3045-3052 |
| 7160738 | CIF | C45 H36 O4 | P b c n | 34.0625; 15.8412; 29.0629 90; 90; 90 | 15682.1 | Xu, Zhongwei; Lei, Yu; Chang, Meng; Qiang, Ruihua; Hu, Qiong; Hu, Yimin Formation of complex cyclic compounds <i>via</i> a dehydrogenative Diels-Alder reaction. Organic & biomolecular chemistry, 2025, 23, 9330-9335 |
| 7160872 | CIF | C44 H97 Br N4 O12 | P b c n | 19.3063; 16.6092; 33.619 90; 90; 90 | 10780.3 | White, Lisa J.; Streather, Bree; Sutton, J. Mark; Rankin, Jennifer; Baker, Jennifer; Bennett, Charlotte; Wilson, Hollie B.; Hind, Charlotte K.; Hiscock, Jennifer R. Dicarboxylate and dicarboxylic acid appended supramolecular self-associating amphiphiles as antimicrobial agents against high priority bacterial pathogens. Organic & biomolecular chemistry, 2025 |
| 7200939 | CIF | C36.5 H35 Co N5 O4.5 | P b c n | 23.4552; 17.1577; 17.1153 90; 90; 90 | 6887.8 | Baudron, Stéphane A.; Salazar-Mendoza, Domingo; Hosseini, Mir Wais Combination of primary amide and dipyrrin for the elaboration of extended architectures built upon both coordination and hydrogen bonding CrystEngComm, 2009, 11, 1245 |
| 7201096 | CIF | C26 H28 N4 Ni O7 | P b c n | 14.894; 17.722; 10.154 90; 90; 90 | 2680.2 | Halder, Partha; Chakraborty, Biswarup; Banerjee, Priya Ranjan; Zangrando, Ennio; Paine, Tapan Kanti Role of α-hydroxycarboxylic acids in the construction of supramolecular assemblies of nickel(ii) complexes with nitrogen donor coligands CrystEngComm, 2009, 11, 2650 |
| 7201118 | CIF | C48 H38 N4 O8 Zn2 | P b c n | 20.621; 11.347; 20.071 90; 90; 90 | 4696 | Guo, Hua-Dong; Qiu, Dong-Fang; Guo, Xian-Min; Zheng, Guo-Li; Wang, Xiao; Dang, Song; Zhang, Hong-Jie Entangled metal‒organic frameworks modulated by N-donor ligands of different conformations CrystEngComm, 2009, 11, 2425 |
| 7201402 | CIF | C2 H Br Cl F O2 | P b c n | 16.458; 6.0708; 21.095 90; 90; 90 | 2107.7 | Gajda, Roman; Katrusiak, Andrzej; Crassous, Jeanne Pressure-controlled aggregation in carboxylic acids. A case study on the polymorphism of bromochlorofluoroacetic acid CrystEngComm, 2009, 11, 2668 |
| 7201403 | CIF | C2 H Br Cl F O2 | P b c n | 16.169; 6.0038; 20.971 90; 90; 90 | 2035.8 | Gajda, Roman; Katrusiak, Andrzej; Crassous, Jeanne Pressure-controlled aggregation in carboxylic acids. A case study on the polymorphism of bromochlorofluoroacetic acid CrystEngComm, 2009, 11, 2668 |
| 7201406 | CIF | C2 H Br Cl F O2 | P b c n | 15.274; 5.8537; 20.7562 90; 90; 90 | 1855.8 | Gajda, Roman; Katrusiak, Andrzej; Crassous, Jeanne Pressure-controlled aggregation in carboxylic acids. A case study on the polymorphism of bromochlorofluoroacetic acid CrystEngComm, 2009, 11, 2668 |
| 7201881 | CIF | C23 H16 N4 O4 | P b c n | 7.883; 9.292; 25.355 90; 90; 90 | 1857.2 | Ashmore, Jason; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L. Synthesis and inclusion properties of new nitrated C2− symmetric diquinoline hosts CrystEngComm, 2008, 10, 839 |
| 7201899 | CIF | C16 H17 N3 Ni O4 | P b c n | 16.316; 8.094; 23.421 90; 90; 90 | 3093 | Brown, Kyalamboka A.; Martin, David P.; Supkowski, Ronald M.; LaDuca, Robert L. Two- and three-dimensional divalent metal coordination polymers constructed from 2,2-dimethylsuccinate and dipyridylamine ligands CrystEngComm, 2008, 10, 846 |
| 7202074 | CIF | C58 H46 Si | P b c n | 17.034; 10.422; 24.427 90; 90; 90 | 4336 | Zhan, Xiaowei; Haldi, Andreas; Risko, Chad; Chan, Calvin K.; Zhao, Wei; Timofeeva, Tatiana V.; Korlyukov, Aleksander; Antipin, Mikhail Yu.; Montgomery, Sarah; Thompson, Evans; An, Zesheng; Domercq, Benoit; Barlow, Stephen; Kahn, Antoine; Kippelen, Bernard; Brédas, Jean-Luc; Marder, Seth R. Fluorenyl-substituted silole molecules: geometric, electronic, optical, and device properties Journal of Materials Chemistry, 2008, 18, 3157 |
| 7202116 | CIF | C38 H40 Cu3 N8 O17 | P b c n | 11.7668; 16.821; 20.579 90; 90; 90 | 4073.2 | Zhang, Lai-Ping; Yang, Jin; Ma, Jian-Fang; Jia, Zhi-Fang; Xie, Yun-Peng; Wei, Guo-Hua A series of 2D and 3D metal‒organic frameworks based on different polycarboxylate anions and a flexible 2,2′-bis(1H-imidazolyl)ether ligand CrystEngComm, 2008, 10, 1410 |
| 7202262 | CIF | C14 H12 O6 S2 | P b c n | 5.5518; 19.8748; 39.87 90; 90; 90 | 4399.3 | Mondal, Pallab; Karmakar, Anirban; Singh, W. Marjit; Baruah, Jubaraj B. Crystal packing in some flexible carboxylic acids and esters attached to a naphthalene ring CrystEngComm, 2008, 10, 1550 |
| 7202319 | CIF | C46 H45 Mn N18 O0.5 | P b c n | 24.958; 24.637; 8.1686 90; 90; 90 | 5022.8 | Du, Miao; Zhang, Zhi-Hui; Wang, Xiu-Guang; Tang, Liang-Fu; Zhao, Xiao-Jun Structural modulation of polythreading and interpenetrating coordination networks with an elongated dipyridyl building block and various anionic co-ligands CrystEngComm, 2008, 10, 1855 |
| 7202320 | CIF | C46 H48 N18 Ni O2 | P b c n | 24.893; 24.682; 8.1486 90; 90; 90 | 5006.6 | Du, Miao; Zhang, Zhi-Hui; Wang, Xiu-Guang; Tang, Liang-Fu; Zhao, Xiao-Jun Structural modulation of polythreading and interpenetrating coordination networks with an elongated dipyridyl building block and various anionic co-ligands CrystEngComm, 2008, 10, 1855 |
| 7202325 | CIF | C44 H44 Co N14 S2 | P b c n | 24.758; 24.387; 8.2917 90; 90; 90 | 5006.3 | Du, Miao; Zhang, Zhi-Hui; Wang, Xiu-Guang; Tang, Liang-Fu; Zhao, Xiao-Jun Structural modulation of polythreading and interpenetrating coordination networks with an elongated dipyridyl building block and various anionic co-ligands CrystEngComm, 2008, 10, 1855 |
| 7202401 | CIF | C15 H13 N2 Nd O8 | P b c n | 16.39; 10.085; 10.35 90; 90; 90 | 1710.8 | Liu, Cai-Ming; Zuo, Jing-Lin; Zhang, De-Qing; Zhu, Dao-Ben Carboxylic acid-dependent assembly of neodymium‒organic frameworks with attractive topologies and second-order nonlinear optical and/or magnetic properties CrystEngComm, 2008, 10, 1674 |
| 7202403 | CIF | C14 H11 N2 Nd O8 | P b c n | 16.652; 9.474; 10.332 90; 90; 90 | 1630 | Liu, Cai-Ming; Zuo, Jing-Lin; Zhang, De-Qing; Zhu, Dao-Ben Carboxylic acid-dependent assembly of neodymium‒organic frameworks with attractive topologies and second-order nonlinear optical and/or magnetic properties CrystEngComm, 2008, 10, 1674 |
| 7202441 | CIF | C12 H14 Cd Cl4 N2 O | P b c n | 7.2994; 7.4104; 30.527 90; 90; 90 | 1651.3 | Costin-Hogan, Christina E.; Chen, Chun-Long; Hughes, Emma; Pickett, Austin; Valencia, Richard; Rath, Nigam P.; Beatty, Alicia M. “Reverse” engineering: Toward 0-D cadmium halide clusters CrystEngComm, 2008, 10, 1910 |
| 7202552 | CIF | C16 H12 Cd N14 | P b c n | 13.3982; 7.7207; 19.1997 90; 90; 90 | 1986.08 | Jana, Atish Dipankar; Ghosh, Ananta Kumar; Ghoshal, Debajyoti; Mostafa, Golam; Chaudhuri, Nirmalendu Ray Towards rational design of supramolecular helices using linear pseudohalides in Cd(ii) - 2,2?-biimidazole system CrystEngComm, 2007, 9, 304 |
| 7202576 | CIF | C20 H18 N2 O4 S3 | P b c n | 17.039; 18.642; 13.69 90; 90; 90 | 4349 | Marie Bourgeaux; Sergio Andrés Pérez Guarìn; W. G. Skene Photophysical, crystallographic, and electrochemical characterization of novel conjugated thiopheno azomethines Journal of Materials Chemistry, 2007, 17, 972 |
| 7202646 | CIF | C14 H11 F5 I N | P b c n | 7.5677; 16.7343; 11.6003 90; 90; 90 | 1469.06 | Aleksandra Wasilewska; Maria Gdaniec; Tadeusz Połoński Co-crystals of iodopentafluorobenzene with nitrogen donors: 2-D molecular assemblies through halogen bonding and aryl?perfluoroaryl interactions CrystEngComm, 2007, 9, 203 |
| 7202883 | CIF | C44 H34 N4 O17 Zn2 | P b c n | 13.0204; 20.3203; 15.8814 90; 90; 90 | 4201.9 | Cao, Xin-Yi; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yao, Yuan-Gen Scorpion-shaped carboxylate ligand tailored molecular square, bilayer, self-threading and (3,6)-connected nets CrystEngComm, 2007, 9, 806 |
| 7202932 | CIF | C20 H40 N4 O8 S8 Zn2 | P b c n | 29.62; 8.458; 13.838 90; 90; 90 | 3467 | Benson, Ronald E.; Ellis, Carol A.; Lewis, Clairissa E.; Tiekink, Edward R.T. 3D-, 2D- and 1D-supramolecular structures of {Zn[S2CN(CH2CH2OH)R]2}2 and their {Zn[S2CN(CH2CH2OH)R]2}2(4,4′-bipyridine) adducts for R = CH2CH2OH, Me or Et: polymorphism and pseudo-polymorphism CrystEngComm, 2007, 9, 930 |
| 7203083 | CIF | C46 H33 Fe2 N14 O2 S6 | P b c n | 13.1562; 20.3741; 18.8557 90; 90; 90 | 5054.19 | Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Neuburger, Markus; Price, David J.; Schaffner, Silvia The conjugate acid of bis{4′-(4-pyridyl)-2,2′:6′,2″-terpyridine}iron(ii) as a self-complementary hydrogen-bonded building block CrystEngComm, 2007, 9, 1073 |
| 7203084 | CIF | C48 H32 Fe2 N15 S6 | P b c n | 13.3057; 20.3495; 18.4014 90; 90; 90 | 4982.44 | Beves, Jonathon E.; Constable, Edwin C.; Housecroft, Catherine E.; Kepert, Cameron J.; Neuburger, Markus; Price, David J.; Schaffner, Silvia The conjugate acid of bis{4′-(4-pyridyl)-2,2′:6′,2″-terpyridine}iron(ii) as a self-complementary hydrogen-bonded building block CrystEngComm, 2007, 9, 1073 |
| 7203107 | CIF | C16 H18 Cl Mn N7 O4 | P b c n | 12.5606; 17.25; 18.1617 90; 90; 90 | 3935.1 | Karmakar, Tapan K.; Aromí, Guillem; Ghosh, Barindra K.; Usman, A.; Fun, Hoong-Kun; Mallah, Talal; Behrens, U.; Solans, Xavier; Chandra, Swapan K. Unexpected diversity and novel features within a family of new azide-bridged MnII complexes of pyridyl/imine ligands Journal of Materials Chemistry, 2006, 16, 278 |
| 7203181 | CIF | C6 H12 K2 N O10 P | P b c n | 12.529; 7.131; 31.914 90; 90; 90 | 2851.3 | Kuczek, Marian; Bryndal, Iwona; Lis, Tadeusz 4-Nitrophenyl phosphoric acid and its four different potassium salts: a solid state structure and kinetic study CrystEngComm, 2006, 8, 150 |
| 7203197 | CIF | C34 H34 N2 O2 | P b c n | 6.3316; 12.517; 33.042 90; 90; 90 | 2618.7 | Zeng, Qingdao; Wu, Dongxia; Ma, Hongwei; Shu, Chuying; Li, Yan; Wang, Chen Polymeric hydrogen-bonded supramolecules by self-assembling of adamantane derivatives with bipyridines CrystEngComm, 2006, 8, 189 |
| 7203288 | CIF | C52 H52 B2 Cu F8 N5 O0.5 S4 | P b c n | 16.743; 20.5911; 30.9059 90; 90; 90 | 10655 | Holmes, Kathryn E.; Kelly, Paul F.; Dale, Sophie H.; Elsegood, Mark R. J. New observations of structural diversity in copper(ii) complexes of diphenylsulfimide CrystEngComm, 2006, 8, 391 |
| 7203378 | CIF | C6 H10 Cu K2 O11 | P b c n | 7.3985; 18.83; 9.3201 90; 90; 90 | 1298.4 | Fernando S. Delgado; Catalina Ruiz-Pérez; Joaquín Sanchiz; Francesc Lloret; Miguel Julve Versatile supramolecular self-assembly. Part I. Network formation and magnetic behaviour of the alkaline salts of the bis(malonate)cuprate(<small>II</small>) anion CrystEngComm, 2006, 8, 507 |
| 7203407 | CIF | C9 H16 Cu N2 O8 | P b c n | 8.268; 16.9351; 9.4736 90; 90; 90 | 1326.49 | Fernando S. Delgado; Catalina Ruiz-Pérez; Joaquín Sanchiz; Francesc Lloret; Miguel Julve Part II. Network formation and magnetic behaviour of copper(<small>II</small>) malonate anions in ammonium derivatives CrystEngComm, 2006, 8, 530 |
| 7203579 | CIF | C44 H50 Cd N6 O7 | P b c n | 12.71; 25.181; 13.499 90; 90; 90 | 4320.4 | M. John Plater; Thomas Gelbrich; Michael B. Hursthouse; Ben M. De Silva Synthesis of co-ordination networks selecting from either (<i>R,R</i>), (<i>S,S</i>) and (<i>R,S</i>)-1,4- or -1,3-bis[2-(4-pyridyl)-2-methylethyl]benzene and a discrete complex from 1,4-bis[2-(3-pyridyl)-2-methyl-<i>cis</i>-ethenyl)]benzene CrystEngComm, 2006, 8, 895 |
| 7203584 | CIF | C46 H46 Co N18 O | P b c n | 24.958; 24.637; 8.1686 90; 90; 90 | 5022.8 | Du, Miao; Wang, Xiu-Guang; Zhang, Zhi-Hui; Tang, Liang-Fu; Zhao, Xiao-Jun Solvent-directed layered Co(ii) coordination polymers with unusual solid-state properties: from a nanoporous framework to the dense polythreading 3-D aggregation CrystEngComm, 2006, 8, 788 |
| 7203628 | CIF | C7 H9 Eu O9 S | P b c n | 15.868; 9.2; 14.955 90; 90; 90 | 2183.2 | Lu, Zhenda; Wen, Lili; Yao, Jing; Zhu, Huizhen; Meng, Qingjin Two types of novel layer framework structures assembled from 5-sulfosalicylic acid and lanthanide ions CrystEngComm, 2006, 8, 847 |
| 7203629 | CIF | C7 H9 Gd O9 S | P b c n | 15.874; 9.161; 14.936 90; 90; 90 | 2172 | Lu, Zhenda; Wen, Lili; Yao, Jing; Zhu, Huizhen; Meng, Qingjin Two types of novel layer framework structures assembled from 5-sulfosalicylic acid and lanthanide ions CrystEngComm, 2006, 8, 847 |
| 7203630 | CIF | C7 H9 Nd O9 S | P b c n | 15.861; 9.269; 14.971 90; 90; 90 | 2201 | Lu, Zhenda; Wen, Lili; Yao, Jing; Zhu, Huizhen; Meng, Qingjin Two types of novel layer framework structures assembled from 5-sulfosalicylic acid and lanthanide ions CrystEngComm, 2006, 8, 847 |
| 7203631 | CIF | C56 H72 O72 S8 Sm8 | P b c n | 15.877; 9.203; 14.958 90; 90; 90 | 2185.6 | Lu, Zhenda; Wen, Lili; Yao, Jing; Zhu, Huizhen; Meng, Qingjin Two types of novel layer framework structures assembled from 5-sulfosalicylic acid and lanthanide ions CrystEngComm, 2006, 8, 847 |
| 7203632 | CIF | C7 H9 O9 S Tb | P b c n | 15.882; 9.212; 14.969 90; 90; 90 | 2190 | Lu, Zhenda; Wen, Lili; Yao, Jing; Zhu, Huizhen; Meng, Qingjin Two types of novel layer framework structures assembled from 5-sulfosalicylic acid and lanthanide ions CrystEngComm, 2006, 8, 847 |
| 7203634 | CIF | C13 H20 Cl2 N4 O3 Zn | P b c n | 19.1929; 7.1978; 24.4277 90; 90; 90 | 3374.6 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi Hydrogen-bonded microporous network, helix and 1-D zigzag chains in MOFs of Zn(ii): studying the effects of ligating topologies, hydrogen bonding backbone and counter-anions CrystEngComm, 2006, 8, 805 |
| 7203635 | CIF | C11 H12 Cl2 N4 O2.98 Zn | P b c n | 18.3464; 6.8405; 24.146 90; 90; 90 | 3030.3 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi Hydrogen-bonded microporous network, helix and 1-D zigzag chains in MOFs of Zn(ii): studying the effects of ligating topologies, hydrogen bonding backbone and counter-anions CrystEngComm, 2006, 8, 805 |
| 7203650 | CIF | C12 H14 Cl2 N2 | P b c n | 27.4793; 6.028; 7.319 90; 90; 90 | 1212.36 | Łukasz Dobrzycki; Krzysztof Woźniak On polymorphism and planarity of benzidine dihydrochloride CrystEngComm, 2006, 8, 780 |
| 7203651 | CIF | C12 H14 Cl2 N2 | P b c n | 27.459; 6.0877; 7.3074 90; 90; 90 | 1221.5 | Łukasz Dobrzycki; Krzysztof Woźniak On polymorphism and planarity of benzidine dihydrochloride CrystEngComm, 2006, 8, 780 |
| 7203747 | CIF | C11 H9 O S | P b c n | 19.056; 7.536; 13.524 90; 90; 90 | 1942.1 | Leriche, Philippe; Frère, Pierre; Roncali, Jean Structure–reactivity relationships in bithiophenic precursors based on the 3-phenoxythiophene building block Journal of Materials Chemistry, 2005, 15, 3473 |
| 7203980 | CIF | Co F Na2 O4 P | P b c n | 5.2475; 13.795; 11.689 90; 90; 90 | 846.2 | Sanz, Francisca; Parada, Carmen; Ruíz-Valero, Caridad Crystal growth, crystal structure and magnetic properties of disodium cobalt fluorophosphate Journal of Materials Chemistry, 2001, 11, 208 |
| 7204144 | CIF | C16 H19 N7 O | P b c n | 38.754; 7.958; 20.954 90; 90; 90 | 6462 | Julian S. Northen; F. Thomas Boyle; William Clegg; Nicola J. Curtin; Andrew J. Edwards; Roger J. Griffin; Bernard T. Golding Controlled stepwise conversion of 2,4,6,8-tetrachloropyrimido[5,4-d]pyrimidine into 2,4,6,8-tetrasubstituted pyrimido[5,4-d]pyrimidines J. Chem. Soc., Perkin Trans. 1, 2002, 108-115 |
| 7204198 | CIF | C1.5 N O4.5 P Zn | P b c n | 22.9824; 7.6791; 6.6178 90; 90; 90 | 1167.94 | Choudhury, Amitava; Neeraj, S.; Natarajan, Srinivasan; Rao, C. N. R. Transformations of two-dimensional layered zinc phosphates to three-dimensional and one-dimensional structures Journal of Materials Chemistry, 2002, 12, 1044 |
| 7204586 | CIF | C20 H14 N4 | P b c n | 17.712; 8.7976; 9.7375 90; 90; 90 | 1517.3 | Dudd, Lucinda M.; Venardou, Eleni; Garcia-Verdugo, Eduardo; Licence, Peter; Blake, Alexander J.; Wilson, Claire; Poliakoff, Martyn Synthesis of benzimidazoles in high-temperature waterThis work was presented at the Green Solvents for Catalysis Meeting held in Bruchsal, Germany, 13‒16th October 2002.Electronic supplementary information (ESI) available: analytical data for compounds 3a‒f and 5g‒j. See http://www.rsc.org/suppdata/gc/b2/b212394k/ Green Chemistry, 2003, 5, 187 |
| 7204712 | CIF | C21 H18 O6 S3 | P b c n | 8.457; 18.553; 13.006 90; 90; 90 | 2040.7 | Tahir Khan; Joseph J. W. McDouall; Eric J. L. McInnes; Peter J. Skabara; Pierre Frère; Simon J. Coles; Michael B. Hursthouse A combined substituent and supramolecular approach for improving the electron donor properties of 1,3-dithiole-2-thione derivatives J. Mater. Chem., 2003, 13, 2490-2498 |
| 7204720 | CIF | C33 H34 N2 O4.5 | P b c n | 15.9821; 14.3963; 23.765 90; 90; 90 | 5467.9 | Nakamura, A.; Sato, T.; Kuroda, R. Novel layered structures of the crystals based on C-methylcalix[4]resorcinarene formed at high temperatureElectronic supplementary information (ESI) available: Structures of compounds 8, 9, 10 and 12 (4 figures). See http://www.rsc.org/suppdata/ce/b3/b307471d/ CrystEngComm, 2003, 5, 318 |
| 7204759 | CIF | C32 H82 N2 Nb2 O14 Sr | P b c n | 14.997; 16.743; 19.587 90; 90; 90 | 4918.2 | Jones, Anthony C.; Tobin, Neil L.; Marshall, Paul A.; Potter, Richard J.; Chalker, Paul R.; Bickley, Jamie F.; Davies, Hywel O.; Smith, Lesley M.; Critchlow, Gary W. Synthesis and characterisation of four new heterometal alkoxides: potential precursors for the MOCVD of ferroelectric oxides Journal of Materials Chemistry, 2004, 14, 887 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!