Crystallography Open Database
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Searching journal of publication like 'CrystEngComm'
COD ID  |
Links | Formula |
Space group  |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7238174 | CIF | C14 H10 Cl N O2 | A 1 | 3.9236; 25.948; 24.4812 90; 93.175; 90 | 2488.6 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Influence of the solvent of crystallization on the orientational disorder of (trans)-4-chloro-4′-nitrostilbene CrystEngComm, 2010, 12, 4101 |
| 7238177 | CIF | C14 H10 Cl N O2 | A 1 | 3.9239; 25.9466; 24.4796 90; 93.192; 90 | 2488.45 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Influence of the solvent of crystallization on the orientational disorder of (trans)-4-chloro-4′-nitrostilbene CrystEngComm, 2010, 12, 4101 |
| 7238186 | CIF | C14 H10 Cl N O2 | A 1 | 3.9227; 25.9528; 24.507 90; 93.2; 90 | 2491.05 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Influence of the solvent of crystallization on the orientational disorder of (trans)-4-chloro-4′-nitrostilbene CrystEngComm, 2010, 12, 4101 |
| 7238199 | CIF | C14 H10 Cl N O2 | A 1 | 3.9173; 25.9126; 24.4686 90; 93.151; 90 | 2479.99 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Influence of the solvent of crystallization on the orientational disorder of (trans)-4-chloro-4′-nitrostilbene CrystEngComm, 2010, 12, 4101 |
| 7238825 | CIF | C13 H9 Br N2 O2 | A 1 2 1 | 10.6408; 16.2706; 7.5669 90; 110.783; 90 | 1224.83 | Subashini, Ashokkumar; Leela, Sundararaman; Ramamurthi, Kandasamy; Arakcheeva, Alla; Stoeckli-Evans, Helen; Petříček, Vaclav; Chapuis, Gervais; Pattison, Philip; Reji, Philip Synthesis, growth and characterization of 4-bromo-4′-nitrobenzylidene aniline (BNBA): a novel nonlinear optical material with a (3+1)-dimensional incommensurately modulated structure CrystEngComm, 2013, 15, 2474 |
| 7238826 | CIF | C13 H9 Br N2 O2 | A 1 2 1 | 10.5217; 16.2535; 7.4403 90; 110.709; 90 | 1190.2 | Subashini, Ashokkumar; Leela, Sundararaman; Ramamurthi, Kandasamy; Arakcheeva, Alla; Stoeckli-Evans, Helen; Petříček, Vaclav; Chapuis, Gervais; Pattison, Philip; Reji, Philip Synthesis, growth and characterization of 4-bromo-4′-nitrobenzylidene aniline (BNBA): a novel nonlinear optical material with a (3+1)-dimensional incommensurately modulated structure CrystEngComm, 2013, 15, 2474 |
| 7208746 | CIF | Bi2.5 Na0.5 Nb2 O9 | A 21 a m | 5.48888; 5.4611; 24.9512 90; 90; 90 | 747.92 | Long, Changbai; Fan, Huiqing; Li, Mengmeng; Li, Qiang Effect of lanthanum and tungsten co-substitution on the structure and properties of new Aurivillius oxides Na0.5La0.5Bi2Nb2-xWxO9 CrystEngComm, 2012, 14, 7201 |
| 7208747 | CIF | Bi2 La0.5 Na0.5 Nb2 O9 | A 21 a m | 5.49254; 5.47896; 24.8632 90; 90; 90 | 748.22 | Long, Changbai; Fan, Huiqing; Li, Mengmeng; Li, Qiang Effect of lanthanum and tungsten co-substitution on the structure and properties of new Aurivillius oxides Na0.5La0.5Bi2Nb2-xWxO9 CrystEngComm, 2012, 14, 7201 |
| 7208748 | CIF | Bi2 La0.5 Na0.5 Nb1.972 O9 W0.023 | A 21 a m | 5.48754; 5.47967; 24.8523 90; 90; 90 | 747.31 | Long, Changbai; Fan, Huiqing; Li, Mengmeng; Li, Qiang Effect of lanthanum and tungsten co-substitution on the structure and properties of new Aurivillius oxides Na0.5La0.5Bi2Nb2-xWxO9 CrystEngComm, 2012, 14, 7201 |
| 7200497 | CIF | C30 H28 Cu N6 O8 S6 | A b a 2 | 20.144; 16.6614; 10.5603 90; 90; 90 | 3544.3 | Carballo, Rosa; Covelo, Berta; Fernández-Hermida, Nuria; Lago, Ana B.; Vázquez-López, Ezequiel M. From copper(II) carboxylate to copper(II) 4-pyridylsulfonate coordination polymers as a consequence of the copper(II)-assisted oxidative cleavage of the 4,4'-dipyridyldisulfide ligand CrystEngComm, 2009, 11, 817-826 |
| 7200705 | CIF | C39 H48 Cl4 N12 O4 Zn2 | A b a 2 | 12.9497; 41.02; 8.8874 90; 90; 90 | 4721 | Liang, Jianjun; Wu, Biao; Jia, Chuandong; Yang, Xiao-Juan Metallomacrocycle or helix: Supramolecular isomerism in bis(pyridylurea) metal complexes CrystEngComm, 2009, 11, 975 |
| 7200706 | CIF | C40 H50 Cl4 N12 O4 Zn2 | A b a 2 | 12.965; 40.535; 8.8052 90; 90; 90 | 4627.5 | Liang, Jianjun; Wu, Biao; Jia, Chuandong; Yang, Xiao-Juan Metallomacrocycle or helix: Supramolecular isomerism in bis(pyridylurea) metal complexes CrystEngComm, 2009, 11, 975 |
| 7201691 | CIF | C16 H15 N O3 | A b a 2 | 15.4037; 13.4121; 13.2831 90; 90; 90 | 2744.23 | Munshi, Parthapratim; Skelton, Brian W.; McKinnon, Joshua J.; Spackman, Mark A. Polymorphism in 3-methyl-4-methoxy-4′-nitrostilbene (MMONS), a highly active NLO material CrystEngComm, 2008, 10, 197 |
| 7201896 | CIF | C16 H17 Cd N3 O4 | A b a 2 | 17.076; 16.577; 11.809 90; 90; 90 | 3343 | 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 |
| 7202281 | CIF | C15 H13 N3 O4 Zn | A b a 2 | 16.846; 16.926; 11.193 90; 90; 90 | 3192 | Brown, Kyalamboka A.; Martin, David P.; LaDuca, Robert L. An acentric parallel interpenetrated dual-ligand zinc coordination polymer from an in situ terminal-to-internal alkene rearrangement CrystEngComm, 2008, 10, 1305 |
| 7202870 | CIF | C28 H24 N6 O4 Zn | A b a 2 | 12.598; 18.483; 10.818 90; 90; 90 | 2519 | Barbazán, Paula; Carballo, Rosa; Vázquez-López, Ezequiel M. Synthesis and structure of 2-acetylpyridine-salicyloylhydrazone and its copper(ii) and zinc(ii) complexes. The effect of the metal coordination on the weak intermolecular interactions CrystEngComm, 2007, 9, 668 |
| 7205428 | CIF | C18 H4 F10 O6 | A b a 2 | 16.3233; 9.9385; 10.9883 90; 90; 90 | 1782.62 | Dikundwar, Amol G.; Venkateswarlu, Ch.; Piltz, Ross O.; Chandrasekaran, Srinivasan; Guru Row, Tayur N. Crystal structures of fluorinated aryl biscarbonates and a biscarbamate: a counterpoise between weak intermolecular interactions and molecular symmetry CrystEngComm, 2011, 13, 1531 |
| 7205429 | CIF | C18 H4 F10 O6 | A b a 2 | 16.3233; 9.9385; 10.9883 90; 90; 90 | 1782.62 | Dikundwar, Amol G.; Venkateswarlu, Ch.; Piltz, Ross O.; Chandrasekaran, Srinivasan; Guru Row, Tayur N. Crystal structures of fluorinated aryl biscarbonates and a biscarbamate: a counterpoise between weak intermolecular interactions and molecular symmetry CrystEngComm, 2011, 13, 1531 |
| 7206818 | CIF | C41 H28 N4 O8 Zn2 | A b a 2 | 14.687; 18.524; 16.622 90; 90; 90 | 4522 | Xiong, Shunshun; Li, Shujuan; Wang, Sujing; Wang, Zhiyong Multi-functional metal‒organic frameworks based on H4mdip: Crystal structure, photoluminescence, selective ion-exchange and catalysis CrystEngComm, 2011, 13, 7236 |
| 7206903 | CIF | C50 H50 N8 Ni O8 | A b a 2 | 19.562; 15.8621; 15.3525 90; 90; 90 | 4763.8 | Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm, 2012, 14, 561 |
| 7207331 | CIF | C14 H12 Ag2 N8 S2 | A b a 2 | 12.2275; 21.7867; 7.0262 90; 90; 90 | 1871.76 | Bai, Yan; Wang, Jun-Li; Dang, Dong-Bin; Li, Meng-Meng; Niu, Jing-Yang Assembly of four d10-metal inorganic‒organic hybrid coordination polymers based on bipyrazine imine-based ligand: Synthesis, crystal structures and luminescent properties CrystEngComm, 2012, 14, 1575 |
| 7208721 | CIF | C64 H60 N8 Ni O3 | A b a 2 | 11.4027; 23.4885; 22.6238 90; 90; 90 | 6059.4 | Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm, 2012, 14, 6492 |
| 7208722 | CIF | C68 H68 Cl4 N8 Ni2 O2 | A b a 2 | 11.6264; 24.3482; 22.2375 90; 90; 90 | 6295.03 | Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm, 2012, 14, 6492 |
| 7208723 | CIF | C64 H62.8 Br2 N8 Ni O3.4 | A b a 2 | 11.4808; 23.4663; 22.5673 90; 90; 90 | 6079.9 | Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm, 2012, 14, 6492 |
| 7208728 | CIF | C66 H61.6 I2 N8 Ni O2.8 | A b a 2 | 23.8271; 11.3058; 23.1922 90; 90; 90 | 6247.6 | Kounavi, Konstantina A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Supramolecular patterns of cationic and neutral Ni(ii) complexes from the interplay of hydrogen-bonding, stacking interactions and metal-coordination motifs CrystEngComm, 2012, 14, 6492 |
| 7209324 | CIF | C12 H8 Cd N10 S2 | A b a 2 | 8.3799; 19.526; 10.357 90; 90; 90 | 1694.7 | Ana B. Caballero; Antonio Rodríguez-Diéguez; Elisa Barea; Miguel Quirós; Juan M. Salas Influence of Pseudohalide Ligands on the Structural Versatility and Properties of Novel Ternary Metal Complexes with 1,2,4-Triazolo[1,5-a]pyrimidine CrystEngComm, 2010, 12, 3038-3045 |
| 7210104 | CIF | C6 H8 Mn N10 O2 | A b a 2 | 9.3707; 12.181; 9.1857 90; 90; 90 | 1048.5 | Liao, Jian-Zhen; Ke, Hua; Liu, Jian-Jun; Li, Zuo-Yin; Lin, Mei-Jin; Wang, Jun-Dong; Huang, Chang-Cang Coordination polymers of tetrazole-yl acylamide with octahedrally coordinated divalent transition metals: the effects of metal centers and side-groups on the structural topologies and symmetries CrystEngComm, 2013, 15, 4830 |
| 7211734 | CIF | C40 H38 Mn2 N4 O16 S | A b a 2 | 17.581; 27.365; 8.8889 90; 90; 90 | 4276.5 | Fu, Feng; Li, Dong-Sheng; Wu, Ya-Pan; Gao, Xiao-Ming; Du*, Miao; Tang, Long; Zhang, Xiao-Ning; Meng, Cai-Xia A versatile V-shaped tetracarboxylate building block for constructing mixed-ligand Co(ii) and Mn(ii) complexes incorporating various N-donor co-ligands CrystEngComm, 2010, 12, 1227 |
| 7212422 | CIF | C27 H28 N2 O6 Zn | A b a 2 | 29.812; 9.6688; 18.052 90; 90; 90 | 5203.4 | Zheng, Yue-Qing; Zhang, Jie; Liu, Ji-Yong New Zn(ii) coordination polymers with 1,3-bis(4-pyridyl)-propane: syntheses, crystal structures and properties CrystEngComm, 2010, 12, 2740 |
| 7213938 | CIF | C96 H66 As8 Cu4 N16 O43 V14 | A b a 2 | 26.4776; 16.8267; 27.5248 90; 90; 90 | 12263.1 | Guo, Hai-Yang; Li, Zhi-Fang; Zhao, De-Chuan; Hu, Yang-Yang; Xiao, Li-Na; Cui, Xiao-Bing; Guan, Jing-Qi; Xu, Ji-Qing The synthesis and characterization of three organic‒inorganic hybrids based on different transition metal complexes and {As8V14O42(H2O)} clusters CrystEngComm, 2014, 16, 2251 |
| 7215020 | CIF | C18 H23 Co2 N5 O13 | A b a 2 | 23.501; 10.181; 10.334 90; 90; 90 | 2472.6 | Huang, Fu-Ping; Li, Hai-Ye; Yu, Qing; Bian, He-Dong; Tian, Jin-Lei; Yan, Shi-Ping; Liao, Dai-Zheng; Cheng, Peng Co(ii)/Ni(ii) coordination polymers incorporated with a bent connector: crystal structures and magnetic properties CrystEngComm, 2012, 14, 4756 |
| 7215302 | CIF | C30.8 H37.8 Cd N6.2 O6.2 | A b a 2 | 15.573; 19.416; 19.664 90; 90; 90 | 5945.7 | Cui, Ke-Hui; Yao, Shi-Yan; Li, Hai-Qin; Li, Yan-Tao; Zhao, Hai-Ping; Jiang, Chun-Jie; Tian, Yun-Qi Acentric and chiral four-connected metal‒organic frameworks based on the racemic binaphthol-like chiral ligand of 4-(1-H(or methyl)-imidaozol-1-yl)benzoic acid CrystEngComm, 2011, 13, 3432 |
| 7216398 | CIF | C19 H19 Cl3 Cu N2 O4 | A b a 2 | 27.317; 22.2583; 6.9575 90; 90; 90 | 4230.4 | Lochenie, Charles; Schlamp, Stephan; Railliet, Antoine P.; Robeyns, Koen; Weber, Birgit; Garcia, Yann Water channels and zipper structures in Schiff base-like Cu(ii) and Ni(ii) mononuclear complexes CrystEngComm, 2014 |
| 7201809 | CIF | C20 H15 Cl2 I3 O | A b m 2 | 12.2182; 20.479; 8.5939 90; 90; 90 | 2150.34 | Schollmeyer, Dieter; Shishkin, Oleg V.; Rühl, Thomas; Vysotsky, Myroslav O. OH‒π and halogen‒π interactions as driving forces in the crystal organisations of tri-bromo and tri-iodo trityl alcohols CrystEngComm, 2008, 10, 715 |
| 7215758 | CIF | C9 H17 N5 O2 | A b m 2 | 21.7368; 7.2102; 15.5904 90; 90; 90 | 2443.4 | Jones, P. G.; Taouss, Christina Lutidine Adducts of Urea: Molecular Mechanisms for Twinning Effects on Cooling CrystEngComm, 2014 |
| 7229249 | CIF | C10 H20 N2 O14 P4 Zn3 | A e a 2 | 10.2729; 18.1781; 10.7119 90; 90; 90 | 2000.36 | Paul, Avijit Kumar; Kanagaraj, Rajendiran; Jana, Ajay; Maji, Pradip Novel Amine Templated Three-Dimensional Zinc-Organophosphonates with Variable Pore-Openings CrystEngComm, 2017 |
| 7234942 | CIF | C22.86 H14.62 N0.6 O8.12 Zn2 | A e a 2 | 41.3632; 18.7393; 17.7052 90; 90; 90 | 13723.6 | Pan, Ying; Ding, Qiongjie; Xu, Hongjia; Shi, Chunyue; Singh, Amita; Kumar, Abhinav; Liu, Jianqiang A new Zn(ii)-based 3D metal‒organic framework with uncommon sev topology and its photocatalytic properties for the degradation of organic dyes CrystEngComm, 2019, 21, 4578 |
| 7235417 | CIF | C36 H24 N2 | A e a 2 | 26.9518; 12.3277; 15.2781 90; 90; 90 | 5076.2 | Gleason, Cody J.; Cox, Jordan M.; Walton, Ian M.; Benedict, Jason B. Polymorphism and the influence of crystal structure on the luminescence of the opto-electronic material 4,4′-bis(9-carbazolyl)biphenyl CrystEngComm, 2014, 16, 7621 |
| 7236164 | CIF | C36 H32 Cl2 Cu N8 O8 | A e a 2 | 17.4049; 17.5945; 11.9876 90; 90; 90 | 3671 | Kitos, Alexandros A.; Moushi, Eleni E.; Manos, Manolis J.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.; Perlepes, Spyros P.; Nastopoulos, Vassilios Solvent-dependent access to mono- and dinuclear copper(ii) assemblies based on a flexible imidazole ligand CrystEngComm, 2016, 18, 4733 |
| 7236177 | CIF | C64 H42 Cd3 N10 O13 | A e a 2 | 31.98; 7.904; 26.8 90; 90; 90 | 6774 | Wang, Xiao-Xiao; Wang, Xiao-Qing; Niu, Xiao-Yan; Hu, Tuo-Ping Three novel metal‒organic frameworks based on an unsymmetrical rigid carboxylate ligand for luminescence sensing of nitrobenzene derivatives and magnetic properties CrystEngComm, 2016, 18, 7471 |
| 7240540 | CIF | C50 H36 Cl8 I4 N4 | A e a 2 | 11.0411; 16.8624; 28.2059 90; 90; 90 | 5251.4 | Oburn, Shalisa M.; Santana, Carlos; Elacqua, Elizabeth; Groeneman , Ryan A diamondoid net sustained by halogen bonds: employing a cyclobutane to generate a tetrahedral architecture CrystEngComm, 2020 |
| 7243326 | CIF | C18 H12 F4 I2 N2 | A e a 2 | 13.1529; 18.502; 15.239 90; 90; 90 | 3708.5 | Peloquin, Andrew J.; McMillen, Colin D.; Pennington, William T. One dimensional halogen bond design: Br⋯N versus I⋯N with fluoroarenes CrystEngComm, 2021, 23, 6098-6106 |
| 7244641 | CIF | C32 H34 N2 O4 | A e a 2 | 26.6725; 19.708; 10.3729 90; 90; 90 | 5452.64 | Tao, Yang; Liu, Xiaoting; Zhoujin, Yunping; Zhou, Panpan; Parkin, Sean R.; Li, Tonglei; Guo, Ju; Yu, Faquan; Long, Sihui Conformational Flexibility and Substitution Pattern Lead to Polymorphism of 3-Methyl-2-(phenylamino)benzoic acid CrystEngComm, 2022 |
| 7244705 | CIF | C40 H37 Cd2.5 N3 O17.5 | A e a 2 | 16.868; 25.914; 28.838 90; 90; 90 | 12606 | Chahine, Ali; Chaffee, Alan L.; Knowles, Gregory P.; Turner, David Roger; Batten, Stuart R. Highly Connected Framework Materials from Flexible Tetra-Isophthalate Ligands CrystEngComm, 2022 |
| 7245503 | CIF | C18 H40 Cl Fe N10 S6 | A e a 2 | 12.806; 16.361; 17.171 90; 90; 90 | 3597.7 | Wang, Ping; Chen, Ming-Kun; Tong, Yu-Qiao; Yin, Shi-Qing; Huang, Bo Structural phase transition and dielectric relaxation in an organic-inorganic hybrid compound: [(CH3)3NH]4[Fe(SCN)6]Cl CrystEngComm, 2022 |
| 7247024 | CIF | C28 H23 N5 O | A e a 2 | 17.7843; 34.8725; 7.54963 90; 90; 90 | 4682.15 | Sun, Xuancheng; Li, Chaoxiong; Meng, Xianggao; Wang, Dunjia; Zheng, Chunyang A highly thermal and pH-stable fluorescence sensor for rapid detection of Hg2+, Fe3+, and tetracycline in aqueous solutions CrystEngComm, 2023, 25, 4531-4538 |
| 7247808 | CIF | C4 H16 Bi Br5 N2 | A e a 2 | 18.2458; 22.4324; 7.8919 90; 90; 90 | 3230.13 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247809 | CIF | C4 H16 Bi Cl5 N2 | A e a 2 | 17.5689; 21.6639; 7.487 90; 90; 90 | 2849.6 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247810 | CIF | C4 H16 Bi Br2.12 Cl2.88 N2 | A e a 2 | 17.7119; 22.0532; 7.5527 90; 90; 90 | 2950.12 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7247811 | CIF | C4 H16 Bi Br1.15 Cl3.85 N2 | A e a 2 | 17.6291; 21.9787; 7.512 90; 90; 90 | 2910.63 | Pradhan, Abinash; Sahoo, Sanand; Samal, Saroj L. (C2H5NH3)2BiCl5−xBrx perovskites containing 1D chains: effect of Br substitution on their structural and optical properties CrystEngComm, 2024, 26, 312-323 |
| 7244917 | CIF | C20 H22 N12 O4 Zn | A e m 2 | 17.5983; 24.5934; 18.2648 90; 90; 90 | 7905 | Fu, Xiaochen; Sale, Matthew; Ding, Bowen; Lewis, William; Silvester, Debbie S.; Ling, Chris D.; D'Alessandro, Deanna Michelle Hydrogen-Bonding 2D Coordination Polymer for Enzyme-Free Electrochemical Glucose Sensing CrystEngComm, 2022 |
| 7208199 | CIF | C42 H37 B Cd3 F5 N7 O8 | A m a 2 | 20.6365; 18.1133; 12.6984 90; 90; 90 | 4746.6 | Xie, Zai-Lai; Feng, Mei-Ling; Tan, Bin; Huang, Xiao-Ying The multifunctional roles of the ionic liquid [Bmim][BF4] in the creation of cadmium metal‒organic frameworks CrystEngComm, 2012, 14, 4894 |
| 7208643 | CIF | B7 Li5 O14 Rb2 | A m a 2 | 20.376; 13.5114; 4.39 90; 90; 90 | 1208.6 | Yang, Yun; Pan, Shilie; Hou, Xueling; Dong, Xiaoyu; Su, Xin; Yang, Zhihua; Zhang, Min; Zhao, Wenwu; Chen, Zhaohui Li5Rb2B7O14: a new congruently melting compound with two kinds of B‒O one-dimensional chains and short UV absorption edge CrystEngComm, 2012, 14, 6720 |
| 7216450 | CIF | C3 Gd Na3 O9 | A m a 2 | 9.926; 10.992; 7.12 90; 90; 90 | 776.8 | Luo, Min; Lin, Chensheng; Zou, Guohong; Ye, Ning; Cheng, Wendan Sodium–rare earth carbonates with shorite structure and large second harmonic generation response CrystEngComm, 2014, 16, 4414 |
| 7216451 | CIF | C3 Na3 O9 Y | A m a 2 | 9.82; 10.883; 7.038 90; 90; 90 | 752.2 | Luo, Min; Lin, Chensheng; Zou, Guohong; Ye, Ning; Cheng, Wendan Sodium–rare earth carbonates with shorite structure and large second harmonic generation response CrystEngComm, 2014, 16, 4414 |
| 7229379 | CIF | C7 H Ag2 N7 O7 | A m a 2 | 6.6521; 16.2005; 11.0651 90; 90; 90 | 1192.5 | Du, Ceng-Ceng; Wang, Xin-Fang; Zhou, Sheng-Bin; Wang, Duo-Zhi; Jia, Dianzeng New complexes constructed from in situ nitration of (1H-tetrazol-5-yl)phenol: synthesis, structures and properties CrystEngComm, 2017 |
| 7239729 | CIF | C17 H14 Co N4 O4 | A m a 2 | 33.563; 12.204; 10.119 90; 90; 90 | 4145 | Wang, Jun; Chen, Ning-Ning; Zhang, Chen; Jia, Li-Yong; Fan, Liming Functional group induced structural diversities and photocatalytic, magnetic and luminescence sensing properties of four cobalt(ii) coordination polymers based on 1,3,5-tris(2-methylimidazol-1-yl)benzene CrystEngComm, 2020, 22, 811-820 |
| 9017410 | CIF | C Ca O3 | A m a 2 | 8.4905; 6.3905; 4.5026 90; 90; 90 | 244.305 | Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R. A new structural model for disorder in vaterite from first-principles calculations CrystEngComm, 2012, 14, 44-47 |
| 7245721 | CIF | C2 H2 Eu O6 | A m m 2 | 4.807; 15.1947; 7.8938 90; 90; 90 | 576.57 | Takano, Rina; Ishida, Takayuki; Ay, Burak Synthesis, crystal structure, and luminescence properties of a three-dimensional coordination polymer from europium(iii) carbonate hemioxalate hydrate CrystEngComm, 2022 |
| 7234924 | CIF | C6 H16 Br5 N2 Sb | B b e m | 22.4485; 18.9653; 7.9488 90; 90; 90 | 3384.14 | Li, Maofan; Teng, Bing; Han, Shiguo; Yang, Tao; Li, Yaobin; Liu, Yi; Zhang, Xinyuan; Liu, Xitao; Luo, Junhua; Sun, Zhihua Near-room-temperature tunable dielectric response induced by dual phase transitions in a lead-free hybrid: (C3H8N)2SbBr5 CrystEngComm, 2019, 21, 3740 |
| 7245134 | CIF | C7 H8 Cs Fe N7 O | B m m b | 8.286; 9.0586; 18.0168 90; 90; 90 | 1352.33 | Li, Qi-Yao; Li, Mao-Fan; Chen, Xiao-Xian; Gong, Ya-Ping; Liu, De-Xuan; Xu, Wei-Jian; Zhang, Wei-Xiong Near-room-temperature dielectric switch and thermal expansion anomaly in a new hybrid crystal: (Me2NH2)[CsFe(CN)5(NO)] CrystEngComm, 2022 |
| 7206608 | CIF | C24 H22 Co N4 O12 V4 | C -1 | 15.4955; 12.1132; 7.9099 88.155; 95.227; 90.875 | 1477.63 | Fernández de Luis, Roberto; Urtiaga, M. Karmele; Mesa, José L.; Segura, Joseba Orive Gómez de; Rojo, Teófilo; Arriortua, María I. {Co(HBpe)2}(V4O12): pedal motion induced order‒disorder P1̄\ρightarrow C1̄ transition and disrupted C1̄→C2/m displacive transition due to thermal instability CrystEngComm, 2011, 13, 6488 |
| 7206609 | CIF | C24 H22 Co N4 O12 V4 | C -1 | 15.456; 12.141; 7.915 89.727; 95.358; 90.177 | 1478.7 | Fernández de Luis, Roberto; Urtiaga, M. Karmele; Mesa, José L.; Segura, Joseba Orive Gómez de; Rojo, Teófilo; Arriortua, María I. {Co(HBpe)2}(V4O12): pedal motion induced order‒disorder P1̄\ρightarrow C1̄ transition and disrupted C1̄→C2/m displacive transition due to thermal instability CrystEngComm, 2011, 13, 6488 |
| 7243996 | CIF | C10 H7 N O2 | C 1 | 19.7858; 9.397; 3.5684 89.986; 98.729; 89.982 | 655.78 | Rekis, Toms; Ramakrishnan, Sitaram; Kotla, Surya Rohith; Bao, Jin-Ke; Eisele, Claudio; Schönleber, Andreas; Noohinejad, Leila; Paulmann, Carsten; Tolkiehn, Martin; van Smaalen, Sander Une étude cristallographique: superspace description of a commensurate composite cocrystal of 4,4′-dinitrobiphenyl and biphenyl CrystEngComm, 2022, 24, 512-517 |
| 7200310 | CIF | C44 H50 N6 O16 S4 Zn2 | C 1 2 1 | 26.545; 6.8628; 17.018 90; 120.68; 90 | 2666.3 | Chen, Zilu; Su, Yan; Xiong, Wei; Wang, Lixia; Liang, Fupei; Shao, Min Controlling the dimensionalities and structures of homochiral Zn(ii) and Cd(ii) compounds of N-(p-tosyl)-S-carboxymethyl-l-cysteine via tuning the connecting modes of metal ions and chiral linkers by different kinds of ancillary ligands CrystEngComm, 2009, 11, 318-328 |
| 7200321 | CIF | C18 H16 N2 O2 | C 1 2 1 | 11.403; 4.4101; 30.27 90; 100.807; 90 | 1495.2 | Portell, Anna; Barbas, Rafael; Braga, Dario; Polito, Marco; Puigjaner, Cristina; Prohens, Rafel New polymorphic hydrogen bonding donor‒acceptor system with two temperature coincident solid‒solid transitions CrystEngComm, 2009, 11, 52 |
| 7200504 | CIF | C20 H8 Br N4 O | C 1 2 1 | 26.349; 7.3596; 8.8067 90; 101.072; 90 | 1676 | Imai, Yoshitane; Kamon, Kensaku; Kido, Shingo; Harada, Takunori; Tajima, Nobuo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio Formation and crystal structure of the chiral charge-transfer complex with axially chiral 1,1'-bis-2-naphthol derivatives and tetracyanobenzene CrystEngComm, 2009, 11, 620-624 |
| 7200505 | CIF | C21 H11 N4 O | C 1 2 1 | 26.469; 7.274; 8.7625 90; 100.479; 90 | 1659 | Imai, Yoshitane; Kamon, Kensaku; Kido, Shingo; Harada, Takunori; Tajima, Nobuo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio Formation and crystal structure of the chiral charge-transfer complex with axially chiral 1,1'-bis-2-naphthol derivatives and tetracyanobenzene CrystEngComm, 2009, 11, 620-624 |
| 7200763 | CIF | C44 H90 Cl4 N8 O11 | C 1 2 1 | 26.7; 7.0199; 17.975 90; 115.95; 90 | 3029.4 | Alfonso, Ignacio; Bolte, Michael; Bru, Miriam; Burguete, M. Isabel; Luis, Santiago V. Crystal structures of the HCl salts of pseudopeptidic macrocycles display "knobs into holes" hydrophobic interactions between aliphatic side chains CrystEngComm, 2009, 11, 735-738 |
| 7200764 | CIF | C44 H80 Cl4 N8 O6 | C 1 2 1 | 26.413; 7.1135; 15.775 90; 96.299; 90 | 2946.1 | Alfonso, Ignacio; Bolte, Michael; Bru, Miriam; Burguete, M. Isabel; Luis, Santiago V. Crystal structures of the HCl salts of pseudopeptidic macrocycles display "knobs into holes" hydrophobic interactions between aliphatic side chains CrystEngComm, 2009, 11, 735-738 |
| 7200809 | CIF | C13 H13 Cl Co N4 O8 | C 1 2 1 | 19.485; 7.084; 12.134 90; 103.33; 90 | 1629.8 | Su, Zhi; Bai, Zheng-Shuai; Xu, Jing; Okamura, Taka-aki; Liu, Guang-Xiang; Chu, Qian; Wang, Xiao-Feng; Sun, Wei-Yin; Ueyama, Norikazu Synthesis, structure and property of cobalt(II) complexes with 3,5-di(1H-imidazol-1-yl)benzoic acid CrystEngComm, 2009, 11, 873 |
| 7200833 | CIF | C39 H36 Sn2 | C 1 2 1 | 44.7; 6.65; 17.806 90; 108.97; 90 | 5005 | Bettens, Ryan P. A.; Dakternieks, Dainis; Duthie, Andrew; Kuan, Fong Sheen; Tiekink, Edward R. T. The influence of crystal packing effects upon the molecular structures of Ph3Sn(CH2)nSnPh3, n = 1 to 8, as determined by X-ray crystallography and DFT molecular orbital calculations. Supramolecular aggregation patterns sustained by C‒H⋯π interactions CrystEngComm, 2009, 11, 1362 |
| 7202008 | CIF | C6 H4 N2 O7 U | C 1 2 1 | 9.2125; 11.6265; 9.8446 90; 102.397; 90 | 1029.86 | Masci, Bernardo; Thuéry, Pierre Hydrothermal synthesis of uranyl‒organic frameworks with pyrazine-2,3-dicarboxylate linkers CrystEngComm, 2008, 10, 1082 |
| 7202039 | CIF | C22 H14 Eu O8 | C 1 2 1 | 28.945; 8.655; 14.105 90; 116.326; 90 | 3167.1 | Han, Yin-Feng; Zhou, Xin-Hui; Zheng, You-Xuan; Shen, Zhen; Song, You; You, Xiao-Zeng Syntheses, structures, photoluminescence, and magnetic properties of nanoporous 3D lanthanide coordination polymers with 4,4′-biphenyldicarboxylate ligand CrystEngComm, 2008, 10, 1237 |
| 7202040 | CIF | C22 H14 O8 Sm | C 1 2 1 | 29.007; 8.6876; 14.166 90; 116.276; 90 | 3201 | Han, Yin-Feng; Zhou, Xin-Hui; Zheng, You-Xuan; Shen, Zhen; Song, You; You, Xiao-Zeng Syntheses, structures, photoluminescence, and magnetic properties of nanoporous 3D lanthanide coordination polymers with 4,4′-biphenyldicarboxylate ligand CrystEngComm, 2008, 10, 1237 |
| 7202041 | CIF | C22 H14 La O8 | C 1 2 1 | 27.615; 8.842; 14.318 90; 114.311; 90 | 3186 | Han, Yin-Feng; Zhou, Xin-Hui; Zheng, You-Xuan; Shen, Zhen; Song, You; You, Xiao-Zeng Syntheses, structures, photoluminescence, and magnetic properties of nanoporous 3D lanthanide coordination polymers with 4,4′-biphenyldicarboxylate ligand CrystEngComm, 2008, 10, 1237 |
| 7202042 | CIF | C22 H14 Ce O8 | C 1 2 1 | 28.912; 8.789; 14.257 90; 116.141; 90 | 3252.2 | Han, Yin-Feng; Zhou, Xin-Hui; Zheng, You-Xuan; Shen, Zhen; Song, You; You, Xiao-Zeng Syntheses, structures, photoluminescence, and magnetic properties of nanoporous 3D lanthanide coordination polymers with 4,4′-biphenyldicarboxylate ligand CrystEngComm, 2008, 10, 1237 |
| 7202043 | CIF | C22 H14 Gd O8 | C 1 2 1 | 28.905; 8.622; 14.066 90; 116.395; 90 | 3140.1 | Han, Yin-Feng; Zhou, Xin-Hui; Zheng, You-Xuan; Shen, Zhen; Song, You; You, Xiao-Zeng Syntheses, structures, photoluminescence, and magnetic properties of nanoporous 3D lanthanide coordination polymers with 4,4′-biphenyldicarboxylate ligand CrystEngComm, 2008, 10, 1237 |
| 7202044 | CIF | C22 H14 Nd O8 | C 1 2 1 | 28.769; 8.723; 14.179 90; 116.028; 90 | 3197 | Han, Yin-Feng; Zhou, Xin-Hui; Zheng, You-Xuan; Shen, Zhen; Song, You; You, Xiao-Zeng Syntheses, structures, photoluminescence, and magnetic properties of nanoporous 3D lanthanide coordination polymers with 4,4′-biphenyldicarboxylate ligand CrystEngComm, 2008, 10, 1237 |
| 7202175 | CIF | C30 H31 N O4 | C 1 2 1 | 28.581; 6.16; 14.2146 90; 97.441; 90 | 2481.5 | Imai, Yoshitane; Nagasaki, Keiko; Murata, Katuzo; Kawaguchi, Kakuhiro; Harada, Takunori; Nakano, Yoko; Sato, Tomohiro; Fujiki, Michiya; Kuroda, Reiko; Matsubara, Yoshio Multiple molecular response columnar host system composed of rac-2-amino-1,2-diphenylethanol and 1-fluorenecarboxylic acid CrystEngComm, 2008, 10, 951 |
| 7202338 | CIF | C36 H45 Cl2 Co N4 O12.5 | C 1 2 1 | 29.612; 16.8947; 19.6973 90; 114.532; 90 | 8964.7 | Yao, Qing-Xia; Ju, Zhan-Feng; Li, Wei; Wu, Wei; Zheng, Shou-Tian; Zhang, Jie Unprecedented 3D polycatenation based on ribbons of rings found in two metallosupramolecular polymers whose open frameworks show reversible collapse upon de- and rehydration CrystEngComm, 2008, 10, 1299 |
| 7202622 | CIF | C8 H29 Bi I9 N4 O0.5 S4 | C 1 2 1 | 23.45; 12.724; 12.401 90; 108.45; 90 | 3510 | Wenhua Bi; Nicolas Louvain; Nicolas Mercier; Jerôme Luc; Bouchta Sahraoui Type structure, which is composed of organic diammonium, triiodide and hexaiodobismuthate, varies according to different structures of incorporated cations CrystEngComm, 2007, 9, 298 |
| 7202803 | CIF | C14 H18 Cl2 N2 | C 1 2 1 | 23.811; 6.1672; 4.9037 90; 100.84; 90 | 707.2 | Dobrzycki, Lukasz; Woźniak, Krzysztof Structural consequences of benzidine dihydrochloride substitution in the solid state CrystEngComm, 2007, 9, 1029 |
| 7202915 | CIF | C29 H32 N2 O3 | C 1 2 1 | 36.231; 5.5605; 12.3394 90; 92.661; 90 | 2483.2 | Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio Chiral channel-like cavity which is tunable via changes in 21-column packing structure CrystEngComm, 2007, 9, 467 |
| 7202916 | CIF | C30 H34 N2 O3 | C 1 2 1 | 36.599; 5.6822; 12.545 90; 90.891; 90 | 2608.6 | Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio Chiral channel-like cavity which is tunable via changes in 21-column packing structure CrystEngComm, 2007, 9, 467 |
| 7202917 | CIF | C31 H29 N2 O3 | C 1 2 1 | 36.751; 5.6734; 12.304 90; 90.865; 90 | 2565.1 | Imai, Yoshitane; Kawaguchi, Kakuhiro; Asai, Katuzo; Sato, Tomohiro; Kuroda, Reiko; Matsubara, Yoshio Chiral channel-like cavity which is tunable via changes in 21-column packing structure CrystEngComm, 2007, 9, 467 |
| 7203128 | CIF | C11 H14 F6 O6 | C 1 2 1 | 18.816; 5.1374; 7.7556 90; 96.202; 90 | 745.31 | Takahashi, Satoshi; Katagiri, Toshimasa; Uneyama, Kenji Nanoporous organic layered crystals of double-headed bis(trifluorolactate)s. Hydrogen-bonded systematic crystal structures controlled by the symmetries of molecular components CrystEngComm, 2006, 8, 132 |
| 7203130 | CIF | C13 H18 F6 O6 | C 1 2 1 | 20.812; 5.1279; 7.9655 90; 96.279; 90 | 844.99 | Takahashi, Satoshi; Katagiri, Toshimasa; Uneyama, Kenji Nanoporous organic layered crystals of double-headed bis(trifluorolactate)s. Hydrogen-bonded systematic crystal structures controlled by the symmetries of molecular components CrystEngComm, 2006, 8, 132 |
| 7203132 | CIF | C17.24 H27.04 F6 O6 | C 1 2 1 | 27.753; 4.9906; 7.992 90; 95.942; 90 | 1101 | Takahashi, Satoshi; Katagiri, Toshimasa; Uneyama, Kenji Nanoporous organic layered crystals of double-headed bis(trifluorolactate)s. Hydrogen-bonded systematic crystal structures controlled by the symmetries of molecular components CrystEngComm, 2006, 8, 132 |
| 7203166 | CIF | C34 H51 N3 O10 | C 1 2 1 | 13.611; 12.374; 20.458 90; 93.146; 90 | 3440.4 | Białońska, Agata; Ciunik, Zbigniew When in the presence of the strong hydrogen bonds, the weak hydrogen bonds gain an importance CrystEngComm, 2006, 8, 66 |
| 7203622 | CIF | C16 H36 Ag2 N4 O5 | C 1 2 1 | 19.8677; 5.2047; 13.8276 90; 128.451; 90 | 1119.77 | Kalf, Irmgard; Braun, Michaela; Wang, Yutian; Englert, Ulli Homo- and heterochiral coordination polymers of silver with diaminocyclohexane as bridging ligand: The effect of chirality on argentophilic interactions CrystEngComm, 2006, 8, 916 |
| 7203626 | CIF | C6 H14 Ag N3 O3 | C 1 2 1 | 24.132; 6.8438; 11.751 90; 93.354; 90 | 1937.4 | Kalf, Irmgard; Braun, Michaela; Wang, Yutian; Englert, Ulli Homo- and heterochiral coordination polymers of silver with diaminocyclohexane as bridging ligand: The effect of chirality on argentophilic interactions CrystEngComm, 2006, 8, 916 |
| 7203746 | CIF | C12 H10 Cl2 N2 O4 | C 1 2 1 | 12.9485; 5.9793; 8.6189 90; 96.16; 90 | 663.45 | Custelcean, Radu; Gorbunova, Maryna G. Protonation-assisted spontaneous resolution: formation of a homochiral 2D interpenetrated hydrogen-bonded network from 4,4?-binicotinic acid under highly acidic conditions CrystEngComm, 2005, 7, 297 |
| 7203750 | CIF | C62 H62 Cd N4 O9 | C 1 2 1 | 24.024; 10.689; 10.982 90; 108.657; 90 | 2671.9 | Paul, Barbara; Näther, Christian; Fromm, Katharina M.; Janiak, Christoph Chiral S-1,1′-bi-2-naphthol (S-BINOL) as a synthon for supramolecular hydrogen-bonded {(S-BINOLATn‒)(S-BINOL)n}-strands with naphthyl-paneled cavities or channels for a Cd(NH3)4-fragment (n= 2) or [Ag(NH3)2]+(n= 1). Part 2 CrystEngComm, 2005, 7, 309 |
| 7203756 | CIF | C76 H44 N18 O0.96 Zn2 | C 1 2 1 | 29.649; 21.016; 12.252 90; 92.14; 90 | 7629 | Zeng, Qingdao; Wu, Dongxia; Wang, Chen; Lu, Jun; Ma, Baocheng; Shu, Chunying; Ma, Hongwei; Li, Yan; Bai, Chunli Bipyridine conformations control the solid-state supramolecular chemistry of zinc(ii) phthalocyanine with bipyridines CrystEngComm, 2005, 7, 243 |
| 7204684 | CIF | C5 H6 Co N O5 | C 1 2 1 | 16.802; 6.8884; 7.4787 90; 115.119; 90 | 783.72 | Fernando S. Delgado; Joaquín Sanchiz; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve High-dimensional malonate-based materials: Synthesis, crystal structures and magnetic properties of [M2(mal)2(L)(H2O)2]n·n(H2O) M = Zn(II), Co(II); H2mal = malonic acid, L = pyrimidine, pyrazine CrystEngComm, 2003, 5, 280-284 |
| 7204685 | CIF | C5 H6 N O5 Zn | C 1 2 1 | 16.546; 6.929; 7.4783 90; 113.472; 90 | 786.42 | Fernando S. Delgado; Joaquín Sanchiz; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve High-dimensional malonate-based materials: Synthesis, crystal structures and magnetic properties of [M2(mal)2(L)(H2O)2]n·n(H2O) M = Zn(II), Co(II); H2mal = malonic acid, L = pyrimidine, pyrazine CrystEngComm, 2003, 5, 280-284 |
| 7205069 | CIF | C30 H42 Cd3 O26 | C 1 2 1 | 18.984; 7.3315; 16.506 90; 119.337; 90 | 2002.7 | Ji, Chang-Chun; Li, Jing; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen Solvothermal synthesis, structures and physical properties of four new complexes constructed from multi-variant tricarboxylate ligand and pyridyl-based ligands CrystEngComm, 2011, 13, 459 |
| 7205609 | CIF | C6 H16 N O4.5 | C 1 2 1 | 10.0728; 7.394; 12.194 90; 91.839; 90 | 907.72 | Prikhodchenko, Petr V.; Medvedev, Alexander G.; Tripol'skaya, Tatiana A.; Churakov, Andrei V.; Wolanov, Yitzhak; Howard, Judith A. K.; Lev, Ovadia Crystal structures of natural amino acid perhydrates CrystEngComm, 2011, 13, 2399 |
| 7205610 | CIF | C9 H14 N O4.5 | C 1 2 1 | 10.0268; 7.2283; 14.15 90; 92.78; 90 | 1024.3 | Prikhodchenko, Petr V.; Medvedev, Alexander G.; Tripol'skaya, Tatiana A.; Churakov, Andrei V.; Wolanov, Yitzhak; Howard, Judith A. K.; Lev, Ovadia Crystal structures of natural amino acid perhydrates CrystEngComm, 2011, 13, 2399 |
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