Crystallography Open Database
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Searching space group like 'P 1 2/n 1'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1560106 | CIF | C7 Bi N7 Ni S6 | P 1 2/n 1 | 12.216; 36.8375; 24.5263 90; 90.224; 90 | 11036.9 | Lee, Jie Yie; Ling, Sanliang; Argent, Stephen P.; Senn, Mark S.; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]} Chemical Science, 2021, 12, 3516-3525 |
| 1560448 | CIF | C11 H16 Cu4 I4 N4 O0 | P 1 2/n 1 | 12.75; 4.3315; 18.209 90; 97.92; 90 | 996 | Wang, Rong-Yan; Zhang, Xiao; Yang, Qing-Feng; Huo, Qi-Sheng; Yu, Jie-Hui; Xu, Jia-Ning; Xu, Ji-Qing New copper(I) iodides with bisimidazole molecules: Synthesis, structural characterization and photoluminescence property Journal of Solid State Chemistry, 2017, 251, 176-185 |
| 1560543 | CIF | C25 H23 Co N4 O4 | P 1 2/n 1 | 10.1585; 9.4462; 14.0641 90; 100.612; 90 | 1326.5 | Arıcı, Mürsel; Zafer Yeşilel, Okan; Büyükgüngör, Orhan Four coordination polymers based on 5- tert -butyl isophthalic acid and rigid bis(imidazol-1yl)benzene linkers: Synthesis, luminescence detection of acetone and optical properties Journal of Solid State Chemistry, 2017, 249, 141-148 |
| 1560632 | CIF | C30 H38 Cu N10 O5 | P 1 2/n 1 | 9.49312; 12.55069; 13.415 90; 95.5687; 90 | 1590.79 | Liu, Yaru; Xing, Zhiyan; Zhang, Xiao; Liang, Guorui Inorganic anion-dependent assembly of zero-, one-, two- and three-dimensional Cu(II)/Ag(I) complexes under the guidance of the HSAB theory: Synthesis, structure, and magnetic property Journal of Solid State Chemistry, 2017, 246, 48-56 |
| 1560726 | CIF | C6 H14 Cl N2 Na O6 | P 1 2/n 1 | 9.1493; 10.1833; 13.22 90; 108.244; 90 | 1169.8 | Prakash, Prabhat; Ardhra, Shylendran; Fall, Birane; Zdilla, Michael J.; Wunder, Stephanie L.; Venkatnathan, Arun Solvate sponge crystals of (DMF)3NaClO4: reversible pressure/temperature controlled juicing in a melt/press-castable sodium-ion conductor Chemical Science, 2021, 12, 5574-5581 |
| 1561263 | CIF | C36 H34 N6 O13 Zn2 | P 1 2/n 1 | 8.8485; 11.661; 17.702 90; 102.533; 90 | 1783 | Yuan, Fei; Yuan, Chun-Mei; Hu, Huai-Ming; Wang, Ting-Ting; Zhou, Chun-Sheng Structural diversity of a series of terpyridyl carboxylate coordination polymers: Luminescent sensor and magnetic properties Journal of Solid State Chemistry, 2018, 258, 588-601 |
| 1561456 | CIF | C104 H76 N12 O22 Zn4 | P 1 2/n 1 | 14.585; 12.639; 26.214 90; 104.592; 90 | 4676 | Cheng, Yue; Yang, Meng-Lin; Hu, Huai-Ming; Xu, Bing; Wang, Xiaofang; Xue, Ganglin Syntheses, structures and luminescence for zinc coordination polymers based on a multifunctional 4′-(3-carboxyphenyl)- 3,2′:6′,3″-terpyridine ligand Journal of Solid State Chemistry, 2016, 239, 121-130 |
| 1561736 | CIF HKL | C20 H14 Mn N2 O6 | P 1 2/n 1 | 8.5807; 12.1887; 17.2541 90; 100.885; 90 | 1772.1 | Kariem, Mukaddus; Yawer, Mohd; Sheikh, Haq Nawaz Solvent induced synthesis, structure and properties of coordination polymers based on 5-hydroxyisophthalic acid as linker and 1,10-phenanthroline as auxiliary ligand Journal of Solid State Chemistry, 2015, 231, 239-247 |
| 1561737 | CIF HKL | C20 H14 Cd N2 O6 | P 1 2/n 1 | 8.7807; 12.3539; 16.9414 90; 100.192; 90 | 1808.73 | Kariem, Mukaddus; Yawer, Mohd; Sheikh, Haq Nawaz Solvent induced synthesis, structure and properties of coordination polymers based on 5-hydroxyisophthalic acid as linker and 1,10-phenanthroline as auxiliary ligand Journal of Solid State Chemistry, 2015, 231, 239-247 |
| 1561738 | CIF HKL | C20 H14 Co N2 O6 | P 1 2/n 1 | 8.6613; 12.1142; 16.8936 90; 102.081; 90 | 1733.3 | Kariem, Mukaddus; Yawer, Mohd; Sheikh, Haq Nawaz Solvent induced synthesis, structure and properties of coordination polymers based on 5-hydroxyisophthalic acid as linker and 1,10-phenanthroline as auxiliary ligand Journal of Solid State Chemistry, 2015, 231, 239-247 |
| 1561975 | CIF | C22 H26 Co N4 O9 | P 1 2/n 1 | 10.0009; 15.472; 18.563 90; 91.811; 90 | 2870.9 | Ye, Jing; Gou, Yongxia; Xu, Zhen-Liang; Xu, Haitao Selectively catalytic micro- and nanocrystals of metal‒organic framework [Co(4-bpdh)(HIA)]∝ Journal of Solid State Chemistry, 2015, 226, 142-146 |
| 1562395 | CIF | C54 H50 O4 | P 1 2/n 1 | 11.1578; 11.0555; 17.2821 90; 98.594; 90 | 2107.9 | Niermeier, Philipp; Maibom, Kristina; Lamm, Jan-Hendrik; Neumann, Beate; Stammler, Georg; Mitzel, Norbert Werner Hydrogen-Bond-Induced Selectivity of a Head-to-Head Photo- Dimerization of Dialkynylanthracene – Access to Tetra Lewis Acids Chemical Science, 2021 |
| 1562494 | CIF | C20 H15 N3 O6 Zn | P 1 2/n 1 | 15.0626; 9.0935; 15.9264 90; 92.588; 90 | 2179.24 | Arıcı, Mürsel; Yeşilel, Okan Zafer; Keskin, Seda; Şahin, Onur Gas adsorption/separation properties of metal directed self-assembly of two coordination polymers with 5-nitroisophthalate Journal of Solid State Chemistry, 2014, 210, 280-286 |
| 1563721 | CIF | C17 H24 Co N2 O7 | P 1 2/n 1 | 10.1354; 11.4156; 16.4322 90; 102.774; 90 | 1854.2 | Nettleman, Joseph H.; Supkowski, Ronald M.; LaDuca, Robert L. Alkyl group dependence on structure and magnetic properties in layered cobalt coordination polymers containing substituted glutarate ligands and 4,4′-bipyridine Journal of Solid State Chemistry, 2010, 183, 291-303 |
| 1564084 | CIF | C10 H10 Cl N4 O4 Zn | P 1 2/n 1 | 23.654; 22.295; 13.6451 90; 73.421; 90 | 6896.8 | Annan, Neveen A.; Butler, Ian S.; Osman, Yehia A.; Hussein, Mervat H.; Jean-Claude, Bertrand J.; Saad, Eman M.; Mostafa, Sahar I. Complexes based N,N-donors (2,2′-bipyridyl & 2-(2-aminophenyl)benzimidazole); Synthesis, characterization, DNA interaction and toxicity assessment against Chlorella vulgaris microchlorophyte; X-ray crystal structure of [Zn(bpy)3)]Cl2 Inorganica Chimica Acta, 2020, 512, 119885 |
| 1564369 | CIF | C12 H12 B2 N2 O2 | P 1 2/n 1 | 15.0331; 5.0718; 15.8131 90; 111.04; 90 | 1125.29 | Li, Xiaopei; Wang, Dongdong; Zhang, Yongjie; Lu, Wenqi; Yang, Songqiu; Hou, Guangjin; Zhao, Zhenchao; Qin, Haijuan; Zhang, Yahui; Li, Minmin; Qing, Guangyan A novel aggregation‒induced enhanced emission aromatic molecule: 2-aminophenylboronic acid dimer Chemical Science, 2021 |
| 1564397 | CIF | C36 H24 Br2 | P 1 2/n 1 | 18.1145; 6.8754; 23.099 90; 112.806; 90 | 2651.9 | Song, Shaotang; Wang, Lulu; Su, Jie; Xu, Zhen; Hsu, Chia-Hsiu; Hua, Chenqiang; Lyu, Pin; Li, Jing; Peng, Xinnan; Kojima, Takahiro; Nobusue, Shunpei; Telychko, Mykola; Zheng, Yi; Chuang, Feng-Chuan; Sakaguchi, Hiroshi; Wong, Ming Wah; Lu, Jiong Manifold dynamic non-covalent interactions for steering molecular assembly and cyclization Chemical Science, 2021 |
| 1565612 | CIF | C32 H40 F2 N6 O10 Zn | P 1 2/n 1 | 10.8253; 11.5326; 13.81 90; 96.568; 90 | 1712.8 | Huang, Yan-Ju; Zhang, Jun Synthesis and characterization a series of Norfloxacin-transition metal complexes Inorganica Chimica Acta, 2020, 501, 119244 |
| 1566928 | CIF | C12 H13 K O3 S | P 1 2/n 1 | 15.1783; 6.6961; 30.176 90; 104.412; 90 | 2970.4 | Plajer, Alex Johannes; Pröhm, Patrick; Rupf, Susanne M. Lithium achieves sequence selective ring-opening terpolymerisation (ROTERP) of ternary monomer mixtures Chemical Science, 2022 |
| 1566941 | CIF | C74 H128 O3 Tm2 | P 1 2/n 1 | 18.6229; 10.3489; 19.6817 90; 111.234; 90 | 3535.7 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1567065 | CIF | C70 H92 O13 | P 1 2/n 1 | 12.5731; 22.6648; 14.4358 90; 113.995; 90 | 3758.2 | Cao, Jiajun; Wu, Yitao; Li, Qi; Zhu, Weijie; Wang, Zeju; Liu, Yang; Jie, Kecheng; Zhu, Huangtianzhi; Huang, Feihe Separation of pyrrolidine from tetrahydrofuran by pillar[6]arene-based nonporous adaptive crystals Chemical Science, 2022 |
| 1567536 | CIF | C36 H36 N4 O2 Zn | P 1 2/n 1 | 9.911; 6.0729; 27.229 90; 93.877; 90 | 1635.1 | D'Aniello, Sara; Laviéville, Sidonie; Santulli, Federica; Simon, Malaury; Sellitto, Michele; Tedesco, Consiglia; Thomas, Christophe M.; Mazzeo, Mina Homoleptic phenoxy-imine pyridine zinc complexes: efficient catalysts for solvent free synthesis and chemical degradation of polyesters Catalysis Science & Technology, 2022, 12, 6142-6154 |
| 1567660 | CIF | C16 H18 N2 Se4 | P 1 2/n 1 | 15.5783; 7.9499; 29.5587 90; 90.3204; 90 | 3660.67 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567662 | CIF | C16 H18 N2 S4 | P 1 2/n 1 | 15.105; 7.8801; 28.9196 90; 90.6804; 90 | 3442.03 | Kerckhoffs, Aidan; Christensen, Kirsten E.; Langton, Matthew J. Fast relaxing red and near-IR switchable azobenzenes with chalcogen and halogen substituents: periodic trends, tuneable thermal half-lives and chalcogen bonding. Chemical science, 2022, 13, 11551-11559 |
| 1567672 | CIF | C37 H40 Cl N2 Pd | P 1 2/n 1 | 22.26; 14.479; 22.541 90; 106.1; 90 | 6980 | Zhou, Tongliang; Gao, Pengcheng; Bisz, Elwira; Dziuk, Błażej; Lalancette, Roger; Szostak, Roman; Szostak, Michal Well-defined, air- and moisture-stable palladium–imidazo[1,5-a]pyridin-3-ylidene complexes: a versatile catalyst platform for cross-coupling reactions by L-shaped NHC ligands Catalysis Science & Technology, 2022, 12, 6581-6589 |
| 1567789 | CIF | C14 H15 F6 Mn N3 O7 S2 | P 1 2/n 1 | 8.9946; 9.9209; 12.2244 90; 105.646; 90 | 1050.42 | Verspeek, Dennis; Ahrens, Sebastian; Spannenberg, Anke; Wen, Xiaodong; Yang, Yong; Li, Yong-Wang; Junge, Kathrin; Beller, Matthias Manganese N,N,N-pincer complex-catalyzed epoxidation of unactivated aliphatic olefins Catalysis Science & Technology, 2022, 12, 7341-7348 |
| 1567866 | CIF | F6 Sn Zr | P 1 2/n 1 | 6.6119; 5.2503; 6.9929 90; 114.239; 90 | 221.35 | Gerasimenko, A. V.; Merkulov, E. B.; Tkachenko, I. A.; Kavun, V. Ya.; Goncharuk, V. K.; Sergienko, V. I. Synthesis and Structure of Tin(II) Hexafluorozirconate Russian Journal of Coordination Chemistry, 2002, 28, 839-842 |
| 1568617 | CIF | C4 H24 Cl7 Mo N4 | P 1 2/n 1 | 16.0647; 7.3477; 16.1264 90; 103.599; 90 | 1850.17 | Binwal, Devesh Chandra; Mudoi, Prashurya Pritam; Panda, Debendra Prasad; Vishnoi, Pratap Molybdenum chloride double perovskites: dimensionality control of optical and magnetic properties. Chemical science, 2023, 14, 3982-3989 |
| 1568921 | CIF Paper | C32 H31 K O14 | P 1 2/n 1 | 11.2185; 10.2204; 13.5244 90; 106.427; 90 | 1487.38 | Jin, Shasha; Haskins, Molly M.; Deng, Cheng Hua; Matos, Catiúcia R M O; Zaworotko, Michael J. Crystal engineering of ionic cocrystals comprising Na/K salts of hesperetin with hesperetin molecules and solubility modulation. IUCrJ, 2023, 10 |
| 1568925 | CIF | C16 H13.5 Na0.5 O6 | P 1 2/n 1 | 10.7741; 9.6357; 13.8452 90; 107.103; 90 | 1373.79 | Jin, Shasha; Haskins, Molly M.; Deng, Cheng Hua; Matos, Catiúcia R M O; Zaworotko, Michael J. Crystal engineering of ionic cocrystals comprising Na/K salts of hesperetin with hesperetin molecules and solubility modulation. IUCrJ, 2023, 10 |
| 1569354 | CIF | C104 H110 F6 N8 O2 S4 | P 1 2/n 1 | 24.3943; 14.1219; 29.0635 90; 103.837; 90 | 9721.6 | Xie, Meiling; Shi, Yanan; Zhu, Lingyun; Zhang, Jianqi; Cheng, Qian; Zhang, Hao; Yan, Yangjun; Zhu, Mingquan; Zhou, Huiqiong; Lu, Kun; Wei, Zhixiang Selective halogenation of central and end-units of nonfullerene acceptors enables enhanced molecular packing and photovoltaic performance Energy & Environmental Science, 2023, 16, 3543-3551 |
| 1569356 | CIF | P | P 1 2/n 1 | 9.1997; 9.1235; 21.9062 90; 97.727; 90 | 1821.97 | Wang, Yanhao; Jin, Mengting; Gu, Mengyue; Zhao, Xuewen; Xie, Jinan; Meng, Guodong; Cheng, Yonghong; He, Jinjiang; Zhang, Jinying Synthesis of violet phosphorus with large lateral sizes to facilitate nano-device fabrications. Nanoscale, 2023, 15, 12406-12412 |
| 1569417 | CIF | C50.67 H46.7 I6 N12 O1.42 Zn3 | P 1 2/n 1 | 31.5077; 14.9991; 34.4289 90; 102.086; 90 | 15910 | Carroll, Robert C.; Harrowven, David C.; Pearce, James E.; Coles, Simon J. A systematic study of the interplay between guest molecule structure and intermolecular interactions in crystalline sponges IUCrJ, 2023, 10, 497-508 |
| 1569606 | CIF | C67 H56 Cu F6 N2 O3 P3 | P 1 2/n 1 | 12.8402; 19.2826; 25.7915 90; 101.171; 90 | 6264.79 | Doettinger, Florian; Kleeberg, Christian; Queffélec, Clémence; Tschierlei, Stefanie; Pellegrin, Yann; Karnahl, Michael Rich or poor: the impact of electron donation and withdrawal on the photophysical and photocatalytic properties of copper(i) complexes Catalysis Science & Technology, 2023, 13, 4092-4106 |
| 1569990 | CIF | C84 H64 N4 O12 S4 | P 1 2/n 1 | 17.1862; 12.2494; 18.3174 90; 113.273; 90 | 3542.4 | Mitchell, Travis B.; Zhang, Xiaotong; Jerozal, Ronald T.; Chen, Yu Sheng; Wang, SuYin; Benedict, Jason B. Development of a scalar-based geometric parameterization approach for the crystal structure landscape of dithienylethene-based crystalline solids. IUCrJ, 2023, 10 |
| 1570072 | CIF | C30 H18 F2 N2 O4 Zn | P 1 2/n 1 | 14.98; 9.8498; 16.639 90; 94.86; 90 | 2446.3 | Jena, Rohan; Laha, Subhajit; Dwarkanath, Nimish; Hazra, Arpan; Haldar, Ritesh; Balasubramanian, Sundaram; Maji, Tapas Kumar Noncovalent interaction guided selectivity of haloaromatic isomers in a flexible porous coordination polymer. Chemical science, 2023, 14, 12321-12330 |
| 1570337 | CIF | C12 H9 B F2 | P 1 2/n 1 | 8.6301; 8.5219; 13.3072 90; 99.458; 90 | 965.37 | Turnbull, Douglas; Légaré, Marc-André Rapid, iterative syntheses of unsymmetrical di- and triarylboranes from crystalline aryldifluoroboranes. Chemical science, 2023, 14, 14256-14261 |
| 1570721 | CIF | C35 H38.5 B10 N11.5 O8.12 Pb2 | P 1 2/n 1 | 16.8622; 17.0582; 18.224 90; 109.153; 90 | 4951.8 | Matveev, Evgenii Yu; Dontsova, Olga S.; Avdeeva, Varvara V.; Kubasov, Alexey S.; Zhdanov, Andrey P.; Nikiforova, Svetlana E.; Goeva, Lyudmila V.; Zhizhin, Konstantin Yu; Malinina, Elena A.; Kuznetsov, Nikolay T. Synthesis and Structures of Lead(II) Complexes with Substituted Derivatives of the <i>Closo</i>-Decaborate Anion with a Pendant N<sub>3</sub> Group. Molecules (Basel, Switzerland), 2023, 28, 8073 |
| 1571080 | CIF | C300 H380 F4 N16 O8 P8 S4 | P 1 2/n 1 | 26.0037; 13.0979; 40.762 90; 95.402; 90 | 13821.6 | Liu, Shihua; Li, Yinwu; Lin, Jieli; Ke, Zhuofeng; Grützmacher, Hansjörg; Su, Cheng-Yong; Li, Zhongshu Sequential radical and cationic reactivity at separated sites within one molecule in solution. Chemical science, 2024, 15, 5376-5384 |
| 1571151 | CIF | C66.83 H62.68 Cl2.49 N8 O6 | P 1 2/n 1 | 14.3914; 14.9401; 33.6959 90; 91.185; 90 | 7243.37 | Yeung, Angus; Zwijnenburg, Martijn A.; Orton, Georgia R. F.; Robertson, Jennifer H.; Barendt, Timothy A. Investigating the diastereoselective synthesis of a macrocycle under Curtin-Hammett control. Chemical science, 2024, 15, 5516-5524 |
| 1571183 | CIF | C50 H37 Fe O12 S32 | P 1 2/n 1 | 24.9368; 19.4844; 31.8267 90; 108.849; 90 | 14634.6 | Blundell, Toby J.; Rusbridge, Elizabeth K.; Pemberton, Rebecca E.; Brannan, Michael J.; Morritt, Alexander L.; Ogar, Joseph O.; Wallis, John D.; Akutsu, Hiroki; Nakazawa, Yasuhiro; Imajo, Shusaku; Martin, Lee Introduction of new guest molecules into BEDT-TTF radical-cation salts with tris(oxalato)ferrate CrystEngComm, 2024, 26, 1962-1975 |
| 1571712 | CIF | C160 H168 N14 Ni3 | P 1 2/n 1 | 16.4956; 19.5137; 27.9638 90; 98.4471; 90 | 8903.6 | Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro; Song, Jianxin Synthesis of NiII porphyrin—NiII 5,15-diazaporphyrin hybrid tapes Chemical Science, 2024, 15, 10207-10213 |
| 1571840 | CIF Paper | C78.84 H55.3 I12 N24 O1.37 Zn6 | P 1 2/n 1 | 31.4246; 14.9857; 34.4395 90; 101.976; 90 | 15865.2 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571848 | CIF Paper | C82.77 H61.36 I12 N24 O1.75 Zn6 | P 1 2/n 1 | 31.387; 15.0302; 34.2836 90; 101.803; 90 | 15831.4 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571855 | CIF Paper | C87.42 H68.09 I12 N24 O2.31 Zn6 | P 1 2/n 1 | 31.5433; 15.0035; 34.4229 90; 101.974; 90 | 15936.5 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571858 | CIF Paper | C82.19 H58.83 I12 N24 O2.04 Zn6 | P 1 2/n 1 | 31.4571; 14.9918; 34.361 90; 101.834; 90 | 15860.2 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571860 | CIF Paper | C85.04 H63.33 I12 N24 O2.09 Zn6 | P 1 2/n 1 | 31.5355; 14.9866; 34.4588 90; 101.931; 90 | 15933.8 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571861 | CIF Paper | C84.39 H63.55 I12 N24 O2 Zn6 | P 1 2/n 1 | 31.6699; 14.978; 34.5752 90; 102.239; 90 | 16028 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571862 | CIF Paper | C84.04 H62.85 I12 N24 O1.98 Zn6 | P 1 2/n 1 | 31.5527; 14.9736; 34.5612 90; 102.244; 90 | 15957.3 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571863 | CIF Paper | C84.74 H64.37 I12 N24 O1.95 Zn6 | P 1 2/n 1 | 31.5154; 15.0261; 34.3648 90; 101.863; 90 | 15926 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571865 | CIF Paper | C94.73 H79.09 I12 N24 O3.08 Zn6 | P 1 2/n 1 | 31.6098; 15.0289; 34.3656 90; 101.939; 90 | 15972.6 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571867 | CIF Paper | C88.38 H69.11 I12 N24 O2.48 Zn6 | P 1 2/n 1 | 31.5448; 14.9824; 34.3898 90; 102.066; 90 | 15894.1 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571868 | CIF Paper | C82.5 H59.2 I12 N24 O2.1 Zn6 | P 1 2/n 1 | 31.6622; 15.0003; 34.4418 90; 102.214; 90 | 15987.6 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571869 | CIF Paper | C87.95 H67.9 I12 N24 O2.58 Zn6 | P 1 2/n 1 | 31.4491; 15.0235; 34.215 90; 101.68; 90 | 15831 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571870 | CIF Paper | C90.62 H72.78 I12 N24 O2.67 Zn6 | P 1 2/n 1 | 31.5672; 15.0183; 34.3644 90; 102.009; 90 | 15935.1 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571871 | CIF Paper | C85.35 H63.69 I12 N24 O2.36 Zn6 | P 1 2/n 1 | 31.479; 15.0233; 34.2503 90; 101.732; 90 | 15859.2 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571872 | CIF Paper | C90.9 H73.02 I12 N24 O2.74 Zn6 | P 1 2/n 1 | 31.549; 15.0248; 34.3298 90; 101.853; 90 | 15925.9 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571873 | CIF Paper | C100.99 H91.97 I12 N24 O2.88 Zn6 | P 1 2/n 1 | 31.5077; 14.9991; 34.4289 90; 102.086; 90 | 15910 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571874 | CIF Paper | C90.17 H71.8 I12 N24 O2.69 Zn6 | P 1 2/n 1 | 31.5685; 15.041; 34.3133 90; 101.955; 90 | 15939.3 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571876 | CIF Paper | C92.12 H75.43 I12 N24 O2.75 Zn6 | P 1 2/n 1 | 31.6878; 14.9984; 34.4068 90; 102.171; 90 | 15984.8 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571877 | CIF Paper | C88.1 H68.2 I12 N24 O2.57 Zn6 | P 1 2/n 1 | 31.5313; 15.0299; 34.2616 90; 101.863; 90 | 15890.2 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1571878 | CIF Paper | C95.66 H80.05 I12.01 N24 O3.27 Zn6.01 | P 1 2/n 1 | 31.6222; 14.9929; 34.405 90; 102.192; 90 | 15943.8 | Carroll, Robert C.; Coles, Simon J. Statistical optimization of guest uptake in crystalline sponges: grading structural outcomes. IUCrJ, 2024, 11 |
| 1572071 | CIF | C35 H28 B | P 1 2/n 1 | 18.3373; 6.019; 24.2331 90; 104.751; 90 | 2586.51 | Wieprecht, Nele; Krummenacher, Ivo; Wüst, Leonie; Michel, Maximilian; Fuchs, Sonja; Nees, Samuel; Härterich, Marcel; Braunschweig, Holger The forgotten borole: synthesis, properties and reactivity of a 1-boraindene. Chemical science, 2024, 15, 12496-12501 |
| 1572445 | CIF | C86 H104 Cu4 Li4 O32 Si12 | P 1 2/n 1 | 27.2908; 12.83961; 28.6407 90; 94.7195; 90 | 10001.8 | Zueva, Anna Y.; Bilyachenko, Alexey N.; Khrustalev, Victor N.; Shul'pina, Lidia S.; Ikonnikov, Nikolay S.; Dorovatovskii, Pavel V.; Shubina, Elena S.; Ragimov, Karim; Lobanov, Nikolai N.; Sun, Di Rational (supra)molecular design and catalytic activity of cage-like Cu<sub>4</sub>-based phenylsilsesquioxanes. Nanoscale, 2024, 16, 18389-18398 |
| 1573182 | CIF | C24 H16 Al4 Br4 | P 1 2/n 1 | 10.1518; 9.9203; 12.7992 90; 100.072; 90 | 1269.13 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573878 | CIF | C20 H18 Br4 N2 O2 | P 1 2/n 1 | 15.9413; 9.245; 16.0151 90; 110.54; 90 | 2210.2 | Jeba Silviya, S. Benita; Ruphina Maragatham, S. Michlin; Andrews, S. G. Jebastin; Bhuvanesh, Nattamai S. P.; Jebaraj, J. Winfred; Balakrishnan, Chithiraivel A robust PET-based chiral Schiff base molecular probe for recognition of Hg<sup>2+</sup> and Pb<sup>2+</sup> and its application in live cell imaging. Analytical methods : advancing methods and applications, 2025, 17, 2342-2354 |
| 1574461 | CIF | C16 H18 N2 O4 S | P 1 2/n 1 | 11.3891; 4.8402; 15.7088 90; 110; 90 | 813.73 | Metherall, Jessica P.; Corner, Philip A.; McCabe, James F.; Probert, Michael R.; Hall, Michael J. High-throughput encapsulated nanodroplet screening for accelerated co-crystal discovery Chemical Science, 2025, 16, 9843-9853 |
| 1574625 | CIF | C151 H177 Al2 K2 N4 O4 | P 1 2/n 1 | 20.4545; 14.2108; 45.7301 90; 96.745; 90 | 13200.6 | Kallmeier, Fabian; Nelmes, Gareth R.; McMullin, Claire L.; Edwards, Alison J.; Hicks, Jamie Enhancing the nucleophilicity of aluminyl anions: targeting selective C–H activation Chemical Science, 2025, 16, 10750-10758 |
| 1574808 | CIF | C60 H72 B2 F6 N2 Sb | P 1 2/n 1 | 16.4468; 9.5691; 19.4316 90; 109.712; 90 | 2879 | Wang, Yuyi; Shi, Tao; Yue, Ling; Zhou, Guijiang; Su, Bochao Carbene-stabilized 6,12-diboraanthanthrenes: unveiling the multistage redox properties of polycyclic aromatic hydrocarbons featuring electron-rich boron centers. Chemical science, 2025, 16, 12510-12518 |
| 1575158 | CIF | C26 H42 Ir2 Mo N2 O4 | P 1 2/n 1 | 10.9967; 10.9728; 12.1515 90; 90.354; 90 | 1466.23 | Dubrawski, Zachary; Del Rosal, Iker; Jeanneau, Erwann; Maron, Laurent; Thieuleux, Chloé; Camp, Clément Synergistic C-H bond activation across molybdenum-iridium multiply bonded complexes: a cascade of transformations. Chemical science, 2025, 16, 14564-14577 |
| 1575404 | CIF | C37 H31 N5 O4 Zn | P 1 2/n 1 | 9.7431; 9.2259; 17.642 90; 98.65; 90 | 1567.8 | Giovanardi, Dario; Cagossi, Giorgio; Zolotarev, Pavel N.; Mazzeo, Paolo P.; Bacchi, Alessia; Carlucci, Lucia; Proserpio, Davide M.; Pelagatti, Paolo Collapse or capture? Guest-induced response of two structurally distinct pillared-MOFs upon exposure to pyridines and quinolines. Dalton transactions (Cambridge, England : 2003), 2025, 54, 13540-13548 |
| 1575621 | CIF | C31 H29 Br Co0.5 O1.5 P2 | P 1 2/n 1 | 15.539; 9.5032; 18.1818 90; 97.433; 90 | 2662.35 | Xu, Chao; Bao, Zhi-Peng; Shao, Sufang; Wu, Xiao-Feng Cobalt-catalyzed direct carbonylative 3-acylation of (N-H)Indoles with alkyl halides. Chemical science, 2025, 16, 18838-18843 |
| 1575865 | CIF | C79 H79.8 N11 O9 | P 1 2/n 1 | 31.9415; 9.5284; 32.2718 90; 117.757; 90 | 8691.8 | Lin, Yun-Hsien; Wang, Xiqu; Szczepanik, Dariusz W.; Wieczorkiewicz, Paweł A; Miljanić, Ognjen Š Inverted azolophanes: alternant <i>o</i>-heteroarene/<i>p</i>-arene macrocycles. Chemical science, 2025, 16, 19967-19972 |
| 1575976 | CIF | C73 H128 N2 U2 | P 1 2/n 1 | 18.4067; 10.3962; 19.3564 90; 109.753; 90 | 3486.1 | Shephard, Angus C. G.; Pedussaut, Lucie; De Marchi, Linda; Demonti, Luca; Rajeshkumar, Thayalan; Casaretto, Nicolas; Maron, Laurent; Danoun, Grégory; Simler, Thomas; Nocton, Grégory Room temperature dinitrogen cleavage and hydrogenation with organometallic complexes of uranium. Chemical science, 2025, 16, 21334-21345 |
| 1575996 | CIF | C32 H56 Au8 S16 | P 1 2/n 1 | 13.9729; 12.1142; 16.6245 90; 105.056; 90 | 2717.44 | George, Tanner; Johnson, Erin R.; Masuda, Jason Douglas Trapping Carbon Suboxide with a Carbene and Isolation of the Carbene-stabilized Carbon Suboxide Dimer Chemical Science, 2025 |
| 1576246 | CIF | C54 H65.94 N8 O8.95 | P 1 2/n 1 | 21.4759; 10.6707; 23.6099 90; 110.611; 90 | 5064.2 | Alimi, Lukman O.; Khalfay, Nida; Khlifi, Soumaya; Lin, Weibin; Moosa, Basem; Khashab, Niveen M. A nonporous crystalline organic cage for selective water uptake and storage Chemical Science, 2025 |
| 2000359 | CIF Paper | C15 H20 O2 | P 1 2/n 1 | 19.362; 6.703; 20.011 90; 109.656; 90 | 2445.8 | Lloyd, B. A.; Arif, A. M.; Allred, E. L. Pyramidalization in a tetracyclic perpendicular diene derivative Acta Crystallographica Section C, 1992, 48, 2147-2151 |
| 2001285 | CIF Paper | C26 H30 Cl N6 O3 V | P 1 2/n 1 | 13.01; 7.687; 13.412 90; 103.63; 90 | 1303.5 | Neves, A.; Hörner, M.; Fenner, H.; Strähle, J. Structure of dioxo[<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis(2-pyridylmethyl)ethylenediamine]vanadium(V) chloride monohydrate, [VO~2~(tpen)]Cl.H~2~O Acta Crystallographica Section C, 1993, 49, 1737-1739 |
| 2001345 | CIF Paper | C2 F4 O4 P4 S4 | P 1 2/n 1 | 8.283; 6.428; 12.707 90; 101.39; 90 | 663.2 | Jones, P. G.; Weinkauf, A. 9,9,10,10-Tetrafluoro-1,3,5,7-tetrathio-2,4,6,8-tetraaoxa-1,3,5,7-tetraphosphatricyclo[3.3.1.1^3,7^]decane, P~4~O~4~(CF~2~)~2~S~4~: a cage structure related to P~4~O~6~ Acta Crystallographica Section C, 1993, 49, 1810-1811 |
| 2001771 | CIF Paper | C2 H4 Na O6 P | P 1 2/n 1 | 9.782; 5.366; 11.175 90; 91.39; 90 | 586.4 | Lis, T. Structure of phosphoglycolate (PG) in different ionization states. Structure of phosphoglycolic acid (H~3~PG) and its salts: KH~2~PG, NaH~2~PG, K~3~H~3~(PG)~2~, Na~2~HPG.0.5H~2~O, Na~5~H(PG)~2~.4H~2~O and Na~3~PG.4H~2~O Acta Crystallographica Section C, 1993, 49, 696-705 |
| 2002527 | CIF | Cu Ho O8 W2 | P 1 2/n 1 | 10.045; 5.808; 5.021 90; 94.38; 90 | 292.1 | Mueller-Buschbaum, Hk; Krueger, T Ein Beitrag zur Kristallstruktur von Cu Y W2 O8, Cu Ho W2 O8 und Cu Yb W2 O8 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1992, 607, 52-56 |
| 2002528 | CIF | Cu O8 W2 Yb | P 1 2/n 1 | 9.948; 5.824; 5.008 90; 93.36; 90 | 289.7 | Mueller-Buschbaum, Hk; Krueger, T Ein Beitrag zur Kristallstruktur von Cu Y W2 O8, Cu Ho W2 O8 und Cu Yb W2 O8 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1992, 607, 52-56 |
| 2002631 | CIF | Cu O8 Tm W2 | P 1 2/n 1 | 9.9789; 5.8212; 5.0126 90; 93.625; 90 | 290.6 | Müller-Buschbaum, Hk.; Gressling, T. Ein Beitrag zur Kristallstruktur von β-CuTmW~2~O~8~ und β-CuLuW~2~O~8~ Journal of Alloys and Compounds, 1993, 201, 267-270 |
| 2002632 | CIF | Cu Lu O8 W2 | P 1 2/n 1 | 9.9095; 5.8214; 5.0075 90; 92.955; 90 | 288.5 | Müller-Buschbaum, Hk.; Gressling, T. Ein Beitrag zur Kristallstruktur von β-CuTmW~2~O~8~ und β-CuLuW~2~O~8~ Journal of Alloys and Compounds, 1993, 201, 267-270 |
| 2002699 | CIF | Cu O8 W2 Y | P 1 2/n 1 | 10.0504; 5.8214; 5.0224 90; 94.23; 90 | 293 | Müller-Buschbaum, Hk.; Szillat, H. Zur Kristallchemie der Kupfer-Lanthanoid-Oxowolframate: (I) triklin-α-CuTbW~2~O~8~, (II) monoklin-CuInW~2~O~8~ und (III) monoklin-CuYW~2~O~8~ Zeitschrift für Anorganische und Allgemeine Chemie, 1994, 620, 642-646 |
| 2004252 | CIF Paper | C72 H84 Li2 O9 Sn3 | P 1 2/n 1 | 11.13; 13.157; 23.077 90; 95.68; 90 | 3362.7 | Smith, G. D.; Fanwick, P. E.; Rothwell, I. P. A Trigonal Prismatic Cluster Compound of Tin and Lithium: Structure of [{Sn(OCMe~2~C~6~H~4~)~2~}~3~Li~2~O].2HOCMe~2~Ph Acta Crystallographica Section C, 1995, 51, 2501-2503 |
| 2004400 | CIF Paper | C30 H24 Br2 | P 1 2/n 1 | 14.643; 8.889; 19.682 90; 105.22; 90 | 2472 | Toda, F.; Tanaka, K.; Stein, Z.; Goldberg, I. Conformation of Acyclic Derivatives of 1,1,4,4-Tetraphenyl-1,3-butadiene Acta Crystallographica Section C, 1996, 52, 118-122 |
| 2004498 | CIF Paper | C24 H20 I3 P | P 1 2/n 1 | 10.332; 7.69; 15.406 90; 92.77; 90 | 1222.6 | Parvez, M.; Wang, M.; Boorman, P. M. Tetraphenylphosphonium Triiodide Acta Crystallographica Section C, 1996, 52, 377-378 |
| 2004622 | CIF Paper | C24 H54 Cd2 N8 O23 | P 1 2/n 1 | 15.298; 6.097; 22.037 90; 106.72; 90 | 1968.5 | Wu, D.-D.; Mak, T. C. W. Polymeric Cadmium(II) Nitrate Adduct of a Flexible Double Betaine: [Cd~2~(<i>L</i>)~2~(NO~3~)~2~(H~2~O)~3~]~<i>n~</i>(NO~3~)~2<i>n~</i> [<i>L</i> = <i>meso</i>-2,5-Bis(trimethylammonio)adipate] Acta Crystallographica Section C, 1996, 52, 529-532 |
| 2005157 | CIF Paper | C15 H25 N3 O2 | P 1 2/n 1 | 12.533; 7.6536; 16.804 90; 101.03; 90 | 1582.1 | Saviano, M.; Lombardi, A.; Pavone, V.; Yamada, T.; Yanagi, T.; Iwamoto, A.; Kuwata, S. A Racemic Bicyclic Acylamidine from a Tripeptide Derivative Acta Crystallographica Section C, 1996, 52, 1705-1708 |
| 2005628 | CIF Paper | C20 H34 O2 Rh2 | P 1 2/n 1 | 12.474; 6.3201; 12.418 90; 94.93; 90 | 975.4 | Ramm, M.; Selent, D. Bis[(1,2,5,6-η)-1,5-cyclooctadiene]-di-μ-ethoxo-dirhodium(I) Acta Crystallographica Section C, 1996, 52, 2703-2705 |
| 2007176 | CIF Paper | C11 H12 Br2 F4 N2 Os | P 1 2/n 1 | 7.08; 6.8203; 29.473 90; 90.32; 90 | 1423.2 | Höhling, Matthias; Preetz, Wilhelm Dipyridiniomethane <i>cis</i>-Dibromotetrafluoroosmate(IV), <i>cis</i>-[(C~5~H~5~ N)~2~CH~2~][OsBr~2~F~4~] Acta Crystallographica Section C, 1998, 54, 481-483 |
| 2007857 | CIF Paper | C4 H24 Cl7 In N4 | P 1 2/n 1 | 16.232; 7.449; 16.125 90; 103.8; 90 | 1893.4 | Rothammel, Walter; Spengler, Roland; Burzlaff, Hans; Jarraya, S.; Ben Salah, Abdelhamid Redetermination of Tetrakis(methylammonium) Hexachloroindate Chloride Acta Crystallographica Section C, 1998, 54, IUC9800059 |
| 2008111 | CIF Paper | C9 H6 Fe O4 | P 1 2/n 1 | 12.2502; 6.5155; 12.415 90; 108.866; 90 | 937.7 | Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja Tricarbonyl[(2,3,6,7-η)-2,3-dimethylene-2,3-dihydrofuran]iron(0) at 120K Acta Crystallographica Section C, 1999, 55, IUC9800082 |
| 2008489 | CIF Paper | C15 H16 N4 Ni O3 | P 1 2/n 1 | 7.183; 9.307; 11.326 90; 105.73; 90 | 728.8 | Tamura, Masana; Kajikawa, Yuji; Azuma, Nagao; Tani, Hiroyuki; Tajima, Kunihiko; Kanaori, Kenji; Makino, Keisuke; Takayama, Toshio [1,3-Bis(pyridine-2-carboxamido)propane]palladium(II) monohydrate and its nickel(II) analogue Acta Crystallographica Section C, 1999, 55, 719-722 |
| 2009493 | CIF Paper | C16 H24 Cu I6 N8 | P 1 2/n 1 | 8.116; 11.246; 17.243 90; 101.49; 90 | 1542.3 | Tebbe, Karl-Friedrich; Nafepour, Shida Tetra(<i>N</i>-methylimidazol)-kupfer(II)-bis(triiodid) [Cu(C~4~H~6~N~2~)~4~](I~3~)~2~ Acta Crystallographica Section C, 1994, 50, 171-173 |
| 2010083 | CIF Paper | C11 H12 Cl2 F4 N2 Os | P 1 2/n 1 | 6.9689; 6.7658; 28.994 90; 90.172; 90 | 1367.07 | Bruhn, Clemens; Preetz, Wilhelm Dipyridiniomethane <i>cis</i>-dichlorotetrafluoroosmate(IV) Acta Crystallographica Section C, 1994, 50, 1555-1557 |
| 2010130 | CIF Paper | C14 H21 N4 O10.5 | P 1 2/n 1 | 11.623; 7.432; 21.197 90; 102.86; 90 | 1785.1 | Frydenvang, Karla; Trickey, Peter; Jensen, Birthe Ethoxycarbonylcholine picrate hemihydrate Acta Crystallographica Section C, 1994, 50, 1839-1841 |
| 2010142 | CIF Paper | C26 H21 O P | P 1 2/n 1 | 18.978; 10.921; 19.62 90; 105.02; 90 | 3927 | Kalyanasundari, M.; Panchanatheswaran, K.; Parthasarathi, V.; Robinson, W.T.; Wen, H. Benzoylmethylenetriphenylphosphorane, C~26~H~21~OP Acta Crystallographica Section C, 1994, 50, 1738-1741 |
| 2010393 | CIF Paper | C56 H60 Mo O P4 | P 1 2/n 1 | 15.743; 10.3; 15.83 90; 104.638; 90 | 2483.6 | Pombeiro, A.J.L.; Hills, A.; Hughes, D.L.; Richards, R.L. [MoH~4~(dppe)~2~].thf (dppe = Ph~2~PCH~2~CH~2~PPh~2~; thf = Tetrahydrofuran) Acta Crystallographica Section C, 1995, 51, 23-26 |
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