Crystallography Open Database
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Searching space group like 'I 1 2/a 1'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1564312 | CIF | C34.12 H38.25 Cl1.25 N3 O3 Pd | I 1 2/a 1 | 18.1028; 14.4854; 24.8028 90; 101.78; 90 | 6367 | Dong, Jie; Wang, Baiquan Homo- and copolymerization of norbornene using tridentate IzQO palladium catalysts with dimethylaminoethyl as a side arm Polymer Chemistry, 2021, 12, 4736-4747 |
| 1564344 | CIF | C36 H25 Br Cu N3 O7 | I 1 2/a 1 | 30.0915; 7.7107; 32.6089 90; 117.332; 90 | 6721.5 | Taniguchi, Yoshimasa; Miwa, Mayuka; Kitada, Naoki Crystalline sponge X-ray analysis coupled with supercritical fluid chromatography: a novel analytical platform for the rapid separation, isolation, and characterization of analytes. The Analyst, 2021, 146, 5230-5235 |
| 1564791 | CIF HKL Paper | C15 H16 N O1.5 | I 1 2/a 1 | 17.1405; 8.3052; 18.5156 90; 102.347; 90 | 2574.8 | Diop, Aboubacar; Diop, Tidiane; Diop, Cheikh Abdou Khadre; Tumanov, Nikolay; Ennio, Zangrando; Sidibé, Mamadou (3<i>E</i>)-4-[(Naphthalen-1-yl)amino]pent-3-en-2-one hemihydrate IUCrData, 2021, 6, x210989 |
| 1564849 | CIF | C22 H24 Cu N2 O8 S2 | I 1 2/a 1 | 11.5109; 21.0713; 20.3473 90; 98.719; 90 | 4878.2 | Toikka, Yulia N.; Spiridonova, Dar’ya V.; Novikov, Alexander S.; Bokach, Nadezhda A. Copper(II) Prevents the Saccarine-Dialkylcyanamide Coupling by Forming Mononuclear (Saccharinate)(Dialkylcyanamide)copper(II) Complexes Inorganics, 2021, 9, 69 |
| 1564895 | CIF | C42 H30 N6 O4 Os P | I 1 2/a 1 | 31.9083; 7.4874; 32.008 90; 94.356; 90 | 7624.9 | Lau, Tai-Chu; Xiang, Jing; Ming, Peng; Yi, PAN; Luo, Li-Juan; Cheng, Shun-Cheung; Jin, XinXin; Yiu, Shek-Man; Man, Wai-Lun; Ko, Chi-Chiu; LAU, Kai Chung Visible Light-Induced Oxidative N-dealkylation of Alkylamines by a Luminescent Osmium(VI) Nitrido Complex Chemical Science, 2021 |
| 1565093 | CIF | C40 H26 | I 1 2/a 1 | 18.9032; 7.449; 38.5591 90; 96.953; 90 | 5389.57 | Enomoto, Riku; Hoshi, Megumi; Oyama, Hironaga; Agata, Hideki; Kurokawa, Shinichi; Kuma, Hitoshi; Uekusa, Hidehiro; Murakami, Yoichi van der Waals solid solution crystals for highly efficient in-air photon upconversion under subsolar irradiance. Materials horizons, 2021, 8, 3449-3456 |
| 1565094 | CIF | C40.4 H27.2 O0.2 | I 1 2/a 1 | 18.8241; 7.5014; 38.7559 90; 96.531; 90 | 5437.1 | Enomoto, Riku; Hoshi, Megumi; Oyama, Hironaga; Agata, Hideki; Kurokawa, Shinichi; Kuma, Hitoshi; Uekusa, Hidehiro; Murakami, Yoichi van der Waals solid solution crystals for highly efficient in-air photon upconversion under subsolar irradiance. Materials horizons, 2021, 8, 3449-3456 |
| 1565095 | CIF | C40.4 H27.2 O0.2 | I 1 2/a 1 | 18.8388; 7.4948; 38.7701 90; 96.653; 90 | 5437.2 | Enomoto, Riku; Hoshi, Megumi; Oyama, Hironaga; Agata, Hideki; Kurokawa, Shinichi; Kuma, Hitoshi; Uekusa, Hidehiro; Murakami, Yoichi van der Waals solid solution crystals for highly efficient in-air photon upconversion under subsolar irradiance. Materials horizons, 2021, 8, 3449-3456 |
| 1565096 | CIF | C40.4 H27.2 O0.2 | I 1 2/a 1 | 18.8286; 7.498; 38.7615 90; 96.684; 90 | 5435.03 | Enomoto, Riku; Hoshi, Megumi; Oyama, Hironaga; Agata, Hideki; Kurokawa, Shinichi; Kuma, Hitoshi; Uekusa, Hidehiro; Murakami, Yoichi van der Waals solid solution crystals for highly efficient in-air photon upconversion under subsolar irradiance. Materials horizons, 2021, 8, 3449-3456 |
| 1565238 | CIF | C94 H74 Mn5 N24 O12 | I 1 2/a 1 | 22.7117; 14.5551; 27.4 90; 91.973; 90 | 9052.3 | Tang, Qun; Yang, Yanli; Cheng, Ze; Chen, Xiuni; Lin, Qingmei; Zou, Zhiming; Zou, Hua-Hong; Liang, Fu-Pei Construction and magnetic properties of hemicyclic “phoenix crown” manganese clusters: Molecular assembly from {Mn5} to {Mn10} cluster Inorganica Chimica Acta, 2020, 504, 119438 |
| 1565534 | CIF | C14 H8 Cu N6 S8 | I 1 2/a 1 | 10.3099; 13.9369; 13.8855 90; 93.83; 90 | 1990.7 | Huang, Yulong; Mitchell, Travis; Yost, Dillon C.; Hu, Yong; Benedict, Jason B.; Grossman, Jeffrey C.; Ren, Shenqiang Emerged Metallicity in Molecular Ferromagnetic Wires. Nano letters, 2021, 21, 9746-9753 |
| 1565535 | CIF | C16 H16 N4 O2 | I 1 2/a 1 | 8.5718; 13.3508; 13.009 90; 93.729; 90 | 1485.6 | Purkait, Kallol; Mukherjee, Arindam Cytotoxicity and reactivity of a redox active 1,4-quinone-pyrazole compound and its Ru(II)-p-cymene complex Inorganica Chimica Acta, 2020, 502, 119361 |
| 1565800 | CIF | C21 H18 Ag N O5 | I 1 2/a 1 | 8.3073; 11.9213; 42.89 90; 95.119; 90 | 4230.6 | Azmi, Nurul I.; Zhan, Shun-Ze; Li, Jing-Hong; Razali, Mohd. R. Metal complexes based on substituted aliphatic acid derived from a Diels-Alder adduct: Synthesis and potential ratiometric luminescent temperature sensor of d10 complex Inorganica Chimica Acta, 2019, 498, 119167 |
| 1566158 | CIF | C31 H52 Al B Br4 N4 | I 1 2/a 1 | 11.781; 15.9628; 41.3531 90; 93.4263; 90 | 7762.9 | Guo, Rui; Zhang, Xin; Li, Tong; Li, Qianli; Ruiz, David A.; Liu, Liu Leo; Tung, Chen-Ho; Kong, Lingbing Unraveling the reactivity of a cationic iminoborane: avenues to unusual boron cations Chemical Science, 2022, 13, 2303-2309 |
| 1566245 | CIF | C342 H236 Bi38 N4 O178 Ti16 | I 1 2/a 1 | 25.2403; 43.6932; 49.0721 90; 96.672; 90 | 53751.6 | Zhang, Lei; Ding, Qing-Rong; Yu, Yinghua; Cao, Changsheng; Zhang, Jian Stepwise Assembly and Reversible Structure Transformation of Ligated Titanium Coated Bismuth-Oxo Cores: Shell Morphology Engineering for Enhanced Chemical Fixation of CO2 Chemical Science, 2022 |
| 1566299 | CIF | C16 H18 O4 | I 1 2/a 1 | 15.851; 9.869; 17.994 90; 92.952; 90 | 2811.1 | Chen, De-Li; Chen, Mei-Ying; Hou, Yong; Wang, Can-Hong; Sun, Zhao-Cui; Yang, Yun; Liang, Han-Qiao; Ma, Guo-Xu; Xu, Xu-Dong; Wei, Jian-He Cadinane-Type Sesquiterpenoids with Cytotoxic Activity from the Infected Stems of the Semi-mangrove <i>Hibiscus tiliaceus</i>. Journal of natural products, 2022, 85, 127-135 |
| 1566383 | CIF | C46 H42 B2 F8 Fe N14 | I 1 2/a 1 | 22.0537; 9.5781; 22.3969 90; 98.891; 90 | 4674.11 | Birchall, Lee; Truccolo, Giada; Jackson, Lewis; Shepherd, Helena Jane Co-crystallisation as a Modular Approach to the Discovery of Spin-Crossover Materials Chemical Science, 2022 |
| 1566890 | CIF | C68 H80 Al2 N4 | I 1 2/a 1 | 16.9198; 22.2833; 17.4576 90; 117.934; 90 | 5815.14 | Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules Chemical Science, 2022 |
| 1566897 | CIF | C59.42 H70.28 B N3 | I 1 2/a 1 | 21.747; 19.582; 23.834 90; 90.748; 90 | 10148.8 | Jiang, Long; Wang, Yu; Tan, Dehui; Chen, Xiaobin; Ma, Tinghao; Zhang, Baoliang; Yang, Deng-Tao Access to tetracoordinate boron-doped polycyclic aromatic hydrocarbons with delayed fluorescence and aggregation-induced emission under mild conditions Chemical Science, 2022 |
| 1566943 | CIF | C109 H177 O6 Tm3 | I 1 2/a 1 | 29.457; 16.1306; 46.333 90; 105.969; 90 | 21166 | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization Chemical Science, 2022 |
| 1567099 | CIF | C22 H19 N3 O | I 1 2/a 1 | 21.1606; 7.1694; 25.5604 90; 110.862; 90 | 3623.5 | Basavaiah, Deevi; Golime, Gangadhararao; Banoth, Shivalal; Todeti, Saidulu An umpolung strategy for intermolecular [2 + 2 + 1] cycloaddition of aryl aldehydes and nitriles: a facile access to 2,4,5-trisubstituted oxazoles. Chemical science, 2022, 13, 8080-8087 |
| 1567113 | CIF | C57 H53 Ag5 F9 N17 O9 S3 | I 1 2/a 1 | 25.7535; 24.5293; 24.9163 90; 91.174; 90 | 15736.7 | Li, Cui-Cui; Zhang, Siqi; Tang, Jian; Jian, Ruijun; Xia, Yu; Zhao, Liang Pyridine dicarbanion-bonded Ag<sub>13</sub> organometallic nanoclusters: synthesis and on-surface oxidative coupling reaction. Chemical science, 2022, 13, 8095-8103 |
| 1567141 | CIF | C12 H16 N4 Ni O4 S | I 1 2/a 1 | 23.012; 6.0848; 10.6386 90; 91.194; 90 | 1489.3 | González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates New Journal of Chemistry, 2022, 46, 14786-14792 |
| 1567284 | CIF | C30 H40 Cu F6 N8 P | I 1 2/a 1 | 22.442; 10.441; 41.64 90; 91.84; 90 | 9752 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567287 | CIF | C31 H40 Cu F3 N8 O3 S | I 1 2/a 1 | 22.769; 10.613; 42.709 90; 90.75; 90 | 10320 | Heck, Joshua; Metz, Fabian; Buchenau, Sören; Teubner, Melissa; Grimm-Lebsanft, Benjamin; Spaniol, Thomas P.; Hoffmann, Alexander; Rübhausen, Michael A.; Herres-Pawlis, Sonja Manipulating electron transfer – the influence of substituents on novel copper guanidine quinolinyl complexes Chemical Science, 2022, 13, 8274-8288 |
| 1567467 | CIF | C79 H55.5 B Cl2 F20 N3 O3 | I 1 2/a 1 | 32.5289; 13.8777; 32.5269 90; 96.618; 90 | 14585.7 | Sato, Hiroki; Suizu, Rie; Kato, Tomoki; Yagi, Akiko; Segawa, Yasutomo; Awaga, Kunio; Itami, Kenichiro N-doped nonalternant aromatic belt via a six-fold annulative double N-arylation Chemical Science, 2022 |
| 1567553 | CIF | C44 H114 N10 Si12 U2 | I 1 2/a 1 | 24.4164; 11.4199; 29.7959 90; 106.683; 90 | 7958.4 | Modder, dieuwertje; Batov, Mikhail; Rajeshkumar, Thayalan; Scopelliti, Rosario; Zivkovic, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Assembling Diuranium Complexes in Different States of Charge with a Bridging Redox-Active Ligand Chemical Science, 2022 |
| 1567555 | CIF | C62 H150 K N12 O6 Si12 U2 | I 1 2/a 1 | 29.9688; 11.6805; 32.306 90; 115.332; 90 | 10221.3 | Modder, dieuwertje; Batov, Mikhail; Rajeshkumar, Thayalan; Scopelliti, Rosario; Zivkovic, Ivica; Sienkiewicz, Andrzej; Maron, Laurent; Mazzanti, Marinella Assembling Diuranium Complexes in Different States of Charge with a Bridging Redox-Active Ligand Chemical Science, 2022 |
| 1567582 | CIF | C57 H84 F3 N2 O4.5 S | I 1 2/a 1 | 17.3378; 16.0403; 38.924 90; 95.096; 90 | 10782.1 | Théry, Valentin; Molton, Florian; Sirach, Selim; Tillet, Neven; Pécaut, Jacques; Tomás-Mendivil, Eder; Martin, David The curious case of a sterically crowded Stenhouse salt Chemical Science, 2022, 13, 9755-9760 |
| 1567652 | CIF | C29.5 H31 Cl N2 | I 1 2/a 1 | 22.0567; 7.5133; 32.5379 90; 109.612; 90 | 5079.32 | Cui, Xian-Chao; Zhang, Hu; Wang, Yi-Ping; Qu, Jian-Ping; Kang, Yan-Biao Synthesis of carbinoxamine via α-C(sp3)–H 2-pyridylation of O, S or N-containing compounds enabled by non-D–A-type super organoreductants and sulfoxide- or sulfide HAT reagents Chemical Science, 2022, 13, 11246-11251 |
| 1567655 | CIF | C24 H28 Br4 N4 O4 | I 1 2/a 1 | 20.6359; 5.1809; 27.7349 90; 104.528; 90 | 2870.4 | 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 |
| 1567805 | CIF | C35 H56 F9 N6 O9 S3 | I 1 2/a 1 | 11.2729; 20.2466; 19.5699 90; 92.742; 90 | 4461.5 | Nayak, Mithilesh Kumar; Sarkar, Pallavi; Elvers, Benedict J.; Mehta, Sakshi; Zhang, Fangyuan; Chrysochos, Nicolas; Krummenacher, Ivo; Vijayakanth, Thangavel; Narayanan, Ramakirushnan Suriya; Dolai, Ramapada; Roy, Biswarup; Malik, Vishal; Rawat, Hemant; Mondal, Abhishake; Boomishankar, Ramamoorthy; Pati, Swapan K.; Braunschweig, Holger; Schulzke, Carola; Ravat, Prince; Jana, Anukul A bis-NHC–CAAC dimer derived dicationic diradical Chemical Science, 2022, 13, 12533-12539 |
| 1568097 | CIF | C9 H5 Cl N O6 Re | I 1 2/a 1 | 9.3367; 11.1259; 22.22 90; 99.672; 90 | 2275.39 | Karges, Johannes; Giardini, Miriam A.; Blacque, Olivier; Woodworth, Brendon; Siqueira-Neto, Jair L; Cohen, Seth M. Enantioselective inhibition of the SARS-CoV-2 main protease with rhenium(i) picolinic acid complexes. Chemical science, 2023, 14, 711-720 |
| 1568101 | CIF | C10 H8 N O6 Re | I 1 2/a 1 | 9.2924; 11.1464; 22.2675 90; 100.09; 90 | 2270.73 | Karges, Johannes; Giardini, Miriam A.; Blacque, Olivier; Woodworth, Brendon; Siqueira-Neto, Jair L; Cohen, Seth M. Enantioselective inhibition of the SARS-CoV-2 main protease with rhenium(i) picolinic acid complexes. Chemical science, 2023, 14, 711-720 |
| 1568102 | CIF | C20 H18 N2 O13 Re2 | I 1 2/a 1 | 22.7527; 10.614; 21.7337 90; 109.916; 90 | 4934.72 | Karges, Johannes; Giardini, Miriam A.; Blacque, Olivier; Woodworth, Brendon; Siqueira-Neto, Jair L; Cohen, Seth M. Enantioselective inhibition of the SARS-CoV-2 main protease with rhenium(i) picolinic acid complexes. Chemical science, 2023, 14, 711-720 |
| 1568111 | CIF | C10 H10 N O8 Re | I 1 2/a 1 | 8.8821; 11.136; 26.399 90; 93.457; 90 | 2606.4 | Karges, Johannes; Giardini, Miriam A.; Blacque, Olivier; Woodworth, Brendon; Siqueira-Neto, Jair L; Cohen, Seth M. Enantioselective inhibition of the SARS-CoV-2 main protease with rhenium(i) picolinic acid complexes. Chemical science, 2023, 14, 711-720 |
| 1568116 | CIF | C10 H10 N O7 Re | I 1 2/a 1 | 9.1881; 11.0679; 25.0097 90; 97.989; 90 | 2518.63 | Karges, Johannes; Giardini, Miriam A.; Blacque, Olivier; Woodworth, Brendon; Siqueira-Neto, Jair L; Cohen, Seth M. Enantioselective inhibition of the SARS-CoV-2 main protease with rhenium(i) picolinic acid complexes. Chemical science, 2023, 14, 711-720 |
| 1568119 | CIF | C9 H7 F N O7 Re | I 1 2/a 1 | 9.0438; 11.1598; 23.9385 90; 96.213; 90 | 2401.85 | Karges, Johannes; Giardini, Miriam A.; Blacque, Olivier; Woodworth, Brendon; Siqueira-Neto, Jair L; Cohen, Seth M. Enantioselective inhibition of the SARS-CoV-2 main protease with rhenium(i) picolinic acid complexes. Chemical science, 2023, 14, 711-720 |
| 1568202 | CIF | C29 H52 N4 O6 | I 1 2/a 1 | 25.8831; 5.6524; 43.78 90; 94.085; 90 | 6388.8 | Alexander, Carlson; Thom, James A.; Kenwright, Alan M.; Christensen, Kirsten E.; Sørensen, Thomas Just; Faulkner, Stephen Chelating chloride using binuclear lanthanide complexes in water. Chemical science, 2023, 14, 1194-1204 |
| 1568352 | CIF | C34 H34 N6 O2 Sn2 | I 1 2/a 1 | 15.389; 8.8015; 23.005 90; 101.75; 90 | 3050.6 | Sikora, Philipp; Naumann, Robert; Förster, Christoph; Heinze, Katja Excited state energy landscape of phosphorescent group 14 complexes. Chemical science, 2023, 14, 2489-2500 |
| 1568599 | CIF | C12 H9 N5 | I 1 2/a 1 | 20.845; 4.6353; 22.7163 90; 107.329; 90 | 2095.29 | Ershov, Ivan S.; Esikov, Kirill A.; Nesterova, Olga M.; Skryl’nikova, Mariya A.; Khramchikhin, Andrey V.; Shmaneva, Nadezda T.; Chernov, Ivan S.; Chernova, Ekaterina N.; Puzyk, Aleksandra M.; Sivtsov, Eugene V.; Pavlyukova, Yuliya N.; Trifonov, Rostislav E.; Ostrovskii, Vladimir A. 3-(5-Phenyl-2H-tetrazol-2-yl)pyridine Molbank, 2023, 2023, M1598 |
| 1568820 | CIF | C13 H13 N O | I 1 2/a 1 | 16.2725; 5.9701; 23.8665 90; 103.114; 90 | 2258.13 | Gorenskaia, Elena; Potter, Jarred; Korb, Marcus; Lambert, Colin; Low, Paul J. Exploring relationships between chemical structure and molecular conductance: from α,ω-functionalised oligoynes to molecular circuits. Nanoscale, 2023, 15, 10573-10583 |
| 1569030 | CIF | C7 H4 Gd K4 N7 O6 S7 | I 1 2/a 1 | 20.0701; 6.4604; 22.2814 90; 107.245; 90 | 2759.15 | Wan, Qingyun; Arczyński, Mirosław; Wakizaka, Masanori; Gupta, Shraddha; Funakoshi, Nobuto; Yamashita, Masahiro Single-Ion Magnetism in a Three-Dimensional Thiocyanate-Bridged Dysprosium(III) Framework Chemistry, 2023, 5, 987-995 |
| 1569031 | CIF | C7 H4 Dy K4 N7 O6 S7 | I 1 2/a 1 | 20.0808; 6.4405; 22.2609 90; 107.379; 90 | 2747.58 | Wan, Qingyun; Arczyński, Mirosław; Wakizaka, Masanori; Gupta, Shraddha; Funakoshi, Nobuto; Yamashita, Masahiro Single-Ion Magnetism in a Three-Dimensional Thiocyanate-Bridged Dysprosium(III) Framework Chemistry, 2023, 5, 987-995 |
| 1569032 | CIF | C7 H4 K4 N7 O6 S7 Tb | I 1 2/a 1 | 20.0705; 6.4492; 22.255 90; 107.304; 90 | 2750.28 | Wan, Qingyun; Arczyński, Mirosław; Wakizaka, Masanori; Gupta, Shraddha; Funakoshi, Nobuto; Yamashita, Masahiro Single-Ion Magnetism in a Three-Dimensional Thiocyanate-Bridged Dysprosium(III) Framework Chemistry, 2023, 5, 987-995 |
| 1569125 | CIF | C103 H111 Ag3 Au6 B5 F20 N21 | I 1 2/a 1 | 28.2746; 33.2019; 29.4805 90; 106.484; 90 | 26537.9 | Lei, Zhen; Zhao, Pei; Pei, Xiao-Li; Ube, Hitoshi; Ehara, Masahiro; Shionoya, Mitsuhiko Photoluminescence control by atomically precise surface metallization of C-centered hexagold(i) clusters using N-heterocyclic carbenes. Chemical science, 2023, 14, 6207-6215 |
| 1569126 | CIF | C123 H109 Ag4 Au6 B6 Cl4 F24 N27 | I 1 2/a 1 | 35.541; 15.07664; 50.5683 90; 93.2056; 90 | 27054.1 | Lei, Zhen; Zhao, Pei; Pei, Xiao-Li; Ube, Hitoshi; Ehara, Masahiro; Shionoya, Mitsuhiko Photoluminescence control by atomically precise surface metallization of C-centered hexagold(i) clusters using N-heterocyclic carbenes. Chemical science, 2023, 14, 6207-6215 |
| 1569162 | CIF | C58 H63 Br N4 O4 | I 1 2/a 1 | 14.8971; 23.3372; 33.3618 90; 92.469; 90 | 11587.7 | Perera, Tharushi A.; Taylor, William V.; Gildner, M. Brenton; Reinheimer, Eric W.; Ito, Sho; Nelson, Anna; Yost, Shane R.; Hudnall, Todd W. Photochemical reactions of a diamidocarbene: cyclopropanation of bromonaphthalene, addition to pyridine, and activation of sp<sup>3</sup> C-H bonds. Chemical science, 2023, 14, 7867-7874 |
| 1569168 | CIF | C31 H51 Al K N3 O1.5 Si2 | I 1 2/a 1 | 18.16775; 13.05007; 30.7237 90; 102.709; 90 | 7105.83 | Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Coles, Martyn P. Controlled reductive C-C coupling of isocyanides promoted by an aluminyl anion. Chemical science, 2023, 14, 6278-6288 |
| 1569369 | CIF | C28 H15 N O2 | I 1 2/a 1 | 15.167; 10.9238; 11.5354 90; 94.397; 90 | 1905.57 | Wu, Yimin; Liu, Xiaoyu; Liu, Junjie; Yang, Ge; Han, Songyan; Yang, Dezhi; Cao, Xiaosong; Ma, Dongge; Bin, Zhengyang; You, Jingsong Geometry engineering of a multiple resonance core <i>via</i> a phenyl-embedded strategy toward highly efficient narrowband blue OLEDs. Materials horizons, 2023, 10, 3785-3790 |
| 1569480 | CIF | C29.5 H28 N2 O4.5 S | I 1 2/a 1 | 21.8311; 8.2255; 29.1754 90; 93.759; 90 | 5227.8 | Zhang, Pengfei; Jiang, Zhiwei; Fan, Zhoulong; Li, Guoshuai; Ma, Qingxue; Huang, Jun; Tang, Jinghong; Xu, Xiaohua; Yu, Jin-Quan; Jin, Zhong Macrocyclization <i>via</i> remote <i>meta</i>-selective C-H olefination using a practical indolyl template. Chemical science, 2023, 14, 8279-8287 |
| 1569489 | CIF | C28 H16 F8 O4 | I 1 2/a 1 | 17.2008; 8.132; 33.0797 90; 91.243; 90 | 4626 | Guo, Shen-Yi; Zhang, Zhuo-Ang; Tong, Shuo; Guo, Qing-Hui; Hua, Ruimao; Wang, Mei-Xiang Tetrahomo corona[4]arene-based spirophanes: synthesis, structure, and properties. Chemical science, 2023, 14, 8393-8400 |
| 1569669 | CIF | C136 H128 Ag9 Au5 Cu2 O2 P4 S8 | I 1 2/a 1 | 28.0881; 18.3857; 82.4807 90; 91.541; 90 | 42579.2 | Cao, Yaoyao; Xu, Ying; Shen, Honglei; Pan, Peiyao; Zou, Xuejuan; Kang, Xi; Zhu, Manzhou Probing the surface-active sites of metal nanoclusters with atomic precision: a case study of Au<sub>5</sub>Ag<sub>11</sub>. Nanoscale, 2023, 15, 13784-13789 |
| 1569890 | CIF | C16 H24 Cl2 Fe N6 | I 1 2/a 1 | 17.306; 9.454; 36.444 90; 97.32; 90 | 5914 | Conrads, Christian; Burkart, Lisa; Soerensen, Sven; Noichl, Sandra; Kara, Yasemin; Heck, Joshua; Hoffmann, Alexander; Herres-Pawlis, Sonja Understanding structure–activity relationships: iron(ii) complexes of “Legacy Guanidines” as catalysts for the synthesis of polylactide Catalysis Science & Technology, 2023, 13, 6006-6021 |
| 1569989 | CIF | C34 H26 N2 S2 | I 1 2/a 1 | 9.8916; 25.9653; 10.937 90; 109.525; 90 | 2647.5 | 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 |
| 1570006 | CIF Paper | C76 H56 N4 O4 S4 Zn2 | I 1 2/a 1 | 20.2935; 16.6798; 25.1409 90; 109.835; 90 | 8005.1 | 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 |
| 1570017 | CIF | C17 H23 N O2 | I 1 2/a 1 | 14.635; 10.097; 20.471 90; 103.824; 90 | 2937.4 | Just, David; Gonçalves, Carlos R; Vezonik, Uroš; Kaiser, Daniel; Maulide, Nuno General acid-mediated aminolactone formation using unactivated alkenes. Chemical science, 2023, 14, 10806-10811 |
| 1570264 | CIF | C112 H242 K2.8 N4 O42.8 Si7.2 U2.54 | I 1 2/a 1 | 18.1765; 24.9651; 32.6981 90; 90.4373; 90 | 14837.3 | Jori, Nadir; Keener, Megan; Rajeshkumar, Thayalan; Scopelliti, Rosario; Maron, Laurent; Mazzanti, Marinella Dinitrogen cleavage by a dinuclear uranium(iii) complex. Chemical science, 2023, 14, 13485-13494 |
| 1570443 | CIF | C4 H10 O | I 1 2/a 1 | 7.7073; 4.0885; 13.233 90; 93.793; 90 | 416.08 | Sacharczuk, Natalia; Olejniczak, Anna; Bujak, Maciej; Dziubek, Kamil Filip; Katrusiak, Andrzej; Podsiadło, Marcin Conformation-aggregation interplay in the simplest aliphatic ethers probed under high pressure. IUCrJ, 2024, 11, 57-61 |
| 1570492 | CIF | C92 H96 Fe6 In13 N6 O46 | I 1 2/a 1 | 27.37206; 15.00755; 31.8968 90; 94.0511; 90 | 13070.1 | Zhang, Rong; Lan, Jiajing; Wang, Fei; Chen, Shumei; Zhang, Jian Aggregate assembly of ferrocene functionalized indium-oxo clusters. Chemical science, 2024, 15, 726-735 |
| 1570527 | CIF | C30 H31 B F4 Mn N5 O3 | I 1 2/a 1 | 23.6994; 8.0465; 33.4683 90; 99.912; 90 | 6287.04 | Gulyaeva, Ekaterina S.; Osipova, Elena S.; Kovalenko, Sergey A.; Filippov, Oleg A.; Belkova, Natalia V.; Vendier, Laure; Canac, Yves; Shubina, Elena S.; Valyaev, Dmitry A. Two active species from a single metal halide precursor: a case study of highly productive Mn-catalyzed dehydrogenation of amine-boranes <i>via</i> intermolecular bimetallic cooperation. Chemical science, 2024, 15, 1409-1417 |
| 1570561 | CIF Paper | C12 H26 N2 Ni O12 S2 | I 1 2/a 1 | 15.4103; 10.1338; 13.4284 90; 108.692; 90 | 1986.44 | Suyunov, Jabbor R.; Turaev, Khayit Kh.; Alimnazarov, Bekmurod Kh.; Ibragimov, Aziz B.; Mengnorov, Islombek J.; Rasulov, Abdusamat A.; Ashurov, Jamshid M. Tetraaqua(ethane-1,2-diamine-κ2 N,N′)nickel(II) naphthalene-1,5-disulfonate dihydrate IUCrData, 2023, 8 |
| 1570568 | CIF | Dy2 O5 Si | I 1 2/a 1 | 10.4642; 6.74981; 12.5396 90; 102.739; 90 | 863.89 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
| 1570569 | CIF | Dy2 O5 Si | I 1 2/a 1 | 10.4617; 6.74837; 12.5382 90; 102.748; 90 | 863.37 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
| 1570570 | CIF | Er2 O5 Si | I 1 2/a 1 | 10.369; 6.7028; 12.464 90; 102.533; 90 | 845.62 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
| 1570571 | CIF | Ho2 O5 Si | I 1 2/a 1 | 10.4156; 6.7273; 12.5019 90; 102.63; 90 | 854.8 | Ciomaga Hatnean, Vasile Cristian; Pui, Aurel; Simonov, Arkadiy; Ciomaga Hatnean, Monica Crystal Growth of the R2SiO5 Compounds (R = Dy, Ho, and Er) by the Floating Zone Method Using a Laser-Diode-Heated Furnace Crystals, 2023, 13, 1687 |
| 1570813 | CIF | C50 H51 B F15 K N O4 | I 1 2/a 1 | 23.8532; 21.0638; 21.3167 90; 97.97; 90 | 10606.9 | Morales, Agustín; Gonçalves, Caroline; Sournia-Saquet, Alix; Vendier, Laure; Lledós, Agustí; Baslé, Olivier; Bontemps, Sébastien Single electron reduction of NHC-CO<sub>2</sub>-borane compounds. Chemical science, 2024, 15, 3165-3173 |
| 1570978 | CIF | C31 H23 Br N2 O | I 1 2/a 1 | 15.4196; 7.0728; 44.912 90; 93.069; 90 | 4891.1 | Zhong, Weiren; Zhang, Jianyu; Lin, Yuting; Li, Shouji; Yang, Yalan; Wang, Wen-Jin; Si, Chuanling; Kühn, Fritz E; Zhao, Zheng; Cai, Xu-Min; Tang, Ben Zhong Multi-site isomerization of synergistically regulated stimuli-responsive AIE materials toward multi-level decryption. Chemical science, 2024, 15, 3920-3927 |
| 1571063 | CIF | C48 H38 B N O S | I 1 2/a 1 | 18.072; 9.2591; 42.868 90; 93.026; 90 | 7163 | Li, Chuan; Zhang, Kai; Luo, Yanju; Yang, Yang; Huang, Yong; Jia, Mengjiao; He, Yuling; Lei, Yue; Tang, Jian-Xin; Huang, Yan; Lu, Zhiyun Realizing highly efficient deep-blue organic light-emitting diodes towards Rec.2020 chromaticity by restricting the vibration of the molecular framework. Chemical science, 2024, 15, 4790-4796 |
| 1571423 | CIF | C24 H44 F12 Li4 N4 O14 S5 | I 1 2/a 1 | 10.398; 19.9938; 22.173 90; 95.895; 90 | 4585.29 | Philippi, Frederik; Middendorf, Maleen; Shigenobu, Keisuke; Matsuyama, Yuna; Palumbo, Oriele; Pugh, David; Sudoh, Taku; Dokko, Kaoru; Watanabe, Masayoshi; Schönhoff, Monika; Shinoda, Wataru; Ueno, Kazuhide Evolving Better Solvate Electrolytes for Lithium Secondary Batteries Chemical Science, 2024 |
| 1571471 | CIF | C3 Na2 O2 | I 1 2/a 1 | 8.313; 7.2925; 6.4432 90; 102.186; 90 | 381.8 | Krüger, Markus; Lamann-Glees, Alexandra; Sebastian, Sean S; Siegel, Renée; Senker, Jürgen; Hempelmann, Jan; Dronskowski, Richard; Ruschewitz, Uwe Na<sub>2</sub>C<sub>3</sub>O<sub>2</sub>: The First Crystalline Compound with the Elusive <sup>-</sup>C≡C-COO<sup>-</sup> Anion. Angewandte Chemie (International ed. in English), 2024, e202402978 |
| 1571720 | CIF | C10 H22 Mg N4 O14 | I 1 2/a 1 | 24.6517; 6.4107; 26.2782 90; 106.673; 90 | 3978.3 | Li, Yang; Ok, Kang Min Crystal clear: unveiling giant birefringence in organic-inorganic cocrystals Chemical Science, 2024 |
| 2000163 | CIF Paper | C6 H16 N O6 P | I 1 2/a 1 | 15.108; 4.636; 28.819 90; 98.62; 90 | 1995.7 | Macíček, J.; Vladkova, T. Structure of {εpsilon}-ammoniohexanoic acid dihydrogenphosphate Acta Crystallographica Section C, 1991, 47, 2709-2711 |
| 2000182 | CIF Paper | C18 H15 Br O | I 1 2/a 1 | 17.607; 8.213; 19.976 90; 93.09; 90 | 2884.5 | Chen, J.; Hwang, C.; Scheffer, J. R.; Trotter, J. Structure and photochemistry of a cyclohexenone and its solid-state photoproduct Acta Crystallographica Section C, 1991, 47, 2417-2419 |
| 2000248 | CIF Paper | C25 H18 Cl2 O | I 1 2/a 1 | 23.95; 6.55; 26.59 90; 96.4; 90 | 4145 | Barnes, J. C.; Horspool, W. M.; Mackie, F. I. 6,6-Dichloro-1-methyl-3,4,5-triphenylbicyclo[3.1.0]hex-3-en-2-one and 3-chloro-2-methyl-4,5,6-triphenylphenol Acta Crystallographica Section C, 1991, 47, 1881-1885 |
| 2000426 | CIF Paper | C14 H16 I2 Pt Te2 | I 1 2/a 1 | 23.807; 9.548; 24.192 90; 136.48; 90 | 3787 | Levason, W.; Webster, M.; Mitchell, C. J. Structure of <i>trans</i>-diiodobis(methyl phenyl telluride)platinum(II) Acta Crystallographica Section C, 1992, 48, 1931-1933 |
| 2000430 | CIF Paper | C24 H21 N2 P | I 1 2/a 1 | 30.4088; 11.5561; 22.9996 90; 101.437; 90 | 7921.7 | Llamas-Saiz, A. L.; Foces-Foces, C.; Elguero, J.; Molina, P.; Alajarín, M.; Vidal, A. Effect of the protonation and of the <i>ortho</i> substitution on the structure of aryliminophosphoranes Acta Crystallographica Section C, 1992, 48, 1940-1945 |
| 2000921 | CIF Paper | C20 H18 Br N O4 | I 1 2/a 1 | 25.259; 4.876; 28.326 90; 96.215; 90 | 3468.2 | Atkinson, A. M.; Rogers, D. Structure of 4-bromo-13α-methyl-13aα<i>H</i>-tetrahydropseudocoptisin Acta Crystallographica Section C, 1992, 48, 931-932 |
| 2000926 | CIF Paper | C18 H28 N10 Ni O16 | I 1 2/a 1 | 16.288; 7.5741; 22.6836 90; 96.606; 90 | 2779.83 | Clegg, W.; Bharadwaj, P. K.; Mandal, S. Structure of [Ni(OH~2~)~2~(NH~2~CH~2~CH~2~CH~2~NH~2~)~2~][picrate]~2~ Acta Crystallographica Section C, 1992, 48, 942-943 |
| 2001151 | CIF Paper | C14 H25.33 Cl2 Fe N6 O1.67 | I 1 2/a 1 | 16.562; 9.704; 36.591 90; 92.21; 90 | 5876.4 | Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W. Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^ Acta Crystallographica Section C, 1993, 49, 2102-2107 |
| 2001152 | CIF Paper | C14 H25.33 Cl2 N6 Ni O1.67 | I 1 2/a 1 | 16.477; 9.677; 36.534 90; 91.9; 90 | 5822.1 | Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W. Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^ Acta Crystallographica Section C, 1993, 49, 2102-2107 |
| 2001153 | CIF Paper | C14 H25.33 Cl2 N6 O1.67 Zn | I 1 2/a 1 | 16.54; 9.709; 36.607 90; 92.01; 90 | 5875 | Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W. Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^ Acta Crystallographica Section C, 1993, 49, 2102-2107 |
| 2001154 | CIF Paper | C14 H24 Cl2 Mn N6 O | I 1 2/a 1 | 13.01; 9.162; 15.669 90; 93.251; 90 | 1864.7 | Bonhôte, P.; Ferigo, M.; Stoeckli-Evans, H.; Marty, W. Structures of 2,6-bis(aminomethyl)pyridine (bamp) complexes of Fe^II^, Ni^II^, Zn^II^, Mn^II^, Co^III^ and Cu^II^ Acta Crystallographica Section C, 1993, 49, 2102-2107 |
| 2001749 | CIF Paper | C6 H8 Cd Cl O3 P | I 1 2/a 1 | 13.885; 5.8864; 21.624 90; 93.25; 90 | 1764.5 | Du, J.-L.; Rettig, S. J.; Thompson, R. C.; Trotter, J. Structure of a polymeric cadmium complex containing triply bridging monophenylphosphinate ligands Acta Crystallographica Section C, 1993, 49, 1035-1036 |
| 2001845 | CIF Paper | C15 H19 Mn N5 O2 S2 | I 1 2/a 1 | 9.902; 12.581; 15.203 90; 101.46; 90 | 1856.2 | Brooker, S.; McKee, V. Seven-coordinate manganese(II) complexes of 2,6-bis[1-(2-hydroxyethylimino)ethyl]pyridine Acta Crystallographica Section C, 1993, 49, 441-445 |
| 2002657 | CIF | O24 Os4 Sr11 | I 1 2/a 1 | 11.703; 16.058; 11.969 90; 90.03; 90 | 2249.3 | Tomaszewska, A; Mueller-Buschbaum, Hk Ein neues gemischtvalentes Oxoosmat (VI, VII): Sr11 (Os6+)2 (Os7+)2 O24 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1993, 619, 1738-1742 |
| 2002672 | CIF | Cu Mo2 O8 Sb | I 1 2/a 1 | 5.554; 4.916; 21.50998 90; 93.42; 90 | 586.3 | Szillat, H; Mueller-Buschbaum, Hk Zur Darstellung und Kristallstruktur eines neuen Kupfer-Antimon- Oxomolybdats: Cu Sb Mo2 O8 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1995, 50, 717-720 |
| 2002737 | CIF | O9 Sr2 V3 | I 1 2/a 1 | 6.929; 16.24599; 7.26 90; 115.82; 90 | 735.7 | Feldmann, J; Mueller-Buschbaum, Hk Kristallstrukturuntersuchung an einem Strontium-Vanadyl-Vanadat: Sr2 (V O) V2 O8 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1995, 50, 43-46 |
| 2002780 | CIF | O9 P2 Sr2 V | I 1 2/a 1 | 6.744; 15.866; 7.032 90; 115.412; 90 | 679.6 | Wadewitz, C; Mueller-Buschbaum, Hk Synthese und Struktur eines Strontium-Vanadyl-Phosphats: Sr (V O) (P O4)2 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1996, 51, 929-933 |
| 2002793 | CIF | As2 O9 Sr2 V | I 1 2/a 1 | 6.8716; 16.30698; 7.196 90; 115.67; 90 | 726.8 | Wadewitz, C; Mueller-Buschbaum, Hk Strukturelle Unterschiede zwischen Sr2 (V O) (As O4)2 und Ba2 (V O) (P O4)2 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1996, 51, 1290-1294 |
| 2002947 | CIF HKL Paper | C6 H10 N2 | I 1 2/a 1 | 14.1911; 8.252; 16.7382 90; 90.696; 90 | 1960 | Infantes, L.; Foces-Foces, C.; Elguero,J. 3(5),4-Dimethyl- and 3,4,5-trimethylpyrazole at 200K. X-ray crystallography and quantum-chemical analysis Acta Crystallographica Section B, 1999, 55, 441-447 |
| 2003486 | CIF HKL Paper | C26 H22 N4 O6 Zn | I 1 2/a 1 | 13.899; 12.156; 15.781 90; 105.84; 90 | 2565.1 | Falvello, L. R.; Hicke, S.; Mueller, T. E. <i>cis</i>-Dipyridine Complex of Bis(ω-nitroacetophenonato)zinc(II) Acta Crystallographica Section C, 1995, 51, 859-861 |
| 2003565 | CIF Paper | C20 H22 Br N O6 | I 1 2/a 1 | 21.974; 7.2; 26.151 90; 110.18; 90 | 3883 | Kariuki, B. M.; Jones, W. Five Salts of Berberine Acta Crystallographica Section C, 1995, 51, 1234-1240 |
| 2004458 | CIF Paper | C26 H22 Mn N4 O6 | I 1 2/a 1 | 13.847; 12.2; 15.981 90; 105.72; 90 | 2598.7 | Hicke, S.; Mueller, T. E.; Falvello, L. R. <i>cis</i>-Dipyridine Complex of Bis(ω-nitroacetophenonato)manganese(II) Acta Crystallographica Section C, 1996, 52, 307-309 |
| 2005492 | CIF Paper | C18 H10 Ag2 F6 N4 O7 S2 | I 1 2/a 1 | 13.032; 11.948; 16.295 90; 103.83; 90 | 2463.7 | Venkataraman, D.; Gardner, G. B.; Covey, A. C.; Lee, S.; Moore, J. S. Silver(I) Complexes of 1,4-Dicyanobenzene Acta Crystallographica Section C, 1996, 52, 2416-2419 |
| 2006008 | CIF Paper | C15 H22 O2 | I 1 2/a 1 | 17.812; 8.2826; 19.064 90; 99.878; 90 | 2770.8 | Boss, C.; Stoeckli-Evans, H.; Keese, R. <i>meso</i>-1,11-Dimethylcyclotrideca-2,9-diyne-1,11-diol Acta Crystallographica Section C, 1997, 53, 322-325 |
| 2006009 | CIF Paper | C15 H22 O2 | I 1 2/a 1 | 17.779; 8.238; 18.881 90; 99.92; 90 | 2724 | Boss, C.; Stoeckli-Evans, H.; Keese, R. <i>meso</i>-1,11-Dimethylcyclotrideca-2,9-diyne-1,11-diol Acta Crystallographica Section C, 1997, 53, 322-325 |
| 2006064 | CIF HKL Paper | C8 H24 F12 N4 Ni P2 S2 | I 1 2/a 1 | 17.582; 9.451; 24.558 90; 98.88; 90 | 4032 | Blake, A. J.; Danks, J. P.; Parsons, S.; Schröder, M. Bis[bis(2-aminoethyl-<i>N</i>)sulfide-<i>S</i>]nickel(II) Bis(hexafluorophosphate) Acta Crystallographica Section C, 1997, 53, 411-413 |
| 2006371 | CIF Paper | C12 H13 N2 O0.5 S2 | I 1 2/a 1 | 18.781; 5.292; 24.948 90; 90.47; 90 | 2479.5 | Kaitner, Branko; Pavlović, Gordana 2,2'-Diaminodiphenyl Disulfide Hemihydrate Acta Crystallographica Section C, 1997, 53, 1103-1105 |
| 2006528 | CIF Paper | C15 H10 Cl F N2 S | I 1 2/a 1 | 22.093; 7.878; 31.473 90; 100.28; 90 | 5389.9 | Bruno, Giuseppe; Chimirri, Alba; Monforte, Anna Maria; Nicoló, Francesco; Scopelliti, Rosario 1-Aryl-1<i>H</i>,3<i>H</i>-thiazolo[3,4-<i>a</i>]benzimidazole Derivatives Acta Crystallographica Section C, 1997, 53, 1337-1341 |
| 2006987 | CIF Paper | C12 H6 Cl2 S2 | I 1 2/a 1 | 21.311; 3.908; 27.581 90; 97.49; 90 | 2277.4 | Chang, Ning-Leh; Thomas, Stewart N.; Lynch, Vincent M.; Simonsen, Stanley H. 2,7-Dichlorothianthrene Acta Crystallographica Section C, 1998, 54, 266-267 |
| 2007086 | CIF Paper | C10 H20 Br4 I2 Pd S4 | I 1 2/a 1 | 14.651; 9.3117; 16.7648 90; 93.468; 90 | 2283 | Blake, Alexander J.; Gilby, Liam M.; Gould, Robert O.; Lippolis, Vito; Parsons, Simon; Schröder, Martin Macrocyclic Thioether Complexes of Palladium with Dibromoiodide Anions Acta Crystallographica Section C, 1998, 54, 295-298 |
| 2007122 | CIF Paper | C5 H5 N3 O2 | I 1 2/a 1 | 18.331; 3.678; 17.052 90; 98.43; 90 | 1137.2 | Angelova, Olyana; Petrova, Rosica; Atanasov, Vladimir 2-(Nitroamino)pyridine Acta Crystallographica Section C, 1998, 54, 441-442 |
| 2007641 | CIF Paper | C24 H22 N3 O2 P | I 1 2/a 1 | 16.599; 13.957; 18.105 90; 95.929; 90 | 4172 | Low, John N.; Ferguson, George; Cobo, Justo; Nogueras, Manuel; Sanchez, Adolfo; Marchal, Antonio 2-Methoxy-3-methyl-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one and 3-Methyl-2-methylthio-6-[(triphenylphosphoranylidene)amino]pyrimidin-4(3<i>H</i>)-one Acta Crystallographica Section C, 1998, 54, 1355-1357 |
| 2008194 | CIF HKL Paper | C9 H15 Cu Na O12 | I 1 2/a 1 | 13.524; 11.221; 18.41 90; 96.06; 90 | 2778.2 | Chui, Stephen Sin Yin; Siu, Alvin; Williams, Ian D. Sodium copper(II) trimesate, [NaCu{C~6~H~3~(COO)~3~}(H~2~O)~4~].2H~2~O, a double-sheet coordination polymer with bridging aqua ligands Acta Crystallographica Section C, 1999, 55, 194-196 |
| 2008402 | CIF Paper | C8 H12 | I 1 2/a 1 | 8.916; 6.0717; 12.62 90; 95.027; 90 | 680.6 | Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja Dispiro[2.1.2.1]octane at 103K Acta Crystallographica Section C, 1999, 55, IUC9900023 |
| 2009006 | CIF Paper | C11 H12 N2 O | I 1 2/a 1 | 12.1685; 13.724; 13.315 90; 114.792; 90 | 2018.7 | Clark, Bernard A. J.; Evans, Matthew C.; Lloyd, Douglas; McNab, Hamish; Parsons, Simon 7-Phenyl-2,3,4,5-tetrahydro-1<i>H</i>-1,4-diazepin-5-one Acta Crystallographica Section C, 1999, 55, 1725-1727 |
| 2009572 | CIF Paper | C16 H26 N2 O4 | I 1 2/a 1 | 21.438; 8.161; 21.655 90; 109.98; 90 | 3560.6 | Frydenvang, K.; Hjelvang, G.; Jensen, B.; Martinho Do Rosario, S.M. Structures of the choline ion in different crystal surroundings Acta Crystallographica Section C, 1994, 50, 617-623 |
| 2009655 | CIF Paper | C18 H28 Cl4 Cu2 N6 O7 | I 1 2/a 1 | 27.048; 10.298; 20.3 90; 102.62; 90 | 5517.8 | Abboud, K.A.; Palenik, R.C.; Palenik, G.J. Dichloro(2,6-diacetylpyridine dioxime-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) 1.5-hydrate Acta Crystallographica Section C, 1994, 50, 525-528 |
| 2009860 | CIF Paper | C5 H9 N4 O Pd S4 | I 1 2/a 1 | 23.39; 3.9832; 23.8 90; 90.46; 90 | 2217 | Abboudi, M.; Mosset, A. A palladium‒dithiooxamide complex Acta Crystallographica Section C, 1994, 50, 1057-1059 |
| 2010213 | CIF | Dy0.028 Er0.018 Gd0.007 H4 O6 P Y0.947 | I 1 2/a 1 | 5.578; 15.006; 6.275 90; 117.83; 90 | 464.5 | Kohlmann, Monika; Sowa, Heidrun; Reithmayer, Klaus; Schulz, Heinz; Krüger, Rolf-Rüdiger; Abriel, Walter Structure of a Y~1-x~(Gd,Dy,Er)~x~PO~4~.2H~2~O Microcrystal Studied Using Synchrotron Radiation Acta Crystallographica Section C, 1994, 50, 1651-1652 |
| 2012118 | CIF HKL Paper | C5 H6 N2 S | I 1 2/a 1 | 9.7411; 7.5931; 17.444 90; 112.682; 90 | 1190.5 | Smith, Matt C.; Davies, Sian C.; Hughes, David L.; Evans, David J. 1<i>H</i>-Pyrrole-2-carbothioamide Acta Crystallographica Section C, 2001, 57, 987-988 |
| 2012133 | CIF HKL Paper | C H5 Be N O4 P | I 1 2/a 1 | 9.6165; 9.0032; 9.6231 90; 90.951; 90 | 833.05 | Harrison, William T. A. [H~3~N(CH~2~)~2~NH~3~]~0.5~[BePO~4~], a beryllophosphate analogue of aluminosilicate zeolite gismondine Acta Crystallographica Section C, 2001, 57, 891-892 |
| 2012195 | CIF HKL Paper | C18 H20 N2 O6 | I 1 2/a 1 | 10.2455; 12.664; 27.446 90; 97.441; 90 | 3531.1 | Zukerman-Schpector, J.; Vega, Mauricio; Caracelli, I.; Dias, Luiz C.; Fernandes, Anna M. A. P. Two intermediates in the synthesis of decahydroisoquinolines with NMDA and AMPA receptor antagonist activity Acta Crystallographica Section C, 2001, 57, 1089-1091 |
| 2012255 | CIF HKL Paper | C16 H15.5 Cl N4 O6.25 | I 1 2/a 1 | 19.5883; 8.0623; 22.936 90; 90.559; 90 | 3622 | Alfonso, Montserrat; Wang, Yi; Stoeckli-Evans, Helen Hydrogen bonding in the inner-salt zwitterion and in two different charged forms of 5,6-bis(2-pyridyl)pyrazine-2,3-dicarboxylic acid Acta Crystallographica Section C, 2001, 57, 1184-1188 |
| 2012912 | CIF HKL Paper | C26 H30 O4 | I 1 2/a 1 | 15.368; 6.22; 23.142 90; 90.44; 90 | 2212.1 | Kuźnik, Nikodem; Zawadiak, Jan; Gilner, Danuta; Wiȩckol, Angelika; Wagner, Paweł; Kubicki, Maciej 1,4-Bis[(1-methyl-1-phenylethyl)peroxymethyl]benzene Acta Crystallographica Section C, 2002, 58, o549-o550 |
| 2013071 | CIF HKL Paper | C18 H22 Cl N5 | I 1 2/a 1 | 24.862; 7.3778; 19.633 90; 101.823; 90 | 3524.8 | Papandreou, Nikolaos C.; Makedonopoulou, Stella; Antoniadou-Vyza, Ekaterini A.; Mavridis, Irene M.; Hamodrakas, Stavros J. 2,4-Diamino-5-(1-naphthyl)-3,5-diaza-1-azoniaspiro[5.5]undeca-1,3-diene chloride Acta Crystallographica Section C, 2002, 58, o730-o732 |
| 2013384 | CIF Paper | C16 H19 N7 S2 | I 1 2/a 1 | 8.0944; 13.9838; 30.482 90; 92.292; 90 | 3447.5 | Blake, Alexander J.; Hubberstey, Peter; Mackrell, Alexander D.; Wilson, Claire 3,6-Dichloro-4-[2-(4-thiamorpholino)ethanesulfanyl]pyridazine and 3,6-bis(pyrazol-1-yl)-4-[2-(4-thiamorpholino)ethanesulfanyl]pyridazine Acta Crystallographica Section C, 2003, 59, o293-o297 |
| 2013487 | CIF HKL Paper | C20 H26 O2 | I 1 2/a 1 | 9.415; 10.739; 15.332 90; 92.58; 90 | 1548.6 | Lakshminarasimhan Damodharan; Vasantha Pattabhi; Rallapalli Sivakumar; Sambasivarao Kotha Precursors to dodecahedrane Acta Crystallographica Section C, 2003, 59, o373-o375 |
| 2013694 | CIF HKL Paper | C8 H8 Br N O2 Te | I 1 2/a 1 | 14.175; 9.582; 15.433 90; 95.7; 90 | 2085.8 | Prabodhika Mallikaratchy; Richard E. Norman; Frank R. Fronczek; Thomas Junk Tribromo(3,5-dimethyl-2-nitrophenyl-κ^2^<i>C</i>^1^,<i>O</i>)tellurium(IV), bromo(3,5-dimethyl-2-nitrophenyl-κ^2^<i>C</i>^1^,<i>O</i>)tellurium(II) and bromo(3,5-dimethyl-2-nitrosophenyl-κ^2^<i>C</i>^1^,<i>O</i>)tellurium(II) Acta Crystallographica Section C, 2003, 59, o571-o574 |
| 2013926 | CIF HKL Paper | C2 H10 As2 N2 O4 | I 1 2/a 1 | 12.7854; 4.6647; 13.3343 90; 91.738; 90 | 794.89 | Lee, Clare; Harrison, William T. A. The <i>catena</i>-arsenite chain anion, [AsO~2~]~<i>n~</i>^<i>n^{-</i>}: (H~3~NCH~2~CH~2~NH~3~)~0.5~[AsO~2~] and NaAsO~2~ (revisited) Acta Crystallographica Section C, 2004, 60, m215-m218 |
| 2014024 | CIF HKL Paper | C8 H6 Ba2 O19 Zr | I 1 2/a 1 | 9.201; 29.032; 9.2079 90; 115.45; 90 | 2221 | Vertruyen, Bénédicte; Robertz, Bénédicte; Guillaume, Bernard; Rulmont, André; Spirlet, Marie-Rose Dibarium zirconium tetraoxalate trihydrate Acta Crystallographica Section C, 2004, 60, m233-m234 |
| 2014464 | CIF HKL Paper | C13 H13 N3 O | I 1 2/a 1 | 13.3571; 10.7473; 15.7604 90; 90.914; 90 | 2262.2 | Grzyb, Justyna A.; Lough, Alan J.; Batey, Robert A. 1<i>H</i>-Imidazol-1-yl 1,2,3,4-tetrahydroisoquinolin-2-yl ketone Acta Crystallographica Section C, 2004, 60, o730-o732 |
| 2014872 | CIF HKL Paper | C33 H30 F12 N8 P2 Ru S3 | I 1 2/a 1 | 23.685; 14.183; 25.264 90; 108.941; 90 | 8027 | Bruno, Giuseppe; Rotondo, Archimede; Tresoldi, Giuseppe; Nicoló, Francesco; Lanza, Santo Bis(di-2-pyridyl sulfide-κ^2^<i>N</i>,<i>N</i>')(4-methylpyrimidin-2-yl 2-pyridylmethyl sulfide-κ^2^<i>N</i>,<i>S</i>)ruthenium(II) bis(hexafluorophosphate) acetonitrile solvate Acta Crystallographica Section C, 2005, 61, m169-m172 |
| 2015666 | CIF HKL Paper | C10 H10 Cl4 Mn N2 | I 1 2/a 1 | 6.9781; 12.7118; 14.1568 90; 91.206; 90 | 1255.5 | Li, Ming-Xue; Li, Su-Zhi <i>catena</i>-Poly[4,4'-bipyridinium [[<i>cis</i>-dichloromanganese(II)]-di-μ-chloro]], a novel manganese(II) coordination polymer with 4,4'-bipyridinium Acta Crystallographica Section C, 2006, 62, m525-m526 |
| 2016260 | CIF HKL Paper | C4 H13 Cl2 N5 O2 | I 1 2/a 1 | 9.4045; 8.6089; 13.742 90; 107.742; 90 | 1059.67 | Gustavo Portalone; Marcello Colapietro Hydrogen-bonded supramolecular motifs in the 1:1 monohydrated molecular adduct of acetoguanaminium chloride with acetoguanamine and in 2,4,6-triaminopyrimidinediium dichloride dihydrate Acta Crystallographica Section C, 2007, 63, o655-o658 |
| 2016554 | CIF HKL Paper | C12 H20 N6 O4 | I 1 2/a 1 | 9.441; 16.347; 18.799 90; 90.045; 90 | 2901.3 | Orozco, Fabían; Insuasty, Braulio; Low, John N.; Cobo, Justo; Glidewell, Christopher Hydrogen-bonded sheet structures in neutral, anionic and hydrated 6-amino-2-(morpholin-4-yl)-5-nitrosopyrimidines Acta Crystallographica Section C, 2008, 64, o220-o225 |
| 2016587 | CIF HKL Paper | C32 H33 Cl Cu N7 O4 | I 1 2/a 1 | 21.834; 12.948; 23.502 90; 97.039; 90 | 6594 | Stibrany, Robert T.; Potenza, Joseph A. An alternating copolymer containing trigonal planar homocoordinated copper(I) ions: <i>catena</i>-poly[[[bis[μ-(<i>E</i>)-1,2-bis(1-ethyl-1<i>H</i>-benzimidazol-2-yl)ethene-κ^2^<i>N</i>^3^:<i>N</i>^3'^]dicopper(I)]-μ-(<i>E</i>)-1,2-bis(1-ethyl-1<i>H</i>-benzimidazol-2-yl)ethene-κ^2^<i>N</i>^3^:<i>N</i>^3'^] bis(perchlorate) acetonitrile disolvate] Acta Crystallographica Section C, 2008, 64, m213-m216 |
| 2016604 | CIF HKL Paper | C20 H18 Cl2 N O1.5 | I 1 2/a 1 | 15.61; 13.2847; 17.2233 90; 91.358; 90 | 3570.7 | Prukała, Wiesław; Prukała, Dorota; Kubicki, Maciej Isomorphism in 1-(2-halidobenzyl)-4-[(<i>E</i>)-2-(3-hydroxyphenyl)ethenyl]pyridinium halide hemihydrates (halide = Cl, Br) Acta Crystallographica Section C, 2008, 64, o269-o271 |
| 2016605 | CIF HKL Paper | C20 H18 Br2 N O1.5 | I 1 2/a 1 | 15.6975; 13.5505; 17.2562 90; 92.879; 90 | 3665.9 | Prukała, Wiesław; Prukała, Dorota; Kubicki, Maciej Isomorphism in 1-(2-halidobenzyl)-4-[(<i>E</i>)-2-(3-hydroxyphenyl)ethenyl]pyridinium halide hemihydrates (halide = Cl, Br) Acta Crystallographica Section C, 2008, 64, o269-o271 |
| 2016719 | CIF HKL Paper | C4 H10 Cl2 Cu N2 O4 | I 1 2/a 1 | 15.224; 3.9694; 15.444 90; 94.73; 90 | 930.1 | Sarangarajan, Thanjavur R.; Krishnamoorthy, Belli S.; Panchanatheswaran, Krishnaswamy; Low, John N.; Glidewell, Christopher Three-dimensional frameworks built from piperazine-2,5-dione and simple metal salts (<i>M</i> = Co, Ni, Cu and Ag) Acta Crystallographica Section C, 2008, 64, m286-m291 |
| 2016834 | CIF HKL Paper | C6 H21 Eu O12 S3 | I 1 2/a 1 | 24.323; 5.4408; 27.066 90; 111.328; 90 | 3336.5 | Wallus, Sarah; Frank, Walter The first structural characterization of a rare earth ethanesulfonate Acta Crystallographica Section C, 2008, 64, m384-m386 |
| 2018212 | CIF HKL Paper | C52 H40 Cl4 Cu4 N4 O12 | I 1 2/a 1 | 20.326; 14.184; 36.696 90; 94.89; 90 | 10541 | Moncol, Jan; Jomova, Klaudia; Zelenicky, Lubomir; Lis, Tadeusz; Valko, Marian A tetranuclear copper(II) cluster: bis(μ-4-chlorobenzoato-κ^2^<i>O</i>:<i>O</i>')(4-chlorobenzoato-κ^2^<i>O</i>,<i>O</i>')(4-chlorobenzoato-κ<i>O</i>)tetrakis(μ~3~-2-pyridylmethanolato-κ^4^<i>N</i>,<i>O</i>:<i>O</i>:<i>O</i>)tetracopper(II) Acta Crystallographica Section C, 2011, 67, m318-m320 |
| 2018252 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.999; 6.7318; 21.1835 90; 101.887; 90 | 2651.2 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
| 2018253 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.77; 6.645; 20.8 90; 101.61; 90 | 2541 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
| 2018254 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.604; 6.583; 20.295 90; 101.5; 90 | 2436 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
| 2018255 | CIF HKL Paper | H8 N O11 Rb Te4 | I 1 2/a 1 | 18.501; 6.542; 20.045 90; 101.41; 90 | 2378.2 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
| 2018256 | CIF HKL Paper | H N O11 Rb Te4 | I 1 2/a 1 | 18.344; 6.473; 19.62 90; 101.4; 90 | 2284 | Friese, K.; Halasyamani, P. S.; Tolkiehn, M.; Grzechnik, A. A high-pressure single-crystal synchrotron diffraction study of NH~4~RbTe~4~O~9~·2H~2~O: stability of three different TeO~<i>x~</i> coordination polyhedra Acta Crystallographica Section C, 2011, 67, i45-i49 |
| 2018603 | CIF HKL Paper | C9 H11 N O6 | I 1 2/a 1 | 17.241; 6.1519; 20.71 90; 107.96; 90 | 2089.6 | Tutughamiarso, Maya; Pisternick, Thorsten; Egert, Ernst Pseudopolymorphs of chelidamic acid and its dimethyl ester Acta Crystallographica Section C, 2012, 68, o344-o350 |
| 2019171 | CIF Paper | C23 H31 Cl N O3 P Si | I 1 2/a 1 | 17.3791; 14.7131; 20.019 90; 90.464; 90 | 5118.7 | Ouahrouch, Abdelaaziz; Krim, Jamal; Taourirte, Moha; Lazrek, Hassan B.; Engels, Joachim W.; Bats, Jan W. Four related diethyl [(arylamino)(4-ethynylphenyl)methyl]phosphonates Acta Crystallographica Section C, 2013, 69, 1157-1163 |
| 2019268 | CIF Paper | C6 H9 Cl N2 O2 | I 1 2/a 1 | 13.1489; 6.578; 17.0721 90; 90.42; 90 | 1476.59 | Lopez de Diego, Heidi; Koradia, Vishal; Bond, Andrew D. Enantiotropically related polymorphs of gaboxadol hydrochloride Acta Crystallographica Section C, 2013, 69, 1234-1237 |
| 2019436 | CIF HKL Paper | C2 N4 O4 S3 | I 1 2/a 1 | 11.182; 8.436; 8.609 90; 91.36; 90 | 811.9 | Jones, Ray Three trithiadiazepines and a trithiatriazepine Acta Crystallographica Section C, 2014, 70, 60-66 |
| 2019604 | CIF HKL Paper | H12 O14 S2 U | I 1 2/a 1 | 7.519; 13.2464; 11.5073 90; 104.388; 90 | 1110.18 | Burns, Alexander D.; Patrick, Brian O.; Lam, Anita E.; Dreisinger, David The effect of coordinated water on the connectivity of uranium(IV) sulfate <i>x</i>-hydrate: [U(SO~4~)~2~(H~2~O)~5~]·H~2~O and [U(SO~4~)~2~(H~2~O)~6~]·2H~2~O, and a comparison with other known structures Acta Crystallographica Section C, 2014, 70, 726-731 |
| 2020102 | CIF HKL Paper | C8 H12 Br2 F4 N2 | I 1 2/a 1 | 10.9815; 10.8697; 11.1525 90; 111.135; 90 | 1241.7 | Brisdon, Alan K.; Muneer, Abeer M. T.; Pritchard, Robin G. Halogen-bonded adduct of 1,2-dibromo-1,1,2,2-tetrafluoroethane and 1,4-diazabicyclo[2.2.2]octane Acta Crystallographica Section C, 2015, 71 |
| 2020392 | CIF HKL Paper | C11 H13 N3 O8 | I 1 2/a 1 | 17.8382; 10.322; 14.5599 90; 101.06; 90 | 2631.1 | Smith, Graham; Lynch, Daniel E. Cyclic heterotetrameric and low-dimensional hydrogen-bonded polymeric structures in the morpholinium salts of ring-substituted benzoic acid analogues Acta Crystallographica Section C, 2016, 72, 105-111 |
| 2020660 | CIF HKL Paper | C34 H50 Cl6 N2 O5 | I 1 2/a 1 | 14.8441; 13.2872; 21.0311 90; 105.191; 90 | 4003.2 | Cai, Xiao-Qing; Tian, Bei; Zhang, Jian-Nan; Jin, Zhi-Min The hydrogen-bonded complex bis(<i>tert</i>-butylammonium) 2,6-dichlorophenolate 2,4-dichlorophenol‒2,4-dichlorophenolate tetrahydrofuran disolvate containing a chiral <i>R</i>~5~^3^(10) hydrogen-bonded ring as a supramolecular synthon Acta Crystallographica Section C, 2016, 72, 720-723 |
| 2020856 | CIF HKL | C17 H18 Cl Fe N3 O2 | I 1 2/a 1 | 20.8783; 7.4013; 23.2605 90; 108.146; 90 | 3415.6 | Swinton Darious, Robert; Thomas Muthiah, Packianathan; Perdih, Franc Supramolecular architectures in the salt trimethoprimium ferrocene-1-carboxylate and the cocrystal 4-amino-5-chloro-2,6-dimethylpyrimidine‒ferrocene-1-carboxylic acid (1/1) Acta Crystallographica Section C, 2017, 73 |
| 2021391 | CIF Paper | C116 H90.67 As2 Cu8 Eu2 K2 N16 O117.5 W22 | I 1 2/a 1 | 30.5449; 14.2507; 48.6187 90; 107.836; 90 | 20145.9 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2021392 | CIF HKL Paper | C116 H92 As2 Cu8 Gd2 K2 N16 O126 W22 | I 1 2/a 1 | 30.5038; 14.1439; 48.2029 90; 108.131; 90 | 19764.2 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2021393 | CIF HKL Paper | C116 H92 As2 Cu8 K2 N16 O126 Tb2 W22 | I 1 2/a 1 | 30.4415; 14.0792; 48.0609 90; 108.235; 90 | 19564.1 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2021394 | CIF HKL Paper | C116 H88 As2 Cu8 Dy2 K2 N16 O128 W22 | I 1 2/a 1 | 30.481; 14.104; 48.1783 90; 108.247; 90 | 19670.6 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2021395 | CIF HKL Paper | C116 H94 As2 Cu8 Ho2 K2 N16 O128 W22 | I 1 2/a 1 | 30.4802; 14.113; 48.116 90; 108.169; 90 | 19665.9 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2021396 | CIF HKL Paper | C116 H87 As2 Cu8 Er2 K2 N16 O128 W22 | I 1 2/a 1 | 30.581; 14.1638; 48.299 90; 108.273; 90 | 19865 | Parbhakar, Swati; Kaushik, Reetam; Hussain, Firasat Synthesis and characterization of self-assembled inorganic‒organic hybrid arsenotungstates Acta Crystallographica Section C Structural Chemistry, 2018, 74 |
| 2021516 | CIF HKL Paper | C12 H12 N6 O3 | I 1 2/a 1 | 12.189; 18.7185; 12.4701 90; 106.612; 90 | 2726.4 | Oliveira, Ana P. A.; Ferreira, Isabella P.; Despaigne, Angel A. Recio; da Silva, Jeferson G.; Vieira, Ana Carolina S.; Santos, Mariana S.; Alexandre-Moreira, Magna S.; Diniz, Renata; Beraldo, Heloisa Structural studies and antileishmanial activity of 2-acetylpyridine and 2-benzoylpyridine nitroimidazole-derived hydrazones Acta Crystallographica Section C, 2019, 75 |
| 2021716 | CIF HKL Paper | C28 H26 Cd Cl2 N12 O15 | I 1 2/a 1 | 15.146; 12.2411; 17.6555 90; 99.104; 90 | 3232.2 | Tayade, Sakharam B.; Markad, Datta; Kumbhar, Avinash S.; Erxleben, Andrea; Chakravarty, Debamitra Coordination polymers of Cd^II^ and Pb^II^ derived from bipyridine‒glycoluril: influence of metal-ion size and counter-ions Acta Crystallographica Section C, 2019, 75 |
| 2021717 | CIF HKL Paper | C28 H24 Cl2 N12 O14 Pb | I 1 2/a 1 | 15.2909; 14.2702; 15.4064 90; 92.174; 90 | 3359.32 | Tayade, Sakharam B.; Markad, Datta; Kumbhar, Avinash S.; Erxleben, Andrea; Chakravarty, Debamitra Coordination polymers of Cd^II^ and Pb^II^ derived from bipyridine‒glycoluril: influence of metal-ion size and counter-ions Acta Crystallographica Section C, 2019, 75 |
| 2021841 | CIF HKL Paper | C9 H8 N4 | I 1 2/a 1 | 11.4608; 5.3791; 26.74 90; 91.457; 90 | 1648 | Moreno-Fuquen, Rodolfo; Arango-Daraviña, Kevin; Garcia, Esteban; Tenorio, Juan-C.; Ellena, Javier Synthesis, spectroscopic (FT‒IR and UV‒Vis), crystallographic and theoretical studies, and amolecular docking simulation of an imatinib-like template Acta Crystallographica Section C, 2019, 75 |
| 2022236 | CIF HKL Paper | C15 H8 Br I O3 | I 1 2/a 1 | 26.4214; 4.76309; 46.6213 90; 106.034; 90 | 5638.9 | Cong, Nguyen Tien; Trang, Huynh Thi Xuan; Dung, Pham Duc; Phuong, Tran Hoang; Trung, Vu Quoc; Dat, Nguyen Dang; Anh, Dang Thi Tuyet; Tuyen, Nguyen Van; Van Meervelt, Luc Synthesis, structure and <i>in vitro</i> cytotoxicity testing of some 2-aroylbenzofuran-3-ols Acta Crystallographica Section C, 2020, 76 |
| 2022282 | CIF HKL Paper | C24 H14 F6 O4 | I 1 2/a 1 | 23.308; 7.132; 27.253 90; 112.62; 90 | 4182 | Rutherford, Ryan Noboru; Ura, Shinji; Chan, Tak-Hang; Fukumoto, Kozo; Nishioka, Takanori; Renzetti, Andrea Dibenzoate esters of <i>cis</i>-tetralin-2,3-diol as analogs of (‒)-epigallocatechin gallate: synthesis and crystal structure of anticancer drug candidates Acta Crystallographica Section C, 2020, 76 |
| 2022571 | CIF HKL Paper | C21 H16 Br N6 O3 | I 1 2/a 1 | 15.5664; 15.3769; 18.4445 90; 109.359; 90 | 4165.3 | Muresan-Pop, Marieta; Macavei, Sergiu; Turza, Alexandru; Borodi, Gheorghe New solvates and a salt of the anti-HIV compound etravirine Acta Crystallographica Section C, 2021, 77, 698-706 |
| 2022772 | CIF HKL Paper | C65 H60 N12 O10 | I 1 2/a 1 | 16.82625; 16.73298; 26.7833 90; 105.216; 90 | 7276.56 | Palacios Rodríguez, José Carlos; Mendoza, Angel; Sosa Rivadeneyra, Martha; Bernès, Sylvain 2-[3-(1<i>H</i>-Benzimidazol-2-yl)prop-yl]-1<i>H</i>-benzimidazol-3-ium 3,4,5-tri-hydroxy-benzoate-1,3-bis-(1<i>H</i>-benzimidazol-2-yl)propane-ethyl acetate (2/1/2.94): co-crystallization between a salt, a neutral mol-ecule and a solvent. Acta crystallographica. Section E, Crystallographic communications, 2023, 79, 562-566 |
| 2022833 | CIF HKL Paper | C16 H35 Br N2 O4 | I 1 2/a 1 | 12.6692; 7.0967; 22.3413 90; 103.022; 90 | 1957.04 | Carlson, Faith M.; Staples, Richard J.; Biros, Shannon M. Crystal structure of a (carboxymethyl)triethylazanium bromide–2-(triethylazaniumyl)acetate (1/1) hydrogen-bonded dimer Acta Crystallographica Section E Crystallographic Communications, 2023, 79 |
| 2022939 | CIF HKL Paper | C15 H16 N2 O3 | I 1 2/a 1 | 13.742; 8.8912; 23.114 90; 94.742; 90 | 2814.5 | Safarova, Ayten S.; Khalilov, Ali N.; Akkurt, Mehmet; Brito, Ivan; Bhattarai, Ajaya; Naghiyev, Farid N.; Mamedov, Ibrahim G. Crystal structure and Hirshfeld surface analysis of (2Z)-3-oxo-N-phenyl-2-[(1H-pyrrol-2-yl)methylidene]butanamide monohydrate Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1142-1146 |
| 2022951 | CIF HKL Paper | C15 H15 F3 N2 O3 S | I 1 2/a 1 | 21.9709; 5.1271; 27.022 90; 93.633; 90 | 3037.8 | Richter, Adrian; Goddard, Richard; Imming, Peter; Seidel, Rüdiger W. Crystal structure and antimycobacterial evaluation of 2-(cyclohexylmethyl)-7-nitro-5-(trifluoromethyl)benzo[d]isothiazol-3(2H)-one Acta Crystallographica Section E Crystallographic Communications, 2023, 79, 1194-1198 |
| 2023018 | CIF HKL Paper | C23 H19 N O16 Pr2 | I 1 2/a 1 | 27.4898; 5.9436; 32.0473 90; 93.854; 90 | 5224.32 | Yotnoi, Bunlawee; Rujiwatra, Apinpus Crystal structure and characterization of a new lanthanide coordination polymer, [Pr<sub>2</sub>(pydc)(phth)<sub>2</sub>(H<sub>2</sub>O)<sub>3</sub>]·H<sub>2</sub>O. Acta crystallographica. Section E, Crystallographic communications, 2024, 80, 228-231 |
| 2100457 | CIF Paper | C2 H6 O4 S | I 1 2/a 1 | 8.9007; 5.8099; 10.2451 90; 101.69; 90 | 518.81 | Acta Crystallographica, Section B, 2006, 62, 280-286 |
| 2100510 | CIF Paper | C2 Ba F6 O6 S2 | I 1 2/a 1 | 21.7505; 4.90797; 9.6949 90; 100.379; 90 | 1018.01 | Dinnebier, Robert; Sofina, Natalia; Hildebrandt, Lars; Jansen, Martin Crystal structures of the trifluoromethyl sulfonates M(SO~3~CF~3~)~2~ (M = Mg, Ca, Ba, Zn, Cu) from synchrotron X-ray powder diffraction data Acta Crystallographica, Section B: Structural Science, 2006, 62, 467-473 |
| 2100599 | CIF Paper | C12 D17 K3 N12 O16 | I 1 2/a 1 | 12.824; 16.332; 23.713 90; 97.514; 90 | 4923.8 | G. S. Nichol; W. Clegg; M. J. Gutmann; D. M. Tooke Stoichiometry-dependent structures: an X-ray and neutron single-crystal diffraction study of the effect of reaction stoichiometry on the crystalline products formed in the potassium‒cyanurate system Acta Crystallographica Section B, 2006, 62, 798-807 |
| 2101051 | CIF Paper | C12 H8 Cl2 O2 S | I 1 2/a 1 | 20.2; 4.91; 12.054 90; 90.02; 90 | 1195.5 | Zúñiga, F. J.; Pérez-Mato, J. M.; Breczewski, T. Structure of the incommensurate phase of 4,4'-dichlorobiphenyl sulfone at 90 K Acta Crystallographica Section B, 1993, 49, 1060-1068 |
| 2101114 | CIF Paper | C14 H19 Br N4 O2 | I 1 2/a 1 | 16.359; 10.469; 18.339 90; 90.9; 90 | 3140 | Bannister, C.; Burns, K.; Prout, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Ife, R. J.; Sach, G. S. Structures of histamine H~1~-receptor antagonists derived from the cimetidine group of histamine H~2~-receptor antagonists Acta Crystallographica Section B, 1994, 50, 221-243 |
| 2102509 | CIF Paper | C10 H12 Cu N2 O6 S | I 1 2/a 1 | 6.963; 12.4686; 14.854 90; 101.01; 90 | 1265.9 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102512 | CIF Paper | C20 H30 O2 | I 1 2/a 1 | 27.869; 5.771; 11.758 90; 91.43; 90 | 1890.5 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102513 | CIF Paper | C23 H34 Cl2 Cu N4 O | I 1 2/a 1 | 18.63; 16.61; 16.972 90; 108.02; 90 | 4994.3 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102520 | CIF Paper | C10 H24 F6 N4 O2 P Re | I 1 2/a 1 | 17.257; 5.533; 18.053 90; 98.14; 90 | 1706.4 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2102523 | CIF Paper | C19 H22 Cl2 Cu N6 O5 S4 | I 1 2/a 1 | 30.123; 7.564; 11.044 90; 91.27; 90 | 2516 | Prof. Clemente Dore Augusto; Prof. Marzotto Armando 30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum Acta Crystallographica Section B, 2004, 60, 287-292 |
| 2103796 | CIF Paper | C26 H43 F3 O3 P2 Pd | I 1 2/a 1 | 20.244; 10.714; 27.238 90; 102.76; 90 | 5762 | Clemente, Dore Augusto; Marzotto, Armando 22 Space-group changes Acta Crystallographica Section B, 2003, 59, 43-50 |
| 2103797 | CIF Paper | C47 H63 N O6 Si | I 1 2/a 1 | 33.99; 9.5179; 29.467 90; 114.65; 90 | 8664 | Clemente, Dore Augusto; Marzotto, Armando 22 Space-group changes Acta Crystallographica Section B, 2003, 59, 43-50 |
| 2103865 | CIF Paper | C10 Mn2 O10 | I 1 2/a 1 | 14.1257; 6.8799; 14.3121 90; 105.078; 90 | 1343.01 | Farrugia, Louis J.; Mallinson, Paul R.; Stewart, Brian Experimental charge density in the transition metal complex Mn~2~(CO)~10~: a comparative study Acta Crystallographica Section B, 2003, 59, 234-247 |
| 2103866 | CIF HKL Paper | C10 Mn2 O10 | I 1 2/a 1 | 14.1257; 6.8799; 14.3121 90; 105.078; 90 | 1343.01 | Farrugia, Louis J.; Mallinson, Paul R.; Stewart, Brian Experimental charge density in the transition metal complex Mn~2~(CO)~10~: a comparative study Acta Crystallographica Section B, 2003, 59, 234-247 |
| 2105557 | CIF Paper | N O P | I 1 2/a 1 | 8.5194; 4.7448; 10.397 90; 90.013; 90 | 420.276 | Haines, J.; Chateau, C.; Léger, J. M.; Le Sauze, A.; Diot, N.; Marchand, R.; Hull, S. Crystal structure of moganite-type phosphorus oxynitride: relationship to other twinned-quartz-based structures Acta Crystallographica Section B, 1999, 55, 677-682 |
| 2105578 | CIF Paper | C16 H10 O5 | I 1 2/a 1 | 15.31; 6.111; 28.3 90; 101.61; 90 | 2594 | Valente, E. J.; Martin, S. B.; Sullivan, L. D. Pseudoacids. II. 2-Acylbenzoic Acid Derivatives Acta Crystallographica Section B, 1998, 54, 264-276 |
| 2106073 | CIF | Bi0.868 O2 Sr | I 1 2/a 1 | 4.905; 5.112; 29.857 90; 93.45; 90 | 747.288 | Leligny, H.; Grebille, D.; Perez, O.; Masset, A.C.; Hervieu, M.; Raveau, B. A five-dimensional structural investigation of the misfit layer compound (Bi0.87 Sr O2)2 (Co O2)1.82 Acta Crystallographica B (39,1983-), 2000, 56, 173-182 |
| 2106621 | CIF HKL Paper | C8 H10 N2 O5 | I 1 2/a 1 | 13.3114; 6.0032; 24.1094 90; 101.854; 90 | 1885.5 | Direm, Amani; Altomare, Angela; Moliterni, Anna; Benali-Cherif, Nourredine Intermolecular interactions of proton transfer compounds: synthesis, crystal structure and Hirshfeld surface analysis Acta Crystallographica Section B, 2015, 71 |
| 2107268 | CIF HKL | C10 H10 I4 N2 Pb | I 1 2/a 1 | 7.7839; 14.1821; 15.3644 90; 90.434; 90 | 1696.06 | Weber, Oliver J.; Marshall, Kayleigh L.; Dyson, Lewis M.; Weller, Mark T. Structural diversity in hybrid organic‒inorganic lead iodide materials Acta Crystallographica Section B, 2015, 71, 668-678 |
| 2107336 | CIF | Co4.36 Li1.4 Mg28.25 O112 Sc3.81 Si36.49 | I 1 2/a 1 | 9.432; 8.756; 48.792 90; 92.25; 90 | 4026.46 | Takeuchi, Y.; Ito, J.; Kudoh, Y. New Series of Superstructures Based on Clinopyroxene. I. The Structure of the 'Enstatite-IV' Series, (Mg(x-12)/3 Sc4) (Li4/3 Si(x-4)/3) Ox, with x = 100, 112 or 124 Acta Crystallographica B (39,1983-), 1984, 40, 115-125 |
| 2108055 | CIF HKL Paper | C14 H14 N2 O4 | I 1 2/a 1 | 20.333; 5.1356; 24.966 90; 90.909; 90 | 2606.7 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108056 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.332; 5.1318; 25.024 90; 90.917; 90 | 2610.7 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108057 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.296; 5.1263; 25.005 90; 90.95; 90 | 2601.2 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108058 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.088; 5.2242; 25.033 90; 92.308; 90 | 2624.9 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108059 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.084; 5.2206; 25.04 90; 92.375; 90 | 2623.2 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108060 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.126; 5.2212; 25.134 90; 92.401; 90 | 2638.8 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108061 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.161; 5.218; 25.234 90; 92.559; 90 | 2652 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108062 | CIF HKL | C14 H14 N2 O4 | I 1 2/a 1 | 20.246; 5.2132; 25.372 90; 92.557; 90 | 2675.3 | Chia, Tze Shyang; Quah, Ching Kheng Temperature-induced first-order displacive phase transition of isonicotinamide-4-methoxybenzoic acid co-crystal Acta Crystallographica Section B, 2017, 73, 285-295 |
| 2108402 | CIF HKL | C24 H22 Cl2 N2 O2 | I 1 2/a 1 | 18.1075; 14.16642; 18.5436 90; 117.163; 90 | 4232.16 | So, Hee-Soo; Matsumoto, Shinya Three differently coloured polymorphs of 3,6-bis(4-chlorophenyl)-2,5-dipropyl-2,5-dihydropyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione Acta Crystallographica Section B, 2019, 75 |
| 2108423 | CIF HKL | C20 H16 Co N6 S2 | I 1 2/a 1 | 17.5108; 13.8088; 18.915 90; 114.745; 90 | 4153.7 | Duros, Vasilios; Papatriantafyllopoulou, Constantina; Kitos, Alexandros A.; Tasiopoulos, Anastasios J.; Nastopoulos, Vassilios Influence of ligand positional isomerism on the molecular and supramolecular structures of cobalt(II)-phenylimidazole complexes Acta Crystallographica Section B, 2019, 75 |
| 2108514 | CIF HKL | C18 H12 N6 | I 1 2/a 1 | 21.3047; 3.7345; 35.1825 90; 93.364; 90 | 2794.4 | Yuan, Liangqian; Xing, Mengyao; Pan, Fangfang Polymorphs of 2,4,6-tris(4-pyridyl)-1,3,5-triazine and their mechanical properties Acta Crystallographica Section B, 2019, 75 |
| 2108553 | CIF HKL Paper | B Cs H2 O8 P2 | I 1 2/a 1 | 13.4002; 7.4869; 14.5329 90; 90.059; 90 | 1458.03 | Shvanskaya, Larisa; Yakubovich, Olga; Krikunova, Polina; Ovchenkov, Evgeny; Vasiliev, Alexander Chain caesium borophosphates with B:P ratio 1:2: synthesis, structure relationships and low-temperature thermodynamic properties Acta Crystallographica Section B, 2019, 75 |
| 2109073 | CIF HKL Paper | C3 H7 N3 O5 | I 1 2/a 1 | 8.6385; 6.6817; 11.6069 90; 107.466; 90 | 639.061 | Bojarowski, Sławomir Antonii; Gruza, Barbara; Trzybiński, Damian; Kamiński, Radosław; Hoser, Anna Agnieszka; Kumar, Prashant; Woźniak, Krzysztof; Dominiak, Paulina Maria New refinement strategies for a pseudoatom databank – toward rapid electrostatic interaction energy estimations Acta Crystallographica Section B, 2022, 78 |
| 2200613 | CIF HKL Paper | C5 H15 Cl2 N2 O0.5 Pd | I 1 2/a 1 | 16.435; 7.562; 16.527 90; 90.28; 90 | 2054 | Farrugia, Louis J.; Cross, Ronald J.; Barley, Helen R. L. <i>cis</i>-(2-Amino-1,1-dimethylethylamine)dichloropalladium(II) ethanol hemisolvate Acta Crystallographica Section E, 2001, 57, m494-m495 |
| 2200646 | CIF Paper | C17 H18 Cl2 N8 O4 | I 1 2/a 1 | 19.929; 4.3417; 22.788 90; 91.4; 90 | 1971.2 | Maulik, Prakas R.; Avasthi, Kamlakar; Sarkhel, Sanjay; Sharon, Ashoke; Rawat, Diwan S.; Bal, Chandralata 1,3-Bis(8-chlorotheophyllin-7-yl)propane: a molecule with no intramolecular stacking Acta Crystallographica Section E, 2001, 57, o1163-o1165 |
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