Crystallography Open Database
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Result : There are 156 entries in the selection
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Searching space group like 'P 61 2 2'
| COD ID: 1513328 | |
| CIF file | Formula: - C6 H12 N2 O4 S2 - Comments: Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay; Warren, John E. The effect of pressure on the crystal structure of hexagonalL-cystine Journal of Synchrotron Radiation 12(5) (2005) 598-607 Space group: P 61 2 2 Cell volume: 1424.3 Cell parameters: 5.4203; 5.4203; 55.98; 90; 90; 120; |
| COD ID: 1513329 | |
| CIF file | Formula: - C6 H12 N2 O4 S2 - Comments: Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay; Warren, John E. The effect of pressure on the crystal structure of hexagonalL-cystine Journal of Synchrotron Radiation 12(5) (2005) 598-607 Space group: P 61 2 2 Cell volume: 1415.35 Cell parameters: 5.403; 5.403; 55.984; 90; 90; 120; |
| COD ID: 1513330 | |
| CIF file | Formula: - C6 H12 N2 O4 S2 - Comments: Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay; Warren, John E. The effect of pressure on the crystal structure of hexagonalL-cystine Journal of Synchrotron Radiation 12(5) (2005) 598-607 Space group: P 61 2 2 Cell volume: 1366.7 Cell parameters: 5.3524; 5.3524; 55.087; 90; 90; 120; |
| COD ID: 1513331 | |
| CIF file | Formula: - C6 H12 N2 O4 S2 - Comments: Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay; Warren, John E. The effect of pressure on the crystal structure of hexagonalL-cystine Journal of Synchrotron Radiation 12(5) (2005) 598-607 Space group: P 61 2 2 Cell volume: 1327.75 Cell parameters: 5.3141; 5.3141; 54.291; 90; 90; 120; |
| COD ID: 1513332 | |
| CIF file | Formula: - C6 H12 N2 O4 S2 - Comments: Moggach, Stephen A.; Allan, David R.; Parsons, Simon; Sawyer, Lindsay; Warren, John E. The effect of pressure on the crystal structure of hexagonalL-cystine Journal of Synchrotron Radiation 12(5) (2005) 598-607 Space group: P 61 2 2 Cell volume: 1286.15 Cell parameters: 5.2663; 5.2663; 53.549; 90; 90; 120; |
| COD ID: 1516622 | |
| CIF file | Formula: - C30 H28 O13 - Comments: Ren, Yulin; Lantvit, Daniel D.; Deng, Youcai; Kanagasabai, Ragu; Gallucci, Judith C.; Ninh, Tran Ngoc; Chai, Hee-Byung; Soejarto, Djaja D.; Fuchs, James R.; Yalowich, Jack C.; Yu, Jianhua; Swanson, Steven M.; Kinghorn, A. Douglas Potent Cytotoxic Arylnaphthalene Lignan Lactones from Phyllanthus poilanei. Journal of natural products 77(6) (2014) 1494-1504 Space group: P 61 2 2 Cell volume: 8517 Cell parameters: 21.4292; 21.4292; 21.4162; 90; 90; 120; |
| COD ID: 1531122 | |
| CIF file | Formula: - B H1.6 In O8.8 P2 - Comments: Belokoneva, E.L.; Al'-Ama, A.G.; Gurbanova, O.A.; Dimitrova, O.V.; Stefanovich, S.Yu. Synthesis, crystal structure and properties of a new indium borophosphate In (B P2 O8) * 0.8(H2 O) Zhurnal Neorganicheskoi Khimii 46 (2001) 1115-1120 Space group: P 61 2 2 Cell volume: 1264.01 Cell parameters: 9.581; 9.581; 15.9; 90; 90; 120; |
| COD ID: 1533478 | |
| CIF file | Formula: - B Co H6 Na O11 P2 - Comments: Shi Hengzhen; Shan Yongkui; Dai Liyi; Liu Yuyan; Weng Linhong Crystal structure of borophosphate with 61 screw axis helices Jiegon Huaxue 22 (2003) 391-394 Space group: P 61 2 2 Cell volume: 1223.49 Cell parameters: 9.447; 9.447; 15.83; 90; 90; 120; |
| COD ID: 1539944 | |
| CIF file | Formula: - Cl3 Cs Cu - Comments: Wells, A.F. The Crystal Structure of Cs Cu Cl3 and the Crystal Chemistry of Complex Halides A B X3 Journal of the Chemical Society 1947 (1947) 1662-1670 Space group: P 61 2 2 Cell volume: 808.106 Cell parameters: 7.2; 7.2; 18; 90; 90; 120; |
| COD ID: 1540551 | |
| CIF file | Formula: - C202 H146 F40 N62 O66 S22 Zn9 - Comments: Wood, Christopher; Ronson, Tanya; McConnell, Anna; Roberts, Derrick A.; Nitschke, Jonathan Dual stimuli-induced formation of a μ-hydroxido bridged [Zn9L5(μ-OH)6]12+half-pipe Chem. Sci. (2015) Space group: P 61 2 2 Cell volume: 41306 Cell parameters: 36.8; 36.8; 35.22; 90; 90; 120; |
| COD ID: 1548044 | |
| CIF file | Formula: - C209 H369 Co Cr14 F16 N5 Ni2 O77 Ru2 - Comments: Jesus Ferrando-Soria; Eufemio Moreno Pineda; Alessandro Chiesa; Antonio Fernandez; Samantha A. Magee; Stefano Carretta; Paolo Santini; Inigo J. Vitorica-Yrezabal; Floriana Tuna; Grigore A. Timco; Eric J.L. McInnes; Richard E.P. Winpenny A modular design of molecular qubits to implement universal quantum gates Nature Communications 7 (2016) 11377 Space group: P 61 2 2 Cell volume: 51876.7 Cell parameters: 24.8796; 24.8796; 96.7732; 90; 90; 120; |
| COD ID: 1548320 | |
| CIF file | Formula: - C24 H44.33 Cl Mo N2 P2 - Comments: Hiromasa Tanaka; Kazuya Arashiba; Shogo Kuriyama; Akira Sasada; Kazunari Nakajima; Kazunari Yoshizawa; Yoshiaki Nishibayashi Unique behaviour of dinitrogen-bridged dimolybdenum complexes bearing pincer ligand towards catalytic formation of ammonia Nature Communications 5 (2014) 3737 Space group: P 61 2 2 Cell volume: 4541.5 Cell parameters: 16.3159; 16.3159; 19.6989; 90; 90; 120; |
| COD ID: 1553654 | |
| CIF file | Formula: - C42 H42 I2 N2 - Comments: Samanta, Soham; Halder, Senjuti; Dey, Poulomi; Manna, Utsab; Ramesh, Aiyagari; Das, Gopal A ratiometric fluorogenic probe for the real-time detection of SO<sub>3</sub><sup>2-</sup> in aqueous medium: application in a cellulose paper based device and potential to sense SO<sub>3</sub><sup>2-</sup> in mitochondria. The Analyst 143(1) (2017) 250-257 Space group: P 61 2 2 Cell volume: 7237.7 Cell parameters: 15.6598; 15.6598; 34.08; 90; 90; 120; |
| COD ID: 1554127 | |
| CIF file | Formula: - C23 H21 B2 F8 N5 - Comments: Inokuchi, Daisuke; Hirao, Yasukazu; Takahashi, Kazuyuki; Matsumoto, Kouzou; Mori, Hatsumi; Kubo, Takashi Dynamics of Water Molecules in a 3-Fold Interpenetrated Hydrogen-Bonded Organic Framework Based on Tetrakis(4-pyridyl)methane The Journal of Physical Chemistry C 123(11) (2019) 6599 Space group: P 61 2 2 Cell volume: 3691.8 Cell parameters: 10.6131; 10.6131; 37.846; 90; 90; 120; |
| COD ID: 1554128 | |
| CIF file | Formula: - C23 H21 B2 F8 N5 - Comments: Inokuchi, Daisuke; Hirao, Yasukazu; Takahashi, Kazuyuki; Matsumoto, Kouzou; Mori, Hatsumi; Kubo, Takashi Dynamics of Water Molecules in a 3-Fold Interpenetrated Hydrogen-Bonded Organic Framework Based on Tetrakis(4-pyridyl)methane The Journal of Physical Chemistry C 123(11) (2019) 6599 Space group: P 61 2 2 Cell volume: 3731.6 Cell parameters: 10.6229; 10.6229; 38.184; 90; 90; 120; |
| COD ID: 1554129 | |
| CIF file | Formula: - C21 H18 B2 F8 N4 - Comments: Inokuchi, Daisuke; Hirao, Yasukazu; Takahashi, Kazuyuki; Matsumoto, Kouzou; Mori, Hatsumi; Kubo, Takashi Dynamics of Water Molecules in a 3-Fold Interpenetrated Hydrogen-Bonded Organic Framework Based on Tetrakis(4-pyridyl)methane The Journal of Physical Chemistry C 123(11) (2019) 6599 Space group: P 61 2 2 Cell volume: 3726.4 Cell parameters: 10.6135; 10.6135; 38.198; 90; 90; 120; |
| COD ID: 1554130 | |
| CIF file | Formula: - C21 H18 B2 F8 N4 - Comments: Inokuchi, Daisuke; Hirao, Yasukazu; Takahashi, Kazuyuki; Matsumoto, Kouzou; Mori, Hatsumi; Kubo, Takashi Dynamics of Water Molecules in a 3-Fold Interpenetrated Hydrogen-Bonded Organic Framework Based on Tetrakis(4-pyridyl)methane The Journal of Physical Chemistry C 123(11) (2019) 6599 Space group: P 61 2 2 Cell volume: 3756.2 Cell parameters: 10.628; 10.628; 38.399; 90; 90; 120; |
| COD ID: 1554131 | |
| CIF file | Formula: - C21 H23 B2 F8 N4 O2.5 - Comments: Inokuchi, Daisuke; Hirao, Yasukazu; Takahashi, Kazuyuki; Matsumoto, Kouzou; Mori, Hatsumi; Kubo, Takashi Dynamics of Water Molecules in a 3-Fold Interpenetrated Hydrogen-Bonded Organic Framework Based on Tetrakis(4-pyridyl)methane The Journal of Physical Chemistry C 123(11) (2019) 6599 Space group: P 61 2 2 Cell volume: 11031.1 Cell parameters: 18.3447; 18.3447; 37.85; 90; 90; 120; |
| COD ID: 1554132 | |
| CIF file | Formula: - C21 H23 B2 F8 N4 O2.5 - Comments: Inokuchi, Daisuke; Hirao, Yasukazu; Takahashi, Kazuyuki; Matsumoto, Kouzou; Mori, Hatsumi; Kubo, Takashi Dynamics of Water Molecules in a 3-Fold Interpenetrated Hydrogen-Bonded Organic Framework Based on Tetrakis(4-pyridyl)methane The Journal of Physical Chemistry C 123(11) (2019) 6599 Space group: P 61 2 2 Cell volume: 3742 Cell parameters: 10.6249; 10.6249; 38.276; 90; 90; 120; |
| COD ID: 1562016 | |
| CIF file | Formula: - Ca2 Li2 O7 Si2 - Comments: Kahlenberg, Volker; Brunello, Emanuele; Hejny, Clivia; Krüger, Hannes; Schmidmair, Daniela; Tribus, Martina; Többens, Daniel M. Li2Ca2Si2O7: Structural, spectroscopic and computational studies on a sorosilicate Journal of Solid State Chemistry 225 (2015) 155-167 Space group: P 61 2 2 Cell volume: 928.07 Cell parameters: 5.09611; 5.09611; 41.264; 90; 90; 120; |
| COD ID: 1566652 | |
| CIF file | Formula: - D2 O - Comments: del Rosso, L.; Grazzi, F.; Celli, M.; Colognesi, D.; Garcia-Sakai, V.; Ulivi, L. Refined structure of metastable ice XVII from neutron diffraction measurements The Journal of Physical Chemistry C 120 (2016) 26955 Space group: P 61 2 2 Cell volume: 210.003 Cell parameters: 6.32849; 6.32849; 6.05472; 90; 90; 120; |
| COD ID: 1574864 | |
| CIF file | Formula: - C24 H35 F N2 O2 Si - Comments: Chang, Yun-Pu; Blanco-Herrero, Kevin; Alturaifi, Turki M.; Fettinger, James C.; Liu, Peng; Franz, Annaliese K. Multifunctional chiral silanol ligands for enantioselective catalysis. Chemical science 16(30) (2025) 13678-13683 Space group: P 61 2 2 Cell volume: 7265.2 Cell parameters: 11.3851; 11.3851; 64.721; 90; 90; 120; |
| COD ID: 1575642 | |
| CIF file | Formula: - C36.35 H53 Ag F4.05 N7.67 O11.7 S1.35 - Comments: Tsunekawa, Eisuke; Nakama, Takahiro; Fujita, Makoto; Sawada, Tomohisa Engineering β-sheet morphologies <i>via</i> metal cross-linking and side chain modifications. Chemical science 16(40) (2025) 18832-18837 Space group: P 61 2 2 Cell volume: 80732 Cell parameters: 32.1; 32.1; 90.47; 90; 90; 120; |
| COD ID: 2011459 | |
| CIF file | Formula: - C39 H54 O4 S2 - Comments: Bates, Robert B.; Carducci, Michael D.; Diez, Anna; Forns, Pilar; Kane, Vinayak V.; Rubiralta, Mario Absolute configuration of a <i>C</i>~2~-symmetric bis(thiophenol) Acta Crystallographica Section C 56(10) (2000) e484-e484 Space group: P 61 2 2 Cell volume: 5541 Cell parameters: 9.3218; 9.3218; 73.631; 90; 90; 120; |
| COD ID: 2020032 | |
| CIF file | Formula: - Ir3 Zr5 - Comments: Cenzual, K.; Parthe, E. Zr5 Ir3 with a deformation superstructure of the Mn5 Si3 structure Acta Crystallographica C (39,1983-) 42 (1986) 1101-1105 Space group: P 61 2 2 Cell volume: 964.141 Cell parameters: 7.9306; 7.9306; 17.701; 90; 90; 120; |
| COD ID: 2101917 | |
| CIF file | Formula: - C1.7 H5.54 Br0.14 N2 O - Comments: Yeo, L.; Harris, K. D. M. Definitive Structural Characterization of the Conventional Low-Temperature Host Structure in Urea Inclusion Compounds Acta Crystallographica Section B 53(5) (1997) 822-830 Space group: P 61 2 2 Cell volume: 656.6 Cell parameters: 8.271; 8.271; 11.083; 90; 90; 120; |
| COD ID: 2101918 | |
| CIF file | Formula: - C2.08 H6.16 Br0.18 N2 O - Comments: Yeo, L.; Harris, K. D. M. Definitive Structural Characterization of the Conventional Low-Temperature Host Structure in Urea Inclusion Compounds Acta Crystallographica Section B 53(5) (1997) 822-830 Space group: P 61 2 2 Cell volume: 645.69 Cell parameters: 8.2201; 8.2201; 11.0342; 90; 90; 120; |
| COD ID: 2108554 | |
| CIF file | Formula: - B Cs0.51 H4.9 Mn1.17 O10.45 P2 - Comments: 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 75(6) (2019) Space group: P 61 2 2 Cell volume: 1269.14 Cell parameters: 9.6292; 9.6292; 15.8051; 90; 90; 120; |
| COD ID: 2206062 | |
| CIF file | Formula: - C14 H16 I P - Comments: Dornhaus, Franz; Lerner, Hans-Wolfram; Bolte, Michael The `absolute structure' of dimethyldiphenylphosphonium iodide Acta Crystallographica Section E 61(6) (2005) o1657-o1658 Space group: P 61 2 2 Cell volume: 2184.8 Cell parameters: 11.7463; 11.7463; 18.2841; 90; 90; 120; |
| COD ID: 2223045 | |
| CIF file | Formula: - C28 H26 N2 O6 Zn - Comments: Yu, Seung Man; Shin, Dong Hoon; Kim, Pan-Gi; Kim, Cheal; Kim, Youngmee <i>catena</i>-Poly[[bis(2-hydroxy-2-phenylacetato-κ^2^<i>O</i>^1^,<i>O</i>^2^)zinc(II)]-μ-1,2-di-4-pyridylethane-κ^2^<i>N</i>:<i>N</i>'] Acta Crystallographica Section E 65(9) (2009) m1045-m1046 Space group: P 61 2 2 Cell volume: 3555.9 Cell parameters: 11.136; 11.136; 33.11; 90; 90; 120; |
| COD ID: 2224404 | |
| CIF file | Formula: - C20 H15 Ag N3 O8 Sm - Comments: Zhu, Li-Cai Poly[μ~3~-acetato-di-μ~3~-isonicotinato-μ~2~-isonicotinato-samarium(III)silver(I)] Acta Crystallographica Section E 65(12) (2009) m1616 Space group: P 61 2 2 Cell volume: 3307.1 Cell parameters: 11.8184; 11.8184; 27.34; 90; 90; 120; |
| COD ID: 2227724 | |
| CIF file | Formula: - C26 H24 N2 O2 - Comments: Bernès, Sylvain; Hernández, Guadalupe; Vázquez, Jaime; Tovar, Alejandra; Gutiérrez, René (–)-(<i>S</i>)-<i>N</i>,<i>N</i>'-Bis[1-(1-naphthyl)ethyl]oxalamide Acta Crystallographica Section E 66(11) (2010) o2988 Space group: P 61 2 2 Cell volume: 3218.2 Cell parameters: 11.4489; 11.4489; 28.35; 90; 90; 120; |
| COD ID: 2300359 | |
| CIF file | Formula: - C6 H24 N8 Ni O6 - Comments: Macchi, Piero; Bürgi, Hans-Beat; Chimpri, Abita S.; Hauser, Jürg; Gál, Zoltán Low-energy contamination of Mo microsource X-ray radiation: analysis and solution of the problem Journal of Applied Crystallography 44(4) (2011) 763-771 Space group: P 61 2 2 Cell volume: 2226 Cell parameters: 8.806; 8.806; 33.147; 90; 90; 120; |
| COD ID: 2300360 | |
| CIF file | Formula: - C6 H24 N8 Ni O6 - Comments: Macchi, Piero; Bürgi, Hans-Beat; Chimpri, Abita S.; Hauser, Jürg; Gál, Zoltán Low-energy contamination of Mo microsource X-ray radiation: analysis and solution of the problem Journal of Applied Crystallography 44(4) (2011) 763-771 Space group: P 61 2 2 Cell volume: 2226 Cell parameters: 8.806; 8.806; 33.147; 90; 90; 120; |
| COD ID: 4000985 | |
| CIF file | Formula: - B2 H8 Mg - Comments: Filinchuk, Yaroslav; Černý, Radovan; Hagemann, Hans Insight into Mg(BH4)2with Synchrotron X-ray Diffraction: Structure Revision, Crystal Chemistry, and Anomalous Thermal Expansion Chemistry of Materials 21(5) (2009) 925 Space group: P 61 2 2 Cell volume: 3440.3 Cell parameters: 10.354; 10.354; 37.055; 90; 90; 120; |
| COD ID: 4002299 | |
| CIF file | Formula: - B Co1.25 H5.5 O10.5 P2 - Comments: Yilmaz, A.; Kizilyalli, M.; Bu Xianhui; Stucky, G.D. Fe (H2 O)2 B P2 O8 . (H2 O), a first zeotype ferriborophosphate with chiral tetrahedral framework topology Chemistry of Materials (1,1989-) 12 (2000) 3243-3245 Space group: P 61 2 2 Cell volume: 1220.05 Cell parameters: 9.496; 9.496; 15.623; 90; 90; 120; |
| COD ID: 4002523 | |
| CIF file | Formula: - H K O3 Ti - Comments: Masaki, N.; Uchida, S.; Sato, T.; Yamane, H. Characterization of a new potassium titanate, K Ti O2 (O H) synthesized via hydrothermal method Chemistry of Materials (1,1989-) 14 (2002) 419-424 Space group: P 61 2 2 Cell volume: 2428.12 Cell parameters: 9.8889; 9.8889; 28.671; 90; 90; 120; |
| COD ID: 4002656 | |
| CIF file | Formula: - Al1.62 Na1.62 Sn4.38 - Comments: Kanno, Masahiro; Yamada, Takahiro; Yamane, Hisanori; Nagai, Hideaki Synthesis, Crystal Structure, and Thermoelectric Properties of Na2+xAl2+xSn4‒x(x= −0.38, ‒0.24) Chemistry of Materials 28(2) (2016) 601 Space group: P 61 2 2 Cell volume: 218.24 Cell parameters: 6.405; 6.405; 6.1427; 90; 90; 120; |
| COD ID: 4002657 | |
| CIF file | Formula: - Al1.76 Na1.76 Sn4.24 - Comments: Kanno, Masahiro; Yamada, Takahiro; Yamane, Hisanori; Nagai, Hideaki Synthesis, Crystal Structure, and Thermoelectric Properties of Na2+xAl2+xSn4‒x(x= −0.38, ‒0.24) Chemistry of Materials 28(2) (2016) 601 Space group: P 61 2 2 Cell volume: 218.149 Cell parameters: 6.3984; 6.3984; 6.1529; 90; 90; 120; |
| COD ID: 4003872 | |
| CIF file | Formula: - C0.8 H1.5 F0.09 N0.2 O2 Si - Comments: Kang, Jong Hun; McCusker, Lynne B.; Deem, Michael W.; Baerlocher, Christian; Davis, Mark E. Further Investigations of Racemic and Chiral Molecular Sieves of the STW Topology Chemistry of Materials (2021) Space group: P 61 2 2 Cell volume: 3630.2 Cell parameters: 11.881; 11.881; 29.696; 90; 90; 120; |
| COD ID: 4066331 | |
| CIF file | Formula: - C56 H56 Cl6 Cr2 P4 - Comments: Kim, Sung-Kwan; Kim, Tae-Jin; Chung, Jae-Ho; Hahn, Tak-Kyu; Chae, Sung-Soek; Lee, Ho-Seong; Cheong, Minserk; Kang, Sang Ook Bimetallic Ethylene Tetramerization Catalysts Derived from Chiral DPPDME Ligands: Syntheses, Structural Characterizations, and Catalytic Performance of [(DPPDME)CrCl3]2(DPPDME =S,S- andR,R-chiraphos andmeso-achiraphos) Organometallics 29(22) (2010) 5805 Space group: P 61 2 2 Cell volume: 9288.4 Cell parameters: 11.0901; 11.0901; 87.205; 90; 90; 120; |
| COD ID: 4069694 | |
| CIF file | Formula: - C10 H13 Cl2 N3 Pd - Comments: Zanardi, Alessandro; Mata, José A.; Peris, Eduardo Domino Approach to Benzofurans by the Sequential Sonogashira/Hydroalkoxylation Couplings Catalyzed by New N-Heterocyclic-Carbene-Palladium Complexes Organometallics 28(15) (2009) 4335 Space group: P 61 2 2 Cell volume: 2070 Cell parameters: 9.047; 9.047; 29.203; 90; 90; 120; |
| COD ID: 4072158 | |
| CIF file | Formula: - C38.73 H37.2 As Cl0.53 F6 O1.37 P2 - Comments: Coote, Michelle L.; Krenske, Elizabeth H.; Porter, Keith A.; Weir, Michelle L.; Willis, Anthony C.; Zhou, Xiangting; Wild, S. Bruce Asymmetric Synthesis of a Tertiary Arsine by Nucleophilic Addition to a Chiral Phosphine-Stabilized Arsenium Salt Organometallics 27(19) (2008) 5099 Space group: P 61 2 2 Cell volume: 11003.1 Cell parameters: 16.4243; 16.4243; 47.099; 90; 90; 120; |
| COD ID: 4102285 | |
| CIF file | Formula: - C68 H72 Cl2 Cu2 P4 - Comments: Ryo Yazaki; Naoya Kumagai; Masakatsu Shibasaki Direct Catalytic Asymmetric Addition of Allyl Cyanide to Ketones via Soft Lewis Acid/Hard Brønsted Base/Hard Lewis Base Catalysis Journal of the American Chemical Society 132 (2010) 5522-5531 Space group: P 61 2 2 Cell volume: 28042.6 Cell parameters: 22.9187; 22.9187; 61.6463; 90; 90; 120; |
| COD ID: 4104976 | |
| CIF file | Formula: - C9 Ag3 Cs3 Cu3 N9 - Comments: Ann M. Chippindale; Simon J. Hibble Helices, Chirality and Interpenetration: the Versatility and Remarkable Interconversion of Silver-Copper Cyanide Frameworks Journal of the American Chemical Society 131 (2009) 12736-12744 Space group: P 61 2 2 Cell volume: 1114.72 Cell parameters: 7.2298; 7.2298; 24.6254; 90; 90; 120; |
| COD ID: 4108224 | |
| CIF file | Formula: - C29 H53.666667 Ir O P2 - Comments: Rajshekhar Ghosh; Thomas J. Emge; Karsten Krogh-Jespersen; Alan S. Goldman Combined Experimental and Computational Studies on Carbon-Carbon Reductive Elimination from Bis(hydrocarbyl) Complexes of (PCP)Ir Journal of the American Chemical Society 130 (2008) 11317-11327 Space group: P 61 2 2 Cell volume: 4582.7 Cell parameters: 16.2384; 16.2384; 20.068; 90; 90; 120; |
| COD ID: 4109637 | |
| CIF file | Formula: - C98.67 H99.33 Cd8 S15 - Comments: Qichun Zhang; Xianhui Bu; Jian Zhang; Tao Wu; Pingyun Feng Chiral Semiconductor Frameworks from Cadmium Sulfide Clusters Journal of the American Chemical Society 129 (2007) 8412-8413 Space group: P 61 2 2 Cell volume: 46540.1 Cell parameters: 34.1978; 34.1978; 45.9516; 90; 90; 120; |
| COD ID: 4111761 | |
| CIF file | Formula: - C84 H187 N41 O56 Ru Zn6 - Comments: Shin Aoki; Mohd Zulkefeli; Motoo Shiro; Masanori Kohsako; Kei Takeda; Eiichi Kimura A Luminescence Sensor of Inositol 1,4,5-Triphosphate and Its Model Compound by Ruthenium-Templated Assembly of a Bis(Zn2±Cyclen) Complex Having a 2,2'-Bipyridyl Linker (Cyclen = 1,4,7,10-Tetraazacyclododecane) Journal of the American Chemical Society 127 (2005) 9129-9139 Space group: P 61 2 2 Cell volume: 24851 Cell parameters: 20; 20; 71.74; 90; 90; 120; |
| COD ID: 4116838 | |
| CIF file | Formula: - C5 H20 B2 P2 - Comments: F. Albert Cotton; Carlos A. Murillo; Xiaoping Wang Low-Valent Ditantalum Complex Ta2(μ-BH3)(μ-dmpm)3(η2-BH4)2: First Dinuclear Compound Containing a Bridging BH3 Group with Direct Ta-B Bonds Journal of the American Chemical Society 120 (1998) 9594-9599 Space group: P 61 2 2 Cell volume: 1620.5 Cell parameters: 6.279; 6.279; 47.46; 90; 90; 120; |
| COD ID: 4120134 | |
| CIF file | Formula: - Na2 Sn5 Zn - Comments: Saskia Stegmaier; Sung-Jin Kim; Alexander Henze; Thomas F. Fässler Tetrahedral Framework Structures: Polymorphic Phase Transition with Reorientation of Hexagonal Helical Channels in the Zintl Compound Na~2~ZnSn~5~ and its Relation to Na~5~Zn~2+<i>x</i>~Sn~10-<i>x</i>~ Journal of the American Chemical Society 135 (2013) 10654-10663 Space group: P 61 2 2 Cell volume: 224.78 Cell parameters: 6.451; 6.451; 6.237; 90; 90; 120; |
| COD ID: 4120261 | |
| CIF file | Formula: - C8 F N2 O20 Si10 - Comments: Alex Rojas; Oriol Arteaga; Bart Kahr; Miguel A. Camblor Synthesis, Structure, and Optical Activity of HPM-1, a Pure Silica Chiral Zeolite Journal of the American Chemical Society 135 (2013) 11975-11984 Space group: P 61 2 2 Cell volume: 3642.62 Cell parameters: 11.90205; 11.90205; 29.692; 90; 90; 120; |
| COD ID: 4121348 | |
| CIF file | Formula: - C60 H36 Ce Cs2 O6 - Comments: Jerome R. Robinson; Zachary Gordon; Corwin H. Booth; Patrick J. Carroll; Patrick J. Walsh; Eric J. Schelter Tuning Reactivity and Electronic Properties through Ligand Reorganization within a Cerium Heterobimetallic Framework Journal of the American Chemical Society 135 (2013) 19016-19024 Space group: P 61 2 2 Cell volume: 8630 Cell parameters: 16.5797; 16.5797; 36.2517; 90; 90; 120; |
| COD ID: 4129980 | |
| CIF file | Formula: - C41 H57 Cu6 I4 N11 O3 - Comments: Luo, Xiaolong; Cao, Yu; Wang, Tao; Li, Guanghua; Li, Jiangang; Yang, Yonggang; Xu, Zhongxuan; Zhang, Jian; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Host-Guest Chirality Interplay: A Mutually Induced Formation of a Chiral ZMOF and Its Double-Helix Polymer Guests. Journal of the American Chemical Society 138(3) (2016) 786-789 Space group: P 61 2 2 Cell volume: 10116 Cell parameters: 22.901; 22.901; 22.272; 90; 90; 120; |
| COD ID: 4129981 | |
| CIF file | Formula: - C41 H57 Cu6 I4 N11 O3 - Comments: Luo, Xiaolong; Cao, Yu; Wang, Tao; Li, Guanghua; Li, Jiangang; Yang, Yonggang; Xu, Zhongxuan; Zhang, Jian; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Host-Guest Chirality Interplay: A Mutually Induced Formation of a Chiral ZMOF and Its Double-Helix Polymer Guests. Journal of the American Chemical Society 138(3) (2016) 786-789 Space group: P 61 2 2 Cell volume: 9615 Cell parameters: 22.22; 22.22; 22.487; 90; 90; 120; |
| COD ID: 4131527 | |
| CIF file | Formula: - C23 H18 Mn O7 P0.5 - Comments: Chen, Xu; Jiang, Hong; Hou, Bang; Gong, Wei; Liu, Yan; Cui, Yong Boosting Chemical Stability, Catalytic Activity, and Enantioselectivity of Metal-Organic Frameworks for Batch and Flow Reactions. Journal of the American Chemical Society 139(38) (2017) 13476-13482 Space group: P 61 2 2 Cell volume: 14690.6 Cell parameters: 27.1819; 27.1819; 22.9588; 90; 90; 120; |
| COD ID: 4131528 | |
| CIF file | Formula: - C23 H12 F6 Mn O7 P0.5 - Comments: Chen, Xu; Jiang, Hong; Hou, Bang; Gong, Wei; Liu, Yan; Cui, Yong Boosting Chemical Stability, Catalytic Activity, and Enantioselectivity of Metal-Organic Frameworks for Batch and Flow Reactions. Journal of the American Chemical Society 139(38) (2017) 13476-13482 Space group: P 61 2 2 Cell volume: 14751.3 Cell parameters: 27.0514; 27.0514; 23.2766; 90; 90; 120; |
| COD ID: 4133668 | |
| CIF file | Formula: - C8 H4 N0 O7.75 Zn2 - Comments: Yang, Huajun; Peng, Fang; Dang, Candy; Wang, Yong; Hu, Dandan; Zhao, Xiang; Feng, Pingyun; Bu, Xianhui Ligand Charge Separation To Build Highly Stable Quasi-Isomer of MOF-74-Zn. Journal of the American Chemical Society 141(25) (2019) 9808-9812 Space group: P 61 2 2 Cell volume: 5070 Cell parameters: 22.026; 22.026; 12.068; 90; 90; 120; |
| COD ID: 4301891 | |
| CIF file | Formula: - C18 H23 Cd N3 O9 - Comments: Eric Shyu; Ronald M. Supkowski; Robert L. LaDuca A Chiral Luminescent Coordination Polymer Featuring a Unique 4-Connected Self-Catenated Topology Built from Helical Motifs Inorganic Chemistry 48 (2009) 2723-2725 Space group: P 61 2 2 Cell volume: 6518.6 Cell parameters: 11.5693; 11.5693; 56.235; 90; 90; 120; |
| COD ID: 4306651 | |
| CIF file | Formula: - C74 H64 Co3 N8 O15 - Comments: David P. Martin; Richard J. Staples; Robert L. LaDuca A Chiral Self-Catenated Dual-Ligand Coordination Polymer Constructed from Three Distinct Interwoven Helical Motifs Interconnected by One-Dimensional Chains Inorganic Chemistry 47 (2008) 9754-9756 Space group: P 61 2 2 Cell volume: 10018.5 Cell parameters: 13.684; 13.684; 61.78; 90; 90; 120; |
| COD ID: 4308204 | |
| CIF file | Formula: - C26 H14 Cu4 N10 Zn - Comments: Shi-Shen Zhang; Shun-Ze Zhan; Mian Li; Rong Peng; Dan Li A Rare Chiral Self-Catenated Network Formed by Two Cationic and One Anionic Frameworks Inorganic Chemistry 46 (2007) 4365-4367 Space group: P 61 2 2 Cell volume: 7797.9 Cell parameters: 14.6465; 14.6465; 41.974; 90; 90; 120; |
| COD ID: 4316574 | |
| CIF file | Formula: - C32.5 H34.5 N1.5 O13.5 Zn2 - Comments: Xiaoliang Zhao; Haiyan He; Fangna Dai; Daofeng Sun; Yanxiong Ke Supramolecular Isomerism in Honeycomb Metal-Organic Frameworks Driven by CH...π Interactions: Homochiral Crystallization from an Achiral Ligand through Chiral Inducement Inorganic Chemistry 49 (2010) 8650-8652 Space group: P 61 2 2 Cell volume: 6691.8 Cell parameters: 16.5812; 16.5812; 28.105; 90; 90; 120; |
| COD ID: 4324256 | |
| CIF file | Formula: - C46 H46 N10 Ni O16.83 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6934.8 Cell parameters: 11.348; 11.348; 62.182; 90; 90; 120; |
| COD ID: 4324257 | |
| CIF file | Formula: - C46 H47.68 Fe N10 O14.84 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 7025.5 Cell parameters: 11.4707; 11.4707; 61.655; 90; 90; 120; |
| COD ID: 4324258 | |
| CIF file | Formula: - C46 H47.52 Co N10 O14.76 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6877.79 Cell parameters: 11.3686; 11.3686; 61.4475; 90; 90; 120; |
| COD ID: 4324259 | |
| CIF file | Formula: - C46 H47.63 N10 Ni O14.82 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6821.99 Cell parameters: 11.2927; 11.2927; 61.771; 90; 90; 120; |
| COD ID: 4324260 | |
| CIF file | Formula: - C46 H46.5 Cu N10 O14.25 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6784.5 Cell parameters: 11.2004; 11.2004; 62.448; 90; 90; 120; |
| COD ID: 4324261 | |
| CIF file | Formula: - C46 H38 Cu N10 O10 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6543 Cell parameters: 11.1347; 11.1347; 60.938; 90; 90; 120; |
| COD ID: 4324262 | |
| CIF file | Formula: - C46 H47.48 N10 O14.74 Zn - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6880.42 Cell parameters: 11.365; 11.365; 61.51; 90; 90; 120; |
| COD ID: 4324263 | |
| CIF file | Formula: - C46 H47.36 Co N10 O16.68 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6876.3 Cell parameters: 11.3835; 11.3835; 61.2732; 90; 90; 120; |
| COD ID: 4324264 | |
| CIF file | Formula: - C46 H38.64 Co N10 O12.32 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6654.9 Cell parameters: 11.4398; 11.4398; 58.718; 90; 90; 120; |
| COD ID: 4324266 | |
| CIF file | Formula: - C46 H46.71 Cu N10 O16.35 - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6808.72 Cell parameters: 11.2179; 11.2179; 62.4758; 90; 90; 120; |
| COD ID: 4324267 | |
| CIF file | Formula: - C46 H47.36 N10 O16.68 Zn - Comments: Daniel L. Reger; Jacob J. Horger; Mark D. Smith; Gary J. Long; Fernande Grandjean Homochiral, Helical Supramolecular Metal-Organic Frameworks Organized by Strong π...π Stacking Interactions: Single-Crystal to Single-Crystal Transformations in Closely Packed Solids Inorganic Chemistry 50 (2011) 686-704 Space group: P 61 2 2 Cell volume: 6867.3 Cell parameters: 11.3689; 11.3689; 61.3502; 90; 90; 120; |
| COD ID: 4326892 | |
| CIF file | Formula: - C20 H48 Ce N4 O4 - Comments: Helen C. Aspinall; John Bacsa; Anthony C. Jones; Jacqueline S. Wrench; Kate Black; Paul R. Chalker; Peter J. King; Paul Marshall; Matthew Werner; Hywel O. Davies; Rajesh Odedra Ce(IV) Complexes with Donor-Functionalized Alkoxide Ligands: Improved Precursors for Chemical Vapor Deposition of CeO2 Inorganic Chemistry 50 (2011) 11644-11652 Space group: P 61 2 2 Cell volume: 3975.3 Cell parameters: 9.8993; 9.8993; 46.8411; 90; 90; 120; |
| COD ID: 4329096 | |
| CIF file | Formula: - C9 H11 Cd N5 O - Comments: Claudio Pettinari; Aurel Tăbăcaru; Ishtvan Boldog; Konstantin V. Domasevitch; Simona Galli; Norberto Masciocchi Novel Coordination Frameworks Incorporating the 4,4'-Bipyrazolyl Ditopic Ligand Inorganic Chemistry 51 (2012) 5235-5245 Space group: P 61 2 2 Cell volume: 1874.29 Cell parameters: 10.09032; 10.09032; 21.25676; 90; 90; 120; |
| COD ID: 4330887 | |
| CIF file | Formula: - C26 H52 Br4 Mn2 N10 O4 - Comments: Salvador Blasco; Joan Cano; M. Paz Clares; Santiago García-Granda; Antonio Doménech; Hermas R. Jiménez; Begoña Verdejo; Francesc Lloret; Enrique García-España A Binuclear MnIII Complex of a Scorpiand-Like Ligand Displaying a Single Unsupported MnIII-O-MnIII Bridge Inorganic Chemistry 51 (2012) 11698-11706 Space group: P 61 2 2 Cell volume: 5486.64 Cell parameters: 10.6892; 10.6892; 55.4479; 90; 90; 120; |
| COD ID: 4332735 | |
| CIF file | Formula: - C12 H12 Br N4 O3 Re S2 - Comments: Silva, Rosalice M.; Liddle, Brendan J.; Lindeman, Sergey J.; Smith, Mark D.; Gardinier, James R. Ligand-Promoted Solvent-Dependent Ionization and Conformational Equilibria of Re(CO)3Br[CH2(S-tim)2] (tim = 1-methylthioimidazolyl). Crystal Structures of Re(CO)3Br[CH2(S-tim)2] and {Re(CO)3(CH3CN)[CH2(S-tim)2]}(PF6) Inorganic Chemistry 45(17) (2006) 6794-6802 Space group: P 61 2 2 Cell volume: 2647.1 Cell parameters: 8.6926; 8.6926; 40.452; 90; 90; 120; |
| COD ID: 4332753 | |
| CIF file | Formula: - C20 H15 Ag Eu N3 O8 - Comments: Gu, Xiaojun; Xue, Dongfeng Spontaneously Resolved Homochiral 3D Lanthanide−Silver Heterometallic Coordination Framework with Extended Helical Ln−O−Ag Subunits Inorganic Chemistry 45(23) (2006) 9257-9261 Space group: P 61 2 2 Cell volume: 3294.9 Cell parameters: 11.8098; 11.8098; 27.279; 90; 90; 120; |
| COD ID: 4332754 | |
| CIF file | Formula: - C20 H15 Ag N3 Nd O8 - Comments: Gu, Xiaojun; Xue, Dongfeng Spontaneously Resolved Homochiral 3D Lanthanide−Silver Heterometallic Coordination Framework with Extended Helical Ln−O−Ag Subunits Inorganic Chemistry 45(23) (2006) 9257-9261 Space group: P 61 2 2 Cell volume: 3319.7 Cell parameters: 11.8241; 11.8241; 27.418; 90; 90; 120; |
| COD ID: 4346355 | |
| CIF file | Formula: - C16 H40 B20 N3 O64 V10 - Comments: Chen, Hong; Zhao, Huishuang; Yu, Zheng-Bao; Wang, Lei; Sun, Licheng; Sun, Junliang Construct Polyoxometalate Frameworks through Covalent Bonds. Inorganic chemistry 54(17) (2015) 8699-8704 Space group: P 61 2 2 Cell volume: 14616.4 Cell parameters: 17.0389; 17.0389; 58.1335; 90; 90; 120; |
| COD ID: 4346931 | |
| CIF file | Formula: - C20 H16 N3 O8 Sm Zn - Comments: He, Xingxiang; Liu, Ying; Lv, Yun; Dong, Yayu; Hu, Gonghao; Zhou, Shuai; Xu, Yan L- and D-[LnZn(IN)3(C2H4O2)]n (Ln = Eu, Sm, and Gd): Chiral Enantiomerically 3D 3d-4f Coordination Polymers Constructed by Interesting Butterfly-like Building Units and -[Ln-O-Zn]n- Helices. Inorganic chemistry 55(5) (2016) 2048-2054 Space group: P 61 2 2 Cell volume: 3070.2 Cell parameters: 11.3407; 11.3407; 27.565; 90; 90; 120; |
| COD ID: 4346932 | |
| CIF file | Formula: - C20 H16 Gd N3 O8 Zn - Comments: He, Xingxiang; Liu, Ying; Lv, Yun; Dong, Yayu; Hu, Gonghao; Zhou, Shuai; Xu, Yan L- and D-[LnZn(IN)3(C2H4O2)]n (Ln = Eu, Sm, and Gd): Chiral Enantiomerically 3D 3d-4f Coordination Polymers Constructed by Interesting Butterfly-like Building Units and -[Ln-O-Zn]n- Helices. Inorganic chemistry 55(5) (2016) 2048-2054 Space group: P 61 2 2 Cell volume: 3054.1 Cell parameters: 11.3308; 11.3308; 27.468; 90; 90; 120; |
| COD ID: 4346934 | |
| CIF file | Formula: - C20 H16 Eu N3 O8 Zn - Comments: He, Xingxiang; Liu, Ying; Lv, Yun; Dong, Yayu; Hu, Gonghao; Zhou, Shuai; Xu, Yan L- and D-[LnZn(IN)3(C2H4O2)]n (Ln = Eu, Sm, and Gd): Chiral Enantiomerically 3D 3d-4f Coordination Polymers Constructed by Interesting Butterfly-like Building Units and -[Ln-O-Zn]n- Helices. Inorganic chemistry 55(5) (2016) 2048-2054 Space group: P 61 2 2 Cell volume: 3038.4 Cell parameters: 11.2797; 11.2797; 27.575; 90; 90; 120; |
| COD ID: 4348604 | |
| CIF file | Formula: - C15 H15 Cd0.5 N2 O4 - Comments: Liu, Bo; Zhou, Hui-Fang; Hou, Lei; Wang, Jian-Ping; Wang, Yao-Yu; Zhu, Zhonghua Structural Diversity of Cadmium(II) Coordination Polymers Induced by Tuning the Coordination Sites of Isomeric Ligands. Inorganic chemistry 55(17) (2016) 8871-8880 Space group: P 61 2 2 Cell volume: 6484.5 Cell parameters: 18.6345; 18.6345; 21.563; 90; 90; 120; |
| COD ID: 4350443 | |
| CIF file | Formula: - C8 H12 Cl6 N4 O Tc2 - Comments: Hagenbach, Adelheid; Yegen, Eda; Abram, Ulrich Technetium tetrachloride as a precursor for small technetium(IV) complexes. Inorganic chemistry 45(18) (2006) 7331-7338 Space group: P 61 2 2 Cell volume: 3929.1 Cell parameters: 10.0719; 10.0719; 44.724; 90; 90; 120; |
| COD ID: 4500764 | |
| CIF file | Formula: - C20 H15 Eu Li N3 O8 - Comments: Peng, Guo; Ma, Li; Cai, Jinbiao; Liang, Li; Deng, Hong; Kostakis, George E. Influence of Alkali Metal Cation (Li(I), Na(I), K(I)) on the Construction of Chiral and Achiral Heterometallic Coordination Polymers Crystal Growth & Design 11(6) (2011) 2485-2492 Space group: P 61 2 2 Cell volume: 3018.6 Cell parameters: 11.3891; 11.3891; 26.872; 90; 90; 120; |
| COD ID: 4500767 | |
| CIF file | Formula: - C20 H15 N3 Na O8 Tb - Comments: Peng, Guo; Ma, Li; Cai, Jinbiao; Liang, Li; Deng, Hong; Kostakis, George E. Influence of Alkali Metal Cation (Li(I), Na(I), K(I)) on the Construction of Chiral and Achiral Heterometallic Coordination Polymers Crystal Growth & Design 11(6) (2011) 2485-2492 Space group: P 61 2 2 Cell volume: 3221.7 Cell parameters: 11.6202; 11.6202; 27.55; 90; 90; 120; |
| COD ID: 4500807 | |
| CIF file | Formula: - C7 H3 Mg N O5 - Comments: Banerjee, Debasis; Finkelstein, Jeffrey; Smirnov, A.; Forster, Paul M.; Borkowski, Lauren A.; Teat, Simon J.; Parise, John B. Synthesis and Structural Characterization of Magnesium Based Coordination Networks in Different Solvents Crystal Growth & Design 11(6) (2011) 2572 Space group: P 61 2 2 Cell volume: 1681.7 Cell parameters: 11.4799; 11.4799; 14.735; 90; 90; 120; |
| COD ID: 4501216 | |
| CIF file | Formula: - C54 H116 Fe12 K5 N4 Na3 O118 Sb12 - Comments: Gao, Qiang; Wang, Xiqu; Conato, Marlon T.; Makarenko, Tatyana; Jacobson, Allan J. Microporous, Homochiral Structures Containing Iron Oxo-Clusters Supported by Antimony(III) Tartrate Scaffolds Crystal Growth & Design 11(10) (2011) 4632 Space group: P 61 2 2 Cell volume: 21454.5 Cell parameters: 18.3733; 18.3733; 73.386; 90; 90; 120; |
| COD ID: 4501724 | |
| CIF file | Formula: - C23 H21 Cl2 N5 O8 - Comments: Matsumoto, Kouzou; Inokuchi, Daisuke; Hirao, Yasukazu; Kurata, Hiroyuki; Kubo, Takashi Hydrogen-Bonded Quartz-type Network of Diprotonated Tetrakis(4-pyridyl)methane Dications Crystal Growth & Design 10(7) (2010) 2854 Space group: P 61 2 2 Cell volume: 3826.44 Cell parameters: 10.6693; 10.6693; 38.8144; 90; 90; 120; |
| COD ID: 4504188 | |
| CIF file | Formula: - C27 H43 N O2 P2 Pd - Comments: Johansson, Roger; Öhrström, Lars; Wendt, Ola F. Hydrogen Bond Control of Dimensionality in Organometallic {2,6-Bis[(di-t-butylphosphino)methyl]phenyl}palladium(II) Compounds: Dimers, Chains, and a 3D-Net with an Apparent Channel Structure Crystal Growth & Design 7(10) (2007) 1974 Space group: P 61 2 2 Cell volume: 4576.3 Cell parameters: 16.669; 16.669; 19.018; 90; 90; 120; |
| COD ID: 4508912 | |
| CIF file | Formula: - C15 H14 Cu N3 O9.63 - Comments: Luisi, Brian S.; Kravtsov, Victor Ch.; Moulton, Brian D. An (8,3)-a 3D Coordination Network and Concomitant Three-Connected Supramolecular Isomers Crystal Growth & Design 6(10) (2006) 2207 Space group: P 61 2 2 Cell volume: 8219.6 Cell parameters: 16.0503; 16.0503; 36.843; 90; 90; 120; |
| COD ID: 4509964 | |
| CIF file | Formula: - C24 H16 N2 O4 Zn - Comments: Dai, Ming; Su, Xin-Ran; Wang, Xiao; Wu, Bing; Ren, Zhi-Gang; Zhou, Xuan; Lang, Jian-Ping Three Zinc(II) Coordination Polymers Based on Tetrakis(4-pyridyl)cyclobutane and Naphthalenedicarboxylate Linkers: Solvothermal Syntheses, Structures, and Photocatalytic Properties Crystal Growth & Design 14(1) (2014) 240 Space group: P 61 2 2 Cell volume: 8842 Cell parameters: 18.615; 18.615; 29.464; 90; 90; 120; |
| COD ID: 4510661 | |
| CIF file | Formula: - C10 H12 Cd N4 - Comments: Tăbăcaru, Aurel; Pettinari, Claudio; Timokhin, Ivan; Marchetti, Fabio; Carrasco-Marín, Francisco; Maldonado-Hódar, Francisco José; Galli, Simona; Masciocchi, Norberto Enlarging an Isoreticular Family: 3,3′,5,5′-Tetramethyl-4,4′-bipyrazolato-Based Porous Coordination Polymers Crystal Growth & Design 13(7) (2013) 3087 Space group: P 61 2 2 Cell volume: 1668.51 Cell parameters: 9.132637; 9.132637; 23.09972; 90; 90; 120; |
| COD ID: 4512736 | |
| CIF file | Formula: - C20 H26 Cu N6 O9 - Comments: Guedes, Guilherme P.; Santos, Igor F.; Mercante, Luiza A.; Speziali, Nivaldo L.; Resende, Jackson A. L. C.; Bernardino, Alice M. R.; Andruh, Marius; Vaz, Maria G. F. A New Quartz-like Metal‒Organic Framework Constructed from a Versatile Pyrazole-Based Spacer Crystal Growth & Design 15(3) (2015) 1027 Space group: P 61 2 2 Cell volume: 3780.6 Cell parameters: 11.3128; 11.3128; 34.111; 90; 90; 120; |
| COD ID: 4515370 | |
| CIF file | Formula: - C18 H10 Ba2 N2 O11 - Comments: Li, Xiu-Yuan; Ma, Li-Na; Liu, Yang; Hou, Lei; Wang, Yao-Yu; Zhu, Zhonghua Honeycomb Metal-Organic Framework with Lewis Acidic and Basic Bifunctional Sites: Selective Adsorption and CO<sub>2</sub> Catalytic Fixation. ACS applied materials & interfaces 10(13) (2018) 10965-10973 Space group: P 61 2 2 Cell volume: 7921 Cell parameters: 13.841; 13.841; 47.743; 90; 90; 120; |
| COD ID: 5000005 | |
| CIF file | Formula: - C6 H12 N2 O4 S2 - Comments: Oughton, B. M.; Harrison, P. M. The crystal structure of hexagonal L-cystine Acta Crystallographica 12(5) (1959) 396-404 Space group: P 61 2 2 Cell volume: 1432.73 Cell parameters: 5.422; 5.422; 56.275; 90; 90; 120; |
| COD ID: 6000558 | |
| CIF file | Formula: - Ag F3 - Comments: Zemva, B.; Lutar, K.; Jesih, A.; Casteel, W. J.; Wilkinson, A. P.; Cox, D. E.; Vondreele, R. B.; Borrmann, H.; Bartlett, N. Silver trifluoride - preparation, crystal-structure, some properties, and comparison with AuF3 Journal of The American Chemical Society 113 (1991) 4192-4198 Space group: P 61 2 2 Cell volume: 345.1 Cell parameters: 5.0782; 5.0782; 15.4524; 90; 90; 120; |
| COD ID: 6000559 | |
| CIF file | Formula: - Au F3 - Comments: Zemva, B.; Lutar, K.; Jesih, A.; Casteel, W. J.; Wilkinson, A. P.; Cox, D. E.; Vondreele, R. B.; Borrmann, H.; Bartlett, N. Silver trifluoride - preparation, crystal-structure, some properties, and comparison with AuF3 Journal of The American Chemical Society 113 (1991) 4192-4198 Space group: P 61 2 2 Cell volume: 373.68 Cell parameters: 5.1508; 5.1508; 16.2637; 90; 90; 120; |
| COD ID: 7013059 | |
| CIF file | Formula: - C8 H28 Mo2 N O26 Sm - Comments: Wu, Chuan-De; Lu, Can-Zhong; Lu, Shao-Fang; Zhuang, Hong-Hui; Huang, Jin-Shun Synthesis, structures and properties of a series of novel left- and right-handed metal coordination double helicates with chiral channels Dalton Transactions (issue 16) (2003) 3192 Space group: P 61 2 2 Cell volume: 3806.54 Cell parameters: 15.3286; 15.3286; 18.7066; 90; 90; 120; |
| COD ID: 7018952 | |
| CIF file | Formula: - C18 H20 Cs3 Eu N6 O19 - Comments: Moore, Evan G. A comparison of sensitized Ln(iii) emission using pyridine- and pyrazine-2,6-dicarboxylates. Dalton transactions (Cambridge, England : 2003) 41(17) (2012) 5272-5279 Space group: P 61 2 2 Cell volume: 5199.64 Cell parameters: 10.4302; 10.4302; 55.1896; 90; 90; 120; |
| COD ID: 7019294 | |
| CIF file | Formula: - C47 H42 Cl2 F12 N6 O2 P2 Pd2 - Comments: Meduri, Angelo; Cozzula, Daniela; D'Amora, Angela; Zangrando, Ennio; Gladiali, Serafino; Milani, Barbara Unique syndio-selectivity in CO/styrene copolymerization reaction catalyzed by palladium complexes with 2-(2'-oxazolinyl)-1,10-phenanthrolines. Dalton transactions (Cambridge, England : 2003) 41(25) (2012) 7474-7484 Space group: P 61 2 2 Cell volume: 7358.8 Cell parameters: 14.19; 14.19; 42.2; 90; 90; 120; |
| COD ID: 7022867 | |
| CIF file | Formula: - C24 H43 Cl P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4428.13 Cell parameters: 16.3363; 16.3363; 19.1594; 90; 90; 120; |
| COD ID: 7022869 | |
| CIF file | Formula: - C24 H43 Br P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4528.48 Cell parameters: 16.4782; 16.4782; 19.2576; 90; 90; 120; |
| COD ID: 7022870 | |
| CIF file | Formula: - C24 H43 Br P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4522.4 Cell parameters: 16.5002; 16.5002; 19.1805; 90; 90; 120; |
| COD ID: 7022872 | |
| CIF file | Formula: - C24 H43 Br P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4527.85 Cell parameters: 16.4706; 16.4706; 19.2727; 90; 90; 120; |
| COD ID: 7022874 | |
| CIF file | Formula: - C24 H43 Br P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4649.54 Cell parameters: 16.5479; 16.5479; 19.6062; 90; 90; 120; |
| COD ID: 7022875 | |
| CIF file | Formula: - C24 H43 Br P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4511.7 Cell parameters: 16.4359; 16.4359; 19.285; 90; 90; 120; |
| COD ID: 7022876 | |
| CIF file | Formula: - C24 H43 Br P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4518.1 Cell parameters: 16.4222; 16.4222; 19.3446; 90; 90; 120; |
| COD ID: 7022883 | |
| CIF file | Formula: - C24 H43 Cl P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4442.34 Cell parameters: 16.3541; 16.3541; 19.1791; 90; 90; 120; |
| COD ID: 7022886 | |
| CIF file | Formula: - C24 H43 Cl P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4453.57 Cell parameters: 16.366; 16.366; 19.1996; 90; 90; 120; |
| COD ID: 7022887 | |
| CIF file | Formula: - C24 H43 Br P2 Pd - Comments: Johnson, Magnus T.; Džolić, Zoran; Cetina, Mario; Lahtinen, Manu; Ahlquist, Mårten S G; Rissanen, Kari; Öhrström, Lars; Wendt, Ola F. Preparation of potentially porous, chiral organometallic materials through spontaneous resolution of pincer palladium conformers. Dalton transactions (Cambridge, England : 2003) 42(23) (2013) 8484-8491 Space group: P 61 2 2 Cell volume: 4523.36 Cell parameters: 16.4632; 16.4632; 19.2709; 90; 90; 120; |
| COD ID: 7025058 | |
| CIF file | Formula: - C10 H16 Fe N3 O8 - Comments: Chmel, Nikola Paul; Howson, Suzanne E.; Allan, Laura E. N.; Barker, James; Clarkson, Guy J.; Turner, Scott S.; Scott, Peter Organic-soluble optically pure anionic metal complexes PPh4[M(III)(S,S-EDDS)].2H2O (M = Fe, Co, Cr). Dalton transactions (Cambridge, England : 2003) 39(11) (2010) 2919-2927 Space group: P 61 2 2 Cell volume: 2113 Cell parameters: 9.504; 9.504; 27.012; 90; 90; 120; |
| COD ID: 7028412 | |
| CIF file | Formula: - C21 H22 Br2 Cl2 N4 Ni - Comments: Zhu, Liang; Fu, Zhi-Sheng; Pan, Hui-Jie; Feng, Wei; Chen, Changle; Fan, Zhi-Qiang Synthesis and application of binuclear α-diimine nickel/palladium catalysts with a conjugated backbone. Dalton transactions (Cambridge, England : 2003) 43(7) (2014) 2900-2906 Space group: P 61 2 2 Cell volume: 3658.32 Cell parameters: 9.11609; 9.11609; 50.8316; 90; 90; 120; |
| COD ID: 7035189 | |
| CIF file | Formula: - C36 H34 Cl2 F10 N2 O2 Ti - Comments: Ma, Yuguo; Lobkovsky, Emil B.; Coates, Geoffrey W. Titanium(iv) catalysts with ancillary imino-spiroketonato ligands: synthesis, structure and olefin polymerization. Dalton transactions (Cambridge, England : 2003) 44(27) (2015) 12265-12272 Space group: P 61 2 2 Cell volume: 5363.6 Cell parameters: 13.5188; 13.5188; 33.888; 90; 90; 120; |
| COD ID: 7050582 | |
| CIF file | Formula: - C48 H38 N8 Na2 O19 Tb2 - Comments: Sendor, Dorota; Hilder, Matthias; Juestel, Thomas; Junk, Peter C.; Kynast, Ulrich H. One dimensional energy transfer in lanthanoid picolinates. Correlation of structure and spectroscopy New Journal of Chemistry 27(7) (2003) 1070 Space group: P 61 2 2 Cell volume: 8270.2 Cell parameters: 12.5741; 12.5741; 60.399; 90; 90; 120; |
| COD ID: 7102278 | |
| CIF file | Formula: - C31 H38 Cd N3 O8 - Comments: Hao, Xiang-Rong; Wang, Xin-Long; Qin, Chao; Su, Zhong-Min; Wang, En-Bo; Lan, Ya-Qian; Shao, Kui-Zhan A 3D chiral nanoporous coordination framework consisting of homochiral nanotubes assembled from octuple helices. Chemical communications (Cambridge, England) (issue 44) (2007) 4620-4622 Space group: P 61 2 2 Cell volume: 9837 Cell parameters: 26.712; 26.712; 15.919; 90; 90; 120; |
| COD ID: 7103218 | |
| CIF file | Formula: - C35 H72 Ce Cl2 Co2 Cr2 O25 P6 - Comments: Yi, Xiao-Yi; Y Sung, Herman H; Williams, Ian D; Leung, Wa-Hung Cerium(IV)-containing oxomolybdenum cluster with a unique Ce6Mo9O38 core structure. Chemical communications (Cambridge, England) (issue 28) (2008) 3269-3271 Space group: P 61 2 2 Cell volume: 8873.7 Cell parameters: 11.9773; 11.9773; 71.426; 90; 90; 120; |
| COD ID: 7104949 | |
| CIF file | Formula: - C46 H46.5 Cu N10 O14.25 - Comments: Reger, Daniel L; Horger, Jacob; Smith, Mark D; Long, Gary J Homochiral, helical metal-organic framework structures organized by strong, non-covalent pi-pi stacking interactions. Chemical communications (Cambridge, England) (issue 41) (2009) 6219-6221 Space group: P 61 2 2 Cell volume: 6784.4 Cell parameters: 11.2004; 11.2004; 62.448; 90; 90; 120; |
| COD ID: 7104950 | |
| CIF file | Formula: - C46 H38 Cu N10 O10 - Comments: Reger, Daniel L; Horger, Jacob; Smith, Mark D; Long, Gary J Homochiral, helical metal-organic framework structures organized by strong, non-covalent pi-pi stacking interactions. Chemical communications (Cambridge, England) (issue 41) (2009) 6219-6221 Space group: P 61 2 2 Cell volume: 6543 Cell parameters: 11.1347; 11.1347; 60.938; 90; 90; 120; |
| COD ID: 7109713 | |
| CIF file | Formula: - C26 H23 Cd N9 O7 - Comments: Kaiju Wei; Jia Ni; Yuanzeng Min; Siming Chen; Yangzhong Liu Unexpected helicity control and helix inversion: homochiral helical nanotubes consisting of an achiral ligand Chem.Commun. 49 (2013) 8220 Space group: P 61 2 2 Cell volume: 4703.1 Cell parameters: 16.0598; 16.0598; 21.0558; 90; 90; 120; |
| COD ID: 7109714 | |
| CIF file | Formula: - C28 H26 Cd N10 O7 - Comments: Kaiju Wei; Jia Ni; Yuanzeng Min; Siming Chen; Yangzhong Liu Unexpected helicity control and helix inversion: homochiral helical nanotubes consisting of an achiral ligand Chem.Commun. 49 (2013) 8220 Space group: P 61 2 2 Cell volume: 4468.8 Cell parameters: 15.7763; 15.7763; 20.7324; 90; 90; 120; |
| COD ID: 7110352 | |
| CIF file | Formula: - C81 H94 Cd2 N7 O23 - Comments: Boer, Stephanie A.; Hawes, Chris S.; Turner, David R. Engineering entanglement: controlling the formation of polycatenanes and polyrotaxanes using π interactions Chemical Communications (Cambridge, United Kingdom) 50(9) (2014) 1125-1127 Space group: P 61 2 2 Cell volume: 27122 Cell parameters: 19.928; 19.928; 78.862; 90; 90; 120; |
| COD ID: 7125122 | |
| CIF file | Formula: - C94 H168 Au9 Co6 N18 Na2 O50 S18 Zn - Comments: Surinwong, Sireenart; Yoshinari, Nobuto; Kojima, Tatsuhiro; Konno, Takumi A drastic change in the superhydrophilic crystal porosities of metallosupramolecular structures via a slight change in pH. Chemical communications (Cambridge, England) 52(87) (2016) 12893-12896 Space group: P 61 2 2 Cell volume: 48231.1 Cell parameters: 44.2485; 44.2485; 28.4446; 90; 90; 120; |
| COD ID: 7125318 | |
| CIF file | Formula: - C96 H108 N12 - Comments: Zhang, Pei; Wang, Xinchang; Xuan, Wei; Peng, Pixian; Li, Zhihao; Lu, Ruqiang; Wu, Shuang; Tian, Zhongqun; Cao, Xiaoyu Chiral separation and characterization of triazatruxene-based face-rotating polyhedra: the role of non-covalent facial interactions. Chemical communications (Cambridge, England) 54(37) (2018) 4685-4688 Space group: P 61 2 2 Cell volume: 42496 Cell parameters: 23.3698; 23.3698; 89.848; 90; 90; 120; |
| COD ID: 7130782 | |
| CIF file | Formula: - C192 H240 N96 Zn24 - Comments: Thorne, Michael Francis; Castillo Blas, Celia; McHugh, Lauren Nicole; Bumstead, Alice M.; Robertson, Georgina; Sapnik, Adam; Coates, Chloe Simone; Sayed, Farheen N.; Grey, Clare P.; Keen, David A.; Etter, Martin; da Silva, Ivan; Užarević, Krunoslav; Bennett, Thomas Douglas Formation of new crystalline qtz-[Zn(mIm)2] polymorph from amorphous ZIF-8 Chemical Communications (2022) Space group: P 61 2 2 Cell volume: 6283.93 Cell parameters: 17.3621; 17.3621; 24.0711; 90; 90; 120; |
| COD ID: 7130919 | |
| CIF file | Formula: - C14 H11 N O2 S - Comments: Hsieh, Chang-Chih; Li, Cheng-Yao; Chiang, Ming-Hsi; Horng, Yih-Chern Catalytic O2 Activation toward Oxidative N-S Bond Formation by a Thiolato Fe(III) Complex Chemical Communications (2022) Space group: P 61 2 2 Cell volume: 3521.8 Cell parameters: 8.297; 8.297; 59.074; 90; 90; 120; |
| COD ID: 7131208 | |
| CIF file | Formula: - C8 H15 F N2 O20 Si10 - Comments: Jiao, Feng; Zhang, Jun; Cai, Xianshu; Li, Hao; Xu, Yanan; Zhao, Yue; Du, Hongbin A fluoride-free siliceous STW-type zeolite synthesized using a designed organic structure-directing agent. Chemical communications (Cambridge, England) 59(12) (2023) 1649-1652 Space group: P 61 2 2 Cell volume: 3634.2 Cell parameters: 11.8995; 11.8995; 29.636; 90; 90; 120; |
| COD ID: 7133925 | |
| CIF file | Formula: - C37 H14 Cl8 F6 - Comments: Imoto, Daiki; Shudo, Hiroki; Mizukami, Kiichi; Kimizuka, Nobuo; Yagi, Akiko; Itami, Kenichiro Synthesis and size-dependent properties of multiple sizes of chlorinated fluorocycloparaphenylenes. Chemical communications (Cambridge, England) 60(86) (2024) 12585-12588 Space group: P 61 2 2 Cell volume: 4901.5 Cell parameters: 11.9887; 11.9887; 39.3782; 90; 90; 120; |
| COD ID: 7200811 | |
| CIF file | Formula: - C29 H28 Cu N2 O6 - Comments: Hao, Hong-Qing; Liu, Wen-Ting; Tan, Wei; Lin, Zhuo-Jia; Tong, Ming-Liang Spontaneous resolution of chiral metal mandelates by stereochemical control CrystEngComm 11(6) (2009) 967 Space group: P 61 2 2 Cell volume: 3809.8 Cell parameters: 11.5503; 11.5503; 32.9751; 90; 90; 120; |
| COD ID: 7200815 | |
| CIF file | Formula: - C29 H28 Fe N2 O6 - Comments: Hao, Hong-Qing; Liu, Wen-Ting; Tan, Wei; Lin, Zhuo-Jia; Tong, Ming-Liang Spontaneous resolution of chiral metal mandelates by stereochemical control CrystEngComm 11(6) (2009) 967 Space group: P 61 2 2 Cell volume: 3798.2 Cell parameters: 11.5654; 11.5654; 32.789; 90; 90; 120; |
| COD ID: 7200817 | |
| CIF file | Formula: - C29 H28 Co N2 O6 - Comments: Hao, Hong-Qing; Liu, Wen-Ting; Tan, Wei; Lin, Zhuo-Jia; Tong, Ming-Liang Spontaneous resolution of chiral metal mandelates by stereochemical control CrystEngComm 11(6) (2009) 967 Space group: P 61 2 2 Cell volume: 3840.6 Cell parameters: 11.5834; 11.5834; 33.052; 90; 90; 120; |
| COD ID: 7200819 | |
| CIF file | Formula: - C29 H28 N2 Ni O6 - Comments: Hao, Hong-Qing; Liu, Wen-Ting; Tan, Wei; Lin, Zhuo-Jia; Tong, Ming-Liang Spontaneous resolution of chiral metal mandelates by stereochemical control CrystEngComm 11(6) (2009) 967 Space group: P 61 2 2 Cell volume: 3769.59 Cell parameters: 11.4711; 11.4711; 33.0791; 90; 90; 120; |
| COD ID: 7200821 | |
| CIF file | Formula: - C29 H28 N2 O6 Zn - Comments: Hao, Hong-Qing; Liu, Wen-Ting; Tan, Wei; Lin, Zhuo-Jia; Tong, Ming-Liang Spontaneous resolution of chiral metal mandelates by stereochemical control CrystEngComm 11(6) (2009) 967 Space group: P 61 2 2 Cell volume: 3854.3 Cell parameters: 11.6056; 11.6056; 33.043; 90; 90; 120; |
| COD ID: 7201114 | |
| CIF file | Formula: - C9 H12 O2 - Comments: Wallentin, Carl-Johan; Orentas, Edvinas; Johnson, Magnus T.; Butkus, Eugenijus; Wendt, Ola F.; Öhrström, Lars; Wärnmark, Kenneth Network analysis of bicyclo[3.3.1]nonanes: the diol, the dione and the acetal CrystEngComm 11(9) (2009) 1837 Space group: P 61 2 2 Cell volume: 1240.68 Cell parameters: 6.9851; 6.9851; 29.362; 90; 90; 120; |
| COD ID: 7202856 | |
| CIF file | Formula: - C42 H72 N Nd7 O61 - Comments: Pierre Thuéry Neodymium(iii) d(?)-citramalate: a chiral three-dimensional framework with water-filled channels CrystEngComm 9(6) (2007) 460 Space group: P 61 2 2 Cell volume: 12068.1 Cell parameters: 12.7819; 12.7819; 85.294; 90; 90; 120; |
| COD ID: 7206898 | |
| CIF file | Formula: - C25 H24 Co N4 O5 - Comments: Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm 14(2) (2012) 561 Space group: P 61 2 2 Cell volume: 3884.07 Cell parameters: 9.6221; 9.6221; 48.4414; 90; 90; 120; |
| COD ID: 7206901 | |
| CIF file | Formula: - C25 H24 N4 O5 Zn - Comments: Goswami, Arijit; Sengupta, Satirtha; Mondal, Raju Construction of helical networks by using multiple V-shaped mixed ligand systems CrystEngComm 14(2) (2012) 561 Space group: P 61 2 2 Cell volume: 3891.1 Cell parameters: 9.6491; 9.6491; 48.258; 90; 90; 120; |
| COD ID: 7207705 | |
| CIF file | Formula: - C27 H17 Ce O7 - Comments: Lin, Zhongjun; Zou, Ruqiang; Liang, Jie; Xia, Wei; Xia, Dingguo; Wang, Yingxia; Lin, Jianhua; Hu, Tongliang; Chen, Qiang; Wang, Xidong; Zhao, Yusheng; Burrell, Anthony K. Pore size-controlled gases and alcohols separation within ultramicroporous homochiral lanthanide‒organic frameworks Journal of Materials Chemistry 22(16) (2012) 7813 Space group: P 61 2 2 Cell volume: 5787.6 Cell parameters: 16.5126; 16.5126; 24.5098; 90; 90; 120; |
| COD ID: 7207706 | |
| CIF file | Formula: - C27 H17 Ce O7 - Comments: Lin, Zhongjun; Zou, Ruqiang; Liang, Jie; Xia, Wei; Xia, Dingguo; Wang, Yingxia; Lin, Jianhua; Hu, Tongliang; Chen, Qiang; Wang, Xidong; Zhao, Yusheng; Burrell, Anthony K. Pore size-controlled gases and alcohols separation within ultramicroporous homochiral lanthanide‒organic frameworks Journal of Materials Chemistry 22(16) (2012) 7813 Space group: P 61 2 2 Cell volume: 5787.6 Cell parameters: 16.5126; 16.5126; 24.5098; 90; 90; 120; |
| COD ID: 7207980 | |
| CIF file | Formula: - C9 H13 Cu0.5 N2.5 O2 - Comments: Cheng, Lin; Zhang, Limin; Gou, Shaohua; Cao, Qingna; Wang, Jianquan; Fang, Lei Metal-directed one-dimensional chiral zigzag chains and right-handed 61 helix with multiple chiral components: luminescence and NLO properties CrystEngComm 14(11) (2012) 3888 Space group: P 61 2 2 Cell volume: 3089.9 Cell parameters: 13.9773; 13.9773; 18.263; 90; 90; 120; |
| COD ID: 7212923 | |
| CIF file | Formula: - C7 H3 Mg N O5 - Comments: Mallick, Arijit; Saha, Subhadeep; Pachfule, Pradip; Roy, Sudip; Banerjee, Rahul Selective CO2 and H2 adsorption in a chiral magnesium-based metal organic framework (Mg-MOF) with open metal sites Journal of Materials Chemistry 20(41) (2010) 9073 Space group: P 61 2 2 Cell volume: 1685.9 Cell parameters: 11.4858; 11.4858; 14.756; 90; 90; 120; |
| COD ID: 7215092 | |
| CIF file | Formula: - C27 H17 O7 Pr - Comments: Lin, Zhongjun; Zou, Ruqiang; Xia, Wei; Chen, Liangjie; Wang, Xidong; Liao, Fuhui; Wang, Yingxia; Lin, Jianhua; Burrell, Anthony K. Ultrasensitive sorption behavior of isostructural lanthanide‒organic frameworks induced by lanthanide contraction Journal of Materials Chemistry 22(39) (2012) 21076 Space group: P 61 2 2 Cell volume: 5564.9 Cell parameters: 16.4393; 16.4393; 23.777; 90; 90; 120; |
| COD ID: 7215093 | |
| CIF file | Formula: - C33 H31 N2 O9 Pr - Comments: Lin, Zhongjun; Zou, Ruqiang; Xia, Wei; Chen, Liangjie; Wang, Xidong; Liao, Fuhui; Wang, Yingxia; Lin, Jianhua; Burrell, Anthony K. Ultrasensitive sorption behavior of isostructural lanthanide‒organic frameworks induced by lanthanide contraction Journal of Materials Chemistry 22(39) (2012) 21076 Space group: P 61 2 2 Cell volume: 5564.9 Cell parameters: 16.4393; 16.4393; 23.777; 90; 90; 120; |
| COD ID: 7223612 | |
| CIF file | Formula: - C16 H15 Ag2 N3 O6 - Comments: Zhang, Ting; Huang, Hua-Qi; Cheng, Xiao-Yue; Guo, Dong; Mei, Hong-Xin; Huang, Rong-Bin; Zheng, Lan-Sun The synthesis and chiral crystal structures of two enantiomers of a Ag helical coordination polymer based on argentophilicity CrystEngComm 18(5) (2016) 670 Space group: P 61 2 2 Cell volume: 2949 Cell parameters: 16.5478; 16.5478; 12.4353; 90; 90; 120; |
| COD ID: 7234918 | |
| CIF file | Formula: - C18 H24 Cl2 Cu N4 - Comments: Li, Haitao; Yang, Yuxia; Famulari, Antonino; Xin, Lianxin; Martí-Rujas, Javier; Guo, Fang Reactivity among first and second coordination spheres using a multiprotonated ligand and Cu(ii) in the solid-state CrystEngComm 21(29) (2019) 4354 Space group: P 61 2 2 Cell volume: 2756.3 Cell parameters: 9.8247; 9.8247; 32.973; 90; 90; 120; |
| COD ID: 7236040 | |
| CIF file | Formula: - C24 H22 Co N6 O7 - Comments: Bhattacharya, Sudeshna; Bala, Sukhen; Mondal, Raju Design of chiral Co(ii)-MOFs and their application in environmental remediation and waste water treatment RSC Advances 6(30) (2016) 25149 Space group: P 61 2 2 Cell volume: 3538.7 Cell parameters: 8.449; 8.449; 57.241; 90; 90; 120; |
| COD ID: 7236669 | |
| CIF file | Formula: - C9 F Ge5.36 N2 O20 Si4.64 - Comments: Lu, Peng; Gómez-Hortigüela, Luis; Xu, Lei; Camblor, Miguel A. Synthesis of STW zeolites using imidazolium-based dications of varying length Journal of Materials Chemistry A 6(4) (2018) 1485 Space group: P 61 2 2 Cell volume: 3884.12 Cell parameters: 12.19692; 12.19692; 30.1482; 90; 90; 120; |
| COD ID: 7703353 | |
| CIF file | Formula: - C40 H43 Br2 N16 O11 Y - Comments: Peewasan, Krisana; Merkel, Marcel P.; Fuhr, Olaf; Powell, Annie K. A designed and potentially decadentate ligand for use in lanthanide(iii) catalysed biomass transformations: targeting diastereoselective trans-4,5-diaminocyclopentenone derivatives. Dalton transactions (Cambridge, England : 2003) 49(7) (2020) 2331-2336 Space group: P 61 2 2 Cell volume: 6734.55 Cell parameters: 12.9343; 12.9343; 46.4828; 90; 90; 120; |
| COD ID: 7703354 | |
| CIF file | Formula: - C40 H43 Br2 N16 O11 Sm - Comments: Peewasan, Krisana; Merkel, Marcel P.; Fuhr, Olaf; Powell, Annie K. A designed and potentially decadentate ligand for use in lanthanide(iii) catalysed biomass transformations: targeting diastereoselective trans-4,5-diaminocyclopentenone derivatives. Dalton transactions (Cambridge, England : 2003) 49(7) (2020) 2331-2336 Space group: P 61 2 2 Cell volume: 6831.57 Cell parameters: 13.0011; 13.0011; 46.6691; 90; 90; 120; |
| COD ID: 7716760 | |
| CIF file | Formula: - C8 H24 N10 Ni O8 - Comments: Dong, Wen-Shuai; Mei, Hao-Zheng; Yu, Qi-Yao; Xu, Mei-Qi; Li, Zong-You; Zhang, Jian-Guo Structure and performance regulation of energetic complexes through multifunctional molecular self-assembly. Dalton transactions (Cambridge, England : 2003) 53(33) (2024) 13925-13932 Space group: P 61 2 2 Cell volume: 2698.4 Cell parameters: 9.341; 9.341; 35.71; 90; 90; 120; |
| COD ID: 8100230 | |
| CIF file | Formula: - B H6 In O11 P2 - Comments: Ewald, Bastian; Prots, Yurii; Menezes, Prashanth; Kniep, Rüdiger Crystal structure of diaqua-indium catena-monoboro-bisphosphate monohydrate, In(H~2~O)~2~[BP~2~O~8~] · H~2~O Zeitschrift für Kristallographie - New Crystal Structures 219(4) (2004) 351-352 Space group: P 61 2 2 Cell volume: 1258.69 Cell parameters: 9.57; 9.57; 15.8695; 90; 90; 120; |
| COD ID: 8100355 | |
| CIF file | Formula: - B Cd H6 Na O10.79 P2 - Comments: Ge, Ming-Hui; Mi, Jin-Xiao; Huang, Ya-Xi; Zhao, Jing-Tai; Kniep, Rüdiger Crystal structure of sodium cadmium diaqua catena-[monoborodiphosphate]- hydrate, NaCd(H~2~O)~2~[BP~2~O~8~] · 0.8H~2~O Zeitschrift für Kristallographie - New Crystal Structures 218(2) (2003) 165-166 Space group: P 61 2 2 Cell volume: 1318.4 Cell parameters: 9.713; 9.713; 16.136; 90; 90; 120; |
| COD ID: 8100899 | |
| CIF file | Formula: - B Na Ni O11 P2 - Comments: Boy, Insan; Schäfer, Gerd; Kniep, Rüdiger Crystal structure of sodium nickel diaqua catena-[monoboro-diphosphate] monohydrate, NaNi(H~2~O)~2~[BP~2~O~8~] · H~2~O, at 293 K and 198 K Zeitschrift für Kristallographie - New Crystal Structures 216(1) (2001) 11-12 Space group: P 61 2 2 Cell volume: 1206.8 Cell parameters: 9.377; 9.377; 15.848; 90; 90; 120; |
| COD ID: 8100900 | |
| CIF file | Formula: - B Na Ni O11 P2 - Comments: Boy, Insan; Schäfer, Gerd; Kniep, Rüdiger Crystal structure of sodium nickel diaqua catena-[monoboro-diphosphate] monohydrate, NaNi(H~2~O)~2~[BP~2~O~8~] · H~2~O, at 293 K and 198 K Zeitschrift für Kristallographie - New Crystal Structures 216(1) (2001) 11-12 Space group: P 61 2 2 Cell volume: 1200.7 Cell parameters: 9.3578; 9.3578; 15.8325; 90; 90; 120; |
| COD ID: 8100901 | |
| CIF file | Formula: - B Fe Na O11 P2 - Comments: Boy, Insan; Schäfer, Gerd; Kniep, Rüdiger Crystal structure of sodium iron(II) diaqua catena-[monoboro-diphosphate] monohydrate, NaFe(H~2~O)~2~[BP~2~O~8~] · H~2~O, and of potassium iron(II) diaqua catena-[monoboro-diphosphate] hemihydrate, KFe(H~2~O) ~2~[BP~2~O~8~] · 0.5H~2~O Zeitschrift für Kristallographie - New Crystal Structures 216(1) (2001) 13-14 Space group: P 61 2 2 Cell volume: 1231.1 Cell parameters: 9.467; 9.467; 15.861; 90; 90; 120; |
| COD ID: 8100902 | |
| CIF file | Formula: - B Fe K O11 P2 - Comments: Boy, Insan; Schäfer, Gerd; Kniep, Rüdiger Crystal structure of sodium iron(II) diaqua catena-[monoboro-diphosphate] monohydrate, NaFe(H~2~O)~2~[BP~2~O~8~] · H~2~O, and of potassium iron(II) diaqua catena-[monoboro-diphosphate] hemihydrate, KFe(H~2~O) ~2~[BP~2~O~8~] · 0.5H~2~O Zeitschrift für Kristallographie - New Crystal Structures 216(1) (2001) 13-14 Space group: P 61 2 2 Cell volume: 1256.4 Cell parameters: 9.523; 9.523; 15.998; 90; 90; 120; |
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