Crystallography Open Database
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Searching space group like 'P n n a'
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|---|---|---|---|---|---|---|
| 2212255 | CIF HKL Paper | C30 H22 Br2 N2 O5 S2 | P n n a | 16.0538; 19.2295; 9.0482 90; 90; 90 | 2793.24 | G. Senthil Kumar; K. Chinnakali; R. Balamurugan; A. K. Mohanakrishnan; Hoong-Kun Fun 2,2'-(Oxydimethylene)bis[3-bromo-1-(phenylsulfonyl)-1<i>H</i>-indole] Acta Crystallographica Section E, 2007, 63, o689-o691 |
| 2214661 | CIF HKL Paper | C18 H14 N8 O4 | P n n a | 13.546; 33.654; 3.7035 90; 90; 90 | 1688.3 | Fu, Xiao-Juan; Zhang, Zhi-Hui; Du, Miao Isophthalic acid–3,6-bis(2-pyrazinyl)-1,4-dihydro-1,2,4,5-tetrazine (1/1) Acta Crystallographica Section E, 2007, 63, o3530-o3530 |
| 2215604 | CIF HKL Paper | C14 H6 Co N2 Na2 O8 | P n n a | 14.476; 12.643; 8.2179 90; 90; 90 | 1504 | Liu, Fu-Chen; Ouyang, Jie Poly[bis(μ~2~-pyridine-2,6-dicarboxylato)cobalt(II)disodium(I)] Acta Crystallographica Section E, 2007, 63, m2557-m2557 |
| 2216695 | CIF Paper | C7 H8.25 Cu N O6.625 | P n n a | 20.324; 12.057; 7.4706 90; 90; 90 | 1830.6 | Martin, David P.; LaDuca, Robert L. <i>catena</i>-Poly[[[diaquacopper(II)]-μ-pyridine-2,4-dicarboxylato-κ^3^<i>N</i>,<i>O</i>^2^:<i>O</i>^4^] 0.625-hydrate] Acta Crystallographica Section E, 2007, 63, m3203-m3203 |
| 2217270 | CIF HKL Paper | C14 H16 Cl N5 O | P n n a | 17.121; 17.308; 10.0243 90; 90; 90 | 2970.5 | Tao Zeng; Wan-Zhong Ren; Lie-Gang Sun 4-Chloro-<i>N</i>-methyl-6-(morpholin-4-yl)-<i>N</i>-phenyl-1,3,5-triazin-2-amine Acta Crystallographica Section E, 2008, 64, o277-o277 |
| 2217568 | CIF HKL Paper | C38 H30 Cl2 Cr N4 Na O6 | P n n a | 18.5082; 26.199; 7.1726 90; 90; 90 | 3478 | Ito, Shinpei; Sato, Yohei; Mizuguchi, Jin Poly[bis(acetone-κ<i>O</i>)bis{μ~3~-1-[(5-chloro-2-oxidophenyl)diazenyl]-2-naphtholato-κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'}sodium(I)chromium(III)] Acta Crystallographica Section E, 2008, 64, m333-m334 |
| 2218534 | CIF HKL Paper | C13 H10 N2 S | P n n a | 12.239; 16.389; 11.487 90; 90; 90 | 2304.1 | Hang, Tian; Ye, Qiong (<i>E</i>)-2-[2-(2-Thienyl)vinyl]-1<i>H</i>-1,3-benzimidazole Acta Crystallographica Section E, 2008, 64, o964 |
| 2222113 | CIF HKL Paper | C12 H14 Co N8 O8 | P n n a | 19.041; 11.694; 7.5371 90; 90; 90 | 1678.3 | Xue, Min; Liu, Fu-Chen Diaquabis(tetrazolo[1,5-<i>a</i>]pyridine-8-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)cobalt(II) dihydrate Acta Crystallographica Section E, 2009, 65, m684 |
| 2222294 | CIF HKL Paper | C12 H14 Mn N8 O8 | P n n a | 19.041; 11.694; 7.5371 90; 90; 90 | 1678.3 | Zhao, Jian-De Diaquabis(tetrazolo[1,5-<i>a</i>]pyridine-8-carboxylato-κ^2^<i>N</i>^1^,<i>O</i>)manganese(II) dihydrate Acta Crystallographica Section E, 2009, 65, m812 |
| 2223006 | CIF HKL Paper | C40 H42 N4 O6 Pd S2 | P n n a | 23.818; 17.4359; 9.3341 90; 90; 90 | 3876.3 | Wang, Suwen; Yang, Tianyu; Li, Zhongfang; Yu, Xianjin <i>catena</i>-Poly[[bis(<i>p</i>-toluenesulfonato-κ<i>O</i>)palladium(II)]bis(μ-1,3-di-4-pyridylpropane-κ^2^<i>N</i>:<i>N</i>')] Acta Crystallographica Section E, 2009, 65, m1116 |
| 2228391 | CIF HKL Paper | C14 H13 N O5 | P n n a | 6.1916; 28.5483; 7.1123 90; 90; 90 | 1257.17 | Li, He-Ping; Ng, Seik Weng Ammonium 4-(4-carboxyphenoxy)benzoate Acta Crystallographica Section E, 2010, 66, o3345 |
| 2229095 | CIF HKL Paper | C24 H18 Cd N6 O4 | P n n a | 8.72; 20.102; 13.483 90; 90; 90 | 2363.4 | Li, Chun-Jiang; Lu, Jing-Mei; Tu, Fan; Chen, Jing-Ying; Li, Yu-Jia <i>catena</i>-Poly[[bis[2-(2-pyridyl)-1-<i>H</i>-imidazole-κ^2^<i>N</i>^2^,<i>N</i>^3^]cadmium]-μ-benzene-1,3-dicarboxylato-κ^2^<i>O</i>^1^:<i>O</i>^3^] Acta Crystallographica Section E, 2011, 67, m269-m270 |
| 2238973 | CIF HKL Paper | C22 H15 N3 O | P n n a | 18.2208; 15.7672; 11.7034 90; 90; 90 | 3362.3 | Ramathilagam, C.; Umarani, P. R.; Venkatesan, N.; Rajakumar, P.; Gunasekaran, B.; Manivannan, V. 1-[6-(1<i>H</i>-Indol-1-yl)pyridin-2-yl]-1<i>H</i>-indole-3-carbaldehyde Acta Crystallographica Section E, 2014, 70, o106 |
| 2244203 | CIF HKL Paper | C34 H26 Cl4 Fe N12 O2 | P n n a | 10.4669; 26.589; 12.8313 90; 90; 90 | 3571 | Znovjyak, Kateryna; Seredyuk, Maksym; Fritsky, Igor O.; Sliva, Tatiana Y.; Amirkhanov, Vladimir M.; Malinkin, Sergey O.; Shova, Sergiu Crystal structure of bis{3-(3,5-dichlorophenyl)-5-[6-(1<i>H</i>-pyrazol-1-yl)pyridin-2-yl]-4<i>H</i>-1,2,4-triazol-4-ido}iron(II) methanol disolvate Acta Crystallographica Section E, 2022, 78 |
| 2312832 | CIF HKL Paper | C49 H40 Co2 N4 O14 | P n n a | 26.428; 17.871; 9.627 90; 90; 90 | 4547 | Lian, Zhaoxun; Zhao, Ning Investigation into the third-order nonlinear optical properties of a three-dimensional cobalt(II) coordination polymer constructed from naphthalene-1,4-dicarboxylic acid and 4,4'-({2,2-bis[(pyridin-4-yloxy)methyl]propane-1,3-diyl}bis(oxy))dipyridine. Acta crystallographica. Section C, Structural chemistry, 2025, 81 |
| 2312862 | CIF HKL Paper | C28 H21 Co N5 O6 | P n n a | 14.705; 17.574; 10.029 90; 90; 90 | 2591.8 | Cheng, Weiwei; Mei, Jie; Jiang, Haijian; Jiang, Weina A threefold interpenetrated three-dimensional cobalt(II) coordination polymer with highly sensitive sensing for nitrofurazone in aqueous medium. Acta crystallographica. Section C, Structural chemistry, 2025, 81 |
| 4001404 | CIF | C4 H4 Co N2 O6 V2 | P n n a | 10.2524; 11.5653; 7.4719 90; 90; 90 | 885.96 | Khan, M. Ishaque; Yohannes, Elizabeth; Golub, Vladimir O.; O'Connor, Charles J.; Doedens, Robert J. Mixed-Valence and Neutral Framework Inorganic−Organic Hybrid Materials: Synthesis, Characterization, and Magnetic Properties of [{Co(N(CH)4N)}(V2O5)2] and [{Co(N(CH)4N)}V2O6] Chemistry of Materials, 2007, 19, 4890 |
| 4002149 | CIF | C27 H23 N7 O Zn | P n n a | 28.4095; 28.0922; 9.4743 90; 90; 90 | 7561.3 | Fu, Hong-Ru; Xu, Zhong-Xuan; Zhang, Jian Water-Stable Metal‒Organic Frameworks for Fast and High Dichromate Trapping via Single-Crystal-to-Single-Crystal Ion Exchange Chemistry of Materials, 2015, 27, 205 |
| 4002360 | CIF | Bi3 Sr2 | P n n a | 15.631; 6.793; 6.599 90; 90; 90 | 700.691 | Merlo, F.; Fornasini, M.L. Crystal structure of some phases and alloying behaviour in alkaline earths, europium and yttrium pnictides Chemistry of Materials (1,1989-), 1992, 4, 435-440 |
| 4002430 | CIF | Al H K O5 P | P n n a | 12.741; 10.2211; 6.2239 90; 90; 90 | 810.52 | Vaughan, D.E.W.; Yennawar, H.P.; Perrotta, J. Synthesis and structure of an aluminophosphate built from 3-rings Chemistry of Materials (1,1989-), 2007, 18, 3611-3615 |
| 4003088 | CIF | C16 H40 Cl5 N2 Sb | P n n a | 12.6371; 13.9398; 14.1728 90; 90; 90 | 2496.7 | Li, Zhongyuan; Li, Ye; Liang, Pei; Zhou, Tianliang; Wang, Le; Xie, Rong-Jun Dual-Band Luminescent Lead-Free Antimony Chloride Halides with Near-Unity Photoluminescence Quantum Efficiency Chemistry of Materials, 2019 |
| 4026198 | CIF | C16 H20 O2 S2 Si2 | P n n a | 15.36; 12.783; 19.119 90; 90; 90 | 3754 | Yulia A. Getmanenko; Chad Risko; Paul Tongwa; Eung-Gun Kim; Hong Li; Bhupinder Sandhu; Tatiana Timofeeva; Jean-Luc Brédas; Seth R. Marder Mono- and Dicarbonyl-Bridged Tricyclic Heterocyclic Acceptors: Synthesis and Electronic Properties Journal of Organic Chemistry, 2011, 76, 2660-2671 |
| 4027942 | CIF | C30 H26 Cl2 N2 | P n n a | 11.4978; 11.519; 18.4158 90; 90; 90 | 2439 | Jan Vávra; Lukáš Severa; Ivana Císařová; Blanka Klepetářová; David Šaman; Dušan Koval; Václav Kašička; Filip Teplý Search for Conglomerate in Set of [7]Helquat Salts: Multigram Resolution of Helicene-Viologen Hybrid by Preferential Crystallization Journal of Organic Chemistry, 2013, 78, 1329-1342 |
| 4030677 | CIF | C8 H4 F12 O10 Rh2 | P n n a | 12.982; 11.191; 27.681 90; 90; 90 | 4021.5 | Cotton, F. A.; Kim, Y. Three Rh2(O2CCF3)4L2 compounds, with L = H2O, tetrahydrofuran and acetonitrile European Journal of Solid State and Inorganic Chemistry, 1994, 31, 525-534 |
| 4030736 | CIF | Fe3 H2 K3 O17 P4 | P n n a | 10.717; 20.823; 6.5296 90; 90; 90 | 1457.1 | Kwang-Hwa Lii K3Fe3(PO4)4.H2O: an iron(III) phosphate with a layer structure European Journal of Solid State and Inorganic Chemistry, 1995, 32, 917-926 |
| 4032644 | CIF | C42 H14 F14 | P n n a | 15.5207; 28.081; 7.3931 90; 90; 90 | 3222.2 | Sakamoto, Youichi; Suzuki, Toshiyasu Perfluorinated and Half-Fluorinated Rubrenes: Synthesis and Crystal Packing Arrangements. The Journal of organic chemistry, 2017, 82, 8111-8116 |
| 4035590 | CIF | C41 H48 Br4 N6 Pd2 | P n n a | 16.9451; 31.169; 9.0524 90; 90; 90 | 4781.1 | Reddy Panyam, Pradeep Kumar; Ugale, Bharat; Gandhi, Thirumanavelan Palladium(II)/N-Heterocyclic Carbene Catalyzed One-Pot Sequential α-Arylation/Alkylation: Access to 3,3-Disubstituted Oxindoles. The Journal of organic chemistry, 2018, 83, 7622-7632 |
| 4038880 | CIF | C90 H108 N6 | P n n a | 29.9197; 21.7163; 12.1918 90; 90; 90 | 7921.6 | Schick, Tobias H. G.; Rominger, Frank; Mastalerz, Michael Examination of the Dynamic Covalent Chemistry of [2 + 3]-Imine Cages. The Journal of organic chemistry, 2020 |
| 4061118 | CIF | C26 H40 Cr N2 O10 Te2 W2 | P n n a | 25.397; 16.399; 8.552 90; 90; 90 | 3561.8 | Organometallics, 2004 |
| 4061823 | CIF | C44 H44 Au2 P2 | P n n a | 19.1819; 25.361; 15.9512 90; 90; 90 | 7759.8 | Vicente, José; Chicote, María-Teresa; Alvarez-Falcón, Miguel M; Jones, Peter G. Gold(I) and Silver(I)/Gold(I) Complexes Derived from C~6~Me~4~(C⋮CH)~2~-1,2 Organometallics, 2005, 24, 4666-4675 |
| 4062352 | CIF | C22 H36 Cl2 Fe P2 Pt | P n n a | 16.0504; 16.9112; 8.8811 90; 90; 90 | 2410.6 | Ong, Joyce H. L.; Nataro, Chip; Golen, James A.; Rheingold, Arnold L. Electrochemistry of Late Transition Metal Complexes Containing the Ligand 1,1'-Bis(diisopropylphosphino)ferrocene (dippf) Organometallics, 2003, 22, 5027-5032 |
| 4070898 | CIF | C38 H78 B9 N9 Zr | P n n a | 17.773; 22.528; 12.7374 90; 90; 90 | 5099.9 | Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei Synthesis, Structural Characterization, and Reactivity of Group 4 Metal Complexes Derived from 1-Indenyl-1,2-carborane Organometallics, 2008, 27, 1157 |
| 4070899 | CIF | C44 H84 B9 N9 Zr | P n n a | 17.7855; 22.6517; 13.1899 90; 90; 90 | 5313.8 | Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei Synthesis, Structural Characterization, and Reactivity of Group 4 Metal Complexes Derived from 1-Indenyl-1,2-carborane Organometallics, 2008, 27, 1157 |
| 4070900 | CIF | C44 H84 B9 Hf N9 | P n n a | 17.7492; 22.5137; 13.1185 90; 90; 90 | 5242.2 | Shen, Hao; Chan, Hoi-Shan; Xie, Zuowei Synthesis, Structural Characterization, and Reactivity of Group 4 Metal Complexes Derived from 1-Indenyl-1,2-carborane Organometallics, 2008, 27, 1157 |
| 4071106 | CIF | C32.5 H16 N1.5 O11.5 Si Zn2 | P n n a | 12.4868; 13.0255; 23.7555 90; 90; 90 | 3863.8 | Lambert, Joseph B.; Liu, Zhongqiang; Liu, Chunqing Metal−Organic Frameworks from Silicon- and Germanium-Centered Tetrahedral Ligands Organometallics, 2008, 27, 1464 |
| 4071340 | CIF | C60 H48 Cl4 O2 P2 | P n n a | 23.504; 20.767; 10.3578 90; 90; 90 | 5056 | Doherty, Simon; Knight, Julian G.; Smyth, Catherine H.; Harrington, Ross W.; Clegg, William Biaryl-Like CATPHOS Diphosphines via Double Diels–Alder Cycloaddition between 1,4-Bis(diphenylphosphinoyl)buta-1,3-diyne and Anthracenes: Efficient Ligands for the Palladium-Catalyzed Amination of Aromatic Bromides and α-Arylation of Ketones Organometallics, 2008, 27, 1679 |
| 4072634 | CIF | C20 H18 F6 N2 | P n n a | 17.3068; 13.2544; 8.1088 90; 90; 90 | 1860.09 | Lersch, Martin; Krivokapic, Alexander; Tilset, Mats Synthesis and Structural Characterization of a Fluorinated α-Diimine Platinum(II) Complex Organometallics, 2007, 26, 1581 |
| 4073290 | CIF | C54 H47 Cl3 F8 N4 O | P n n a | 16.073; 16.716; 18.411 90; 90; 90 | 4947 | Pilz, Maurice Frederic; Limberg, Christian; Lazarov, Boyan B.; Hultzsch, Kai C.; Ziemer, Burkhard Dinuclear Zinc Complexes Based on Parallel β-Diiminato Binding Sites: Syntheses, Structures, and Properties as CO2/Epoxide Copolymerization Catalysts Organometallics, 2007, 26, 3668 |
| 4075674 | CIF | C46 H58 P2 Pt | P n n a | 12.515; 25.187; 14.685 90; 90; 90 | 4628.9 | Johnson, Charles A.; Haley, Michael M.; Rather, Elisabeth; Han, Fusen; Weakley, Timothy J. R. Selective Metallacyclization and Crystallographic Characterization of Structurally Related Platina-annulenes Organometallics, 2005, 24, 1161 |
| 4077023 | CIF | C8 H16 Cl2 N2 Pd | P n n a | 7.843; 11.556; 12.868 90; 90; 90 | 1166.3 | Kozlowski, Marisa C.; Li, Xiaolin; Carroll, Patrick J.; Xu, Zhenrong Copper(II) Complexes of Novel 1,5-Diaza-cis-decalin Diamine Ligands: An Investigation of Structure and Reactivity Organometallics, 2002, 21, 4513 |
| 4077066 | CIF | C44.67 H72 O17.33 P5.33 Sn2.67 | P n n a | 21.774; 24.507; 16.699 90; 90; 90 | 8911 | Chandrasekhar, Vadapalli; Baskar, Viswanathan; Steiner, Alexander; Zacchini, Stefano Synthesis of a Tetranuclear Organooxotin Cage by Debenzylation Reactions: X-ray Crystal Structure of [(PhCH2)2Sn2O(O2P(OH)-t-Bu)4]2 Organometallics, 2002, 21, 4528 |
| 4082751 | CIF | C24 H58 N P2 Rh Si2 | P n n a | 20.456; 17.299; 9.0187 90; 90; 90 | 3191.4 | Whited, Matthew T.; Kosanovich, Alex J.; Janzen, Daron E. Synthesis and Reactivity of Three-Coordinate (dtbpe)Rh Silylamides: CO2Bond Cleavage by a Rhodium(I) Disilylamide Organometallics, 2014, 33, 1416 |
| 4082752 | CIF | C25 H58 N P2 Rh Si | P n n a | 20.2627; 17.1177; 8.921 90; 90; 90 | 3094.3 | Whited, Matthew T.; Kosanovich, Alex J.; Janzen, Daron E. Synthesis and Reactivity of Three-Coordinate (dtbpe)Rh Silylamides: CO2Bond Cleavage by a Rhodium(I) Disilylamide Organometallics, 2014, 33, 1416 |
| 4084516 | CIF | C58 H75 Al | P n n a | 18.5202; 21.1053; 14.7508 90; 90; 90 | 5765.7 | Fettinger, James C.; Gray, Paul A.; Melton, Christopher E.; Power, Philip P. Hydroalumination of Alkenes and Alkynes by Primary Aluminum Hydrides under Mild Conditions Organometallics, 2014, 33, 6232 |
| 4084569 | CIF | C4 H9 Au F3 P | P n n a | 11.7205; 34.9552; 11.7241 90; 90; 90 | 4803.3 | Blaya, María; Bautista, Delia; Gil-Rubio, Juan; Vicente, José Synthesis of Au(I) Trifluoromethyl Complexes. Oxidation to Au(III) and Reductive Elimination of Halotrifluoromethanes Organometallics, 2014, 33, 6358 |
| 4085262 | CIF | C42 H48 Au B F4 N4 | P n n a | 15.998; 31.709; 15.903 90; 90; 90 | 8067 | Lazreg, Faïma; Cordes, David B.; Slawin, Alexandra M. Z.; Cazin, Catherine S. J. Synthesis of Homoleptic and Heteroleptic Bis-N-heterocylic Carbene Group 11 Complexes Organometallics, 2015, 34, 419 |
| 4085309 | CIF | C58 H108 Ge2 Si8 | P n n a | 18.2435; 30.6273; 12.6638 90; 90; 90 | 7075.89 | Sasamori, Takahiro; Sugahara, Tomohiro; Agou, Tomohiro; Guo, Jing-Dong; Nagase, Shigeru; Streubel, Rainer; Tokitoh, Norihiro Synthesis and Characterization of a 1,2-Digermabenzene Organometallics, 2015, 34, 2106 |
| 4086577 | CIF | C19 H22 Au N O2 S2 | P n n a | 9.6573; 14.9056; 13.0267 90; 90; 90 | 1875.2 | Nilakantan, Lakshmi; McMillin, David R.; Sharp, Paul R. Emissive Biphenyl Cyclometalated Gold(III) Diethyl Dithiocarbamate Complexes Organometallics, 2016, 35, 2339 |
| 4103716 | CIF | C36 H72 Cr N4 | P n n a | 16.4797; 15.5746; 15.3467 90; 90; 90 | 3939 | Rosanna A. D. Soriaga; Jennifer M. Nguyen; Thomas A. Albright; David M. Hoffman Diamagnetic Group 6 Tetrakis(di-tert-butylketimido)metal(IV) Complexes Journal of the American Chemical Society, 2010, 132, 18014-18016 |
| 4103717 | CIF | C36 H72 Mo N4 | P n n a | 16.5902; 15.6242; 15.5439 90; 90; 90 | 4029.1 | Rosanna A. D. Soriaga; Jennifer M. Nguyen; Thomas A. Albright; David M. Hoffman Diamagnetic Group 6 Tetrakis(di-tert-butylketimido)metal(IV) Complexes Journal of the American Chemical Society, 2010, 132, 18014-18016 |
| 4104132 | CIF | C38 H46 Zr | P n n a | 20.786; 17.808; 8.229 90; 90; 90 | 3046 | Adam D. Miller; John F. Tannaci; Samuel A. Johnson; Hyuk Lee; Jennifer L. McBee; T. Don Tilley Mesityl Alkyne Substituents for Control of Regiochemistry and Reversibility in Zirconocene Couplings: New Synthetic Strategies for Unsymmetrical Zirconacyclopentadienes and Conjugated Polymers Journal of the American Chemical Society, 2009, 131, 4917-4927 |
| 4104316 | CIF | C36 H6 F12 N2 O4 | P n n a | 31.88; 8.5607; 10.1357 90; 90; 90 | 2766.2 | Rüdiger Schmidt; Joon Hak Oh; Ya-Sen Sun; Manuela Deppisch; Ana-Maria Krause; Krzysztof Radacki; Holger Braunschweig; Martin Könemann; Peter Erk; Zhenan Bao; Frank Würthner High-Performance Air-Stable n-Channel Organic Thin Film Transistors Based on Halogenated Perylene Bisimide Semiconductors Journal of the American Chemical Society, 2009, 131, 6215-6228 |
| 4104786 | CIF | C127.5 H125.5 F12 N12 O12 P4 Pd2 Pt0 S4 | P n n a | 28.414; 41.636; 29.307 90; 90; 90 | 34672 | Jinzhen Lu; David R. Turner; Lindsay P. Harding; Lindsay T. Byrne; Murray V. Baker; Stuart R. Batten Octapi Interactions: Self-Assembly of a Pd-Based [2]Catenane Driven by Eightfold π Interactions Journal of the American Chemical Society, 2009, 131, 10372-10373 |
| 4106167 | CIF | C H6 F Fe N O4 P | P n n a | 12.953; 10.6466; 6.4469 90; 90; 90 | 889.06 | Jennifer A. Armstrong; Edward R. Williams; Mark T. Weller Fluoride-Rich, Hydrofluorothermal Routes to Functional Transition Metal (Mn, Fe, Co, Cu) Fluorophosphates Journal of the American Chemical Society, 2011, 133, 8252-8263 |
| 4106366 | CIF | C22 H16 Cu F6 N4 O6 S2 | P n n a | 16.51; 14.417; 14.91 90; 90; 90 | 3548.9 | Atsushi Kondo; Hiroshi Kajiro; Hiroshi Noguchi; Lucia Carlucci; Davide M. Proserpio; Gianfranco Ciani; Kenichi Kato; Masaki Takata; Hiroko Seki; Masami Sakamoto; Yoshiyuki Hattori; Fujio Okino; Kazuyuki Maeda; Tomonori Ohba; Katsumi Kaneko; Hirofumi Kanoh Super Flexibility of a 2D Cu-Based Porous Coordination Framework on Gas Adsorption in Comparison with a 3D Framework of Identical Composition: Framework Dimensionality-Dependent Gas Adsorptivities Journal of the American Chemical Society, 2011, 133, 10512-10522 |
| 4109164 | CIF | C20 H28 N2 Zn | P n n a | 14.689; 16.472; 8.354 90; 90; 90 | 2021.3 | Janusz Lewiński; Maciej Dranka; Wojciech Bury; Witold Śliwiński; Iwona Justyniak; Janusz Lipkowski From Discrete Linear ZntBu2 Molecules to 1D Coordination Polymers and 2D Fabrics Journal of the American Chemical Society, 2007, 129, 3096-3098 |
| 4109686 | CIF | C42 H45 F5 N O7 P | P n n a | 24.6647; 19.1622; 16.6761 90; 90; 90 | 7881.6 | Bradley O. Ashburn; Rich G. Carter; Lev N. Zakharov Synthesis of Tetra-ortho-substituted, Phosphorus-Containing and Carbonyl-Containing Biaryls Utilizing a Diels-Alder Approach Journal of the American Chemical Society, 2007, 129, 9109-9116 |
| 4112718 | CIF | C76 H122 O2 Si6 Y4 | P n n a | 12.0952; 25.5168; 26.5227 90; 90; 90 | 8185.7 | Olivier Tardif; Daisuke Hashizume; Zhaomin Hou Hydrogenation of Carbon Dioxide and Aryl Isocyanates by a Tetranuclear Tetrahydrido Yttrium Complex. Isolation, Structures, and CO2 Insertion Reactions of Methylene Diolate and μ3-Oxo Yttrium Complexes Journal of the American Chemical Society, 2004, 126, 8080-8081 |
| 4114112 | CIF | C20 H6 F12 Hg3 S | P n n a | 11.151; 10.743; 17.987 90; 90; 90 | 2154.8 | Mitsukimi Tsunoda; François P. Gabbaï Hexacoordination of a Dimethyl Sulfide Molecule Journal of the American Chemical Society, 2003, 125, 10492-10493 |
| 4117627 | CIF | C29 H24 F6 Mg N2 O8 | P n n a | 7.3064; 32.6024; 12.5442 90; 90; 90 | 2988.11 | Ana E. Platero-Prats; Víctor A. de la Peña-O'Shea; Davide M. Proserpio; Natalia Snejko; Enrique Gutiérrez-Puebla; Ángeles Monge Insight into the SBU Condensation in Mg Coordination and Supramolecular Frameworks: A Combined Experimental and Theoretical Study Journal of the American Chemical Society, 2012, 134, 4762-4771 |
| 4117629 | CIF | C29 H20 F6 Mg N2 O6 | P n n a | 9.3105; 26.894; 11.2146 90; 90; 90 | 2808.1 | Ana E. Platero-Prats; Víctor A. de la Peña-O'Shea; Davide M. Proserpio; Natalia Snejko; Enrique Gutiérrez-Puebla; Ángeles Monge Insight into the SBU Condensation in Mg Coordination and Supramolecular Frameworks: A Combined Experimental and Theoretical Study Journal of the American Chemical Society, 2012, 134, 4762-4771 |
| 4118072 | CIF | C10 H6.5 N1.5 O3 Zn0.5 | P n n a | 7.699; 17.608; 15.09 90; 90; 90 | 2045.7 | Satoshi Horike; Keisuke Kishida; Yoshihiro Watanabe; Yasutaka Inubushi; Daiki Umeyama; Masayuki Sugimoto; Tomohiro Fukushima; Munehiro Inukai; Susumu Kitagawa Dense Coordination Network Capable of Selective CO2 Capture from C1 and C2 Hydrocarbons Journal of the American Chemical Society, 2012, 134, 9852-9855 |
| 4119018 | CIF | C83 H114 Fe2 N8 | P n n a | 14.676; 34.656; 14.788 90; 90; 90 | 7521 | Thomas R. Dugan; Eckhard Bill; K. Cory MacLeod; Gemma J. Christian; Ryan E. Cowley; William W. Brennessel; Shengfa Ye; Frank Neese; Patrick L. Holland Reversible C-C Bond Formation between Redox-Active Pyridine Ligands in Iron Complexes Journal of the American Chemical Society, 2012, 134, 20352-20364 |
| 4119044 | CIF | C22 H27 B F5 Fe Ni O3 S4 | P n n a | 30.475; 18.73; 9.4164 90; 90; 90 | 5374.9 | Katharina Weber; Tobias Krämer; Hannah S. Shafaat; Thomas Weyhermüller; Eckhard Bill; Maurice van Gastel; Frank Neese; Wolfgang Lubitz A Functional [NiFe]-Hydrogenase Model Compound That Undergoes Biologically Relevant Reversible Thiolate Protonation Journal of the American Chemical Society, 2012, 134, 20745-20755 |
| 4120753 | CIF | C42 H48 Au B F4 N4 | P n n a | 15.9362; 31.6465; 15.8633 90; 90; 90 | 8000.26 | Daniel Canseco-Gonzalez; Ana Petronilho; Helge Müller-Bunz; Kohsuke Ohmatsu; Takashi Ooi; Martin Albrecht Carbene Transfer from Triazolylidene Gold Complexes as a Potent Strategy for Inducing High Catalytic Activity Journal of the American Chemical Society, 2013, 135, 13193-13203 |
| 4121597 | CIF | C16 H12 Co N2 O4 | P n n a | 12.4892; 13.6324; 12.1687 90; 90; 90 | 2071.8 | Elsaidi, Sameh K.; Mohamed, Mona H.; Wojtas, Lukasz; Chanthapally, Anjana; Pham, Tony; Space, Brian; Vittal, Jagadese J.; Zaworotko, Michael J. Putting the Squeeze on CH4 and CO2 through Control over Interpenetration in Diamondoid Nets. Journal of the American Chemical Society, 2014, 136, 5072-5077 |
| 4121867 | CIF | C4 H9 Mn N3 O6 | P n n a | 8.5164; 11.9772; 9.0562 90; 90; 90 | 923.76 | Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai; Henke, Sebastian; Yeung, Hamish H.-M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K. Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture. Journal of the American Chemical Society, 2014, 136, 7801 |
| 4121869 | CIF | C4 H9 Mn N3 O6 | P n n a | 8.5303; 11.9918; 9.0531 90; 90; 90 | 926.07 | Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai; Henke, Sebastian; Yeung, Hamish H.-M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K. Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture. Journal of the American Chemical Society, 2014, 136, 7801 |
| 4121870 | CIF | C4 H9 Mn N3 O6 | P n n a | 8.5389; 11.9989; 9.0517 90; 90; 90 | 927.41 | Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai; Henke, Sebastian; Yeung, Hamish H.-M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K. Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture. Journal of the American Chemical Society, 2014, 136, 7801 |
| 4121871 | CIF | C4 H9 Mn N3 O6 | P n n a | 8.5471; 12.0046; 9.0496 90; 90; 90 | 928.53 | Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai; Henke, Sebastian; Yeung, Hamish H.-M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K. Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture. Journal of the American Chemical Society, 2014, 136, 7801 |
| 4121873 | CIF | C4 H9 Mn N3 O6 | P n n a | 8.522; 11.9877; 9.054 90; 90; 90 | 924.95 | Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai; Henke, Sebastian; Yeung, Hamish H.-M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K. Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture. Journal of the American Chemical Society, 2014, 136, 7801 |
| 4121874 | CIF | C4 H9 Mn N3 O6 | P n n a | 8.5611; 12.0204; 9.0426 90; 90; 90 | 930.55 | Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai; Henke, Sebastian; Yeung, Hamish H.-M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K. Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture. Journal of the American Chemical Society, 2014, 136, 7801 |
| 4121875 | CIF | C4 H9 Mn N3 O6 | P n n a | 8.5538; 12.0096; 9.0457 90; 90; 90 | 929.24 | Li, Wei; Thirumurugan, A.; Barton, Phillip T.; Lin, Zheshuai; Henke, Sebastian; Yeung, Hamish H.-M.; Wharmby, Michael T.; Bithell, Erica G.; Howard, Christopher J.; Cheetham, Anthony K. Mechanical Tunability via Hydrogen Bonding in Metal-Organic Frameworks with the Perovskite Architecture. Journal of the American Chemical Society, 2014, 136, 7801 |
| 4122312 | CIF | C8 H7 Ag N4 O3 | P n n a | 7.8576; 24.637; 13.7898 90; 90; 90 | 2669.5 | Murdock, Christopher R.; Jenkins, David M. Isostructural synthesis of porous metal-organic nanotubes. Journal of the American Chemical Society, 2014, 136, 10983-10988 |
| 4122342 | CIF | C21 H19 Cu N7 O5 | P n n a | 12.7307; 9.8601; 17.6478 90; 90; 90 | 2215.26 | Du, Miao; Li, Cheng-Peng; Chen, Min; Ge, Zhi-Wei; Wang, Xi; Wang, Lei; Liu, Chun-Sen Divergent Kinetic and Thermodynamic Hydration of a Porous Cu(II) Coordination Polymer with Exclusive CO2 Sorption Selectivity. Journal of the American Chemical Society, 2014, 136, 10906-10909 |
| 4122343 | CIF | C18 H12 Cu N6 O4 | P n n a | 12.5529; 9.9941; 17.6881 90; 90; 90 | 2219.06 | Du, Miao; Li, Cheng-Peng; Chen, Min; Ge, Zhi-Wei; Wang, Xi; Wang, Lei; Liu, Chun-Sen Divergent Kinetic and Thermodynamic Hydration of a Porous Cu(II) Coordination Polymer with Exclusive CO2 Sorption Selectivity. Journal of the American Chemical Society, 2014, 136, 10906-10909 |
| 4122344 | CIF | C18 H14 Cu N6 O5 | P n n a | 12.6065; 10.137; 17.5701 90; 90; 90 | 2245.3 | Du, Miao; Li, Cheng-Peng; Chen, Min; Ge, Zhi-Wei; Wang, Xi; Wang, Lei; Liu, Chun-Sen Divergent Kinetic and Thermodynamic Hydration of a Porous Cu(II) Coordination Polymer with Exclusive CO2 Sorption Selectivity. Journal of the American Chemical Society, 2014, 136, 10906-10909 |
| 4122345 | CIF | C18 H12 Cu N6 O4 | P n n a | 12.6285; 10.0104; 17.6492 90; 90; 90 | 2231.1 | Du, Miao; Li, Cheng-Peng; Chen, Min; Ge, Zhi-Wei; Wang, Xi; Wang, Lei; Liu, Chun-Sen Divergent Kinetic and Thermodynamic Hydration of a Porous Cu(II) Coordination Polymer with Exclusive CO2 Sorption Selectivity. Journal of the American Chemical Society, 2014, 136, 10906-10909 |
| 4122346 | CIF | C18.75 H12 Cu N6 O5.5 | P n n a | 12.3348; 9.936; 17.8259 90; 90; 90 | 2184.7 | Du, Miao; Li, Cheng-Peng; Chen, Min; Ge, Zhi-Wei; Wang, Xi; Wang, Lei; Liu, Chun-Sen Divergent Kinetic and Thermodynamic Hydration of a Porous Cu(II) Coordination Polymer with Exclusive CO2 Sorption Selectivity. Journal of the American Chemical Society, 2014, 136, 10906-10909 |
| 4122347 | CIF | C18 H12 Cu N6 O4 | P n n a | 12.6868; 9.9923; 17.6153 90; 90; 90 | 2233.1 | Du, Miao; Li, Cheng-Peng; Chen, Min; Ge, Zhi-Wei; Wang, Xi; Wang, Lei; Liu, Chun-Sen Divergent Kinetic and Thermodynamic Hydration of a Porous Cu(II) Coordination Polymer with Exclusive CO2 Sorption Selectivity. Journal of the American Chemical Society, 2014, 136, 10906-10909 |
| 4129022 | CIF | C32 H61 Co3 O24 | P n n a | 28.714; 21.1265; 10.946 90; 90; 90 | 6640.1 | Qazvini, Omid T.; Babarao, Ravichandar; Shi, Zhao-Lin; Zhang, Yue-Biao; Telfer, Shane G. A Robust Ethane-Trapping Metal-Organic Framework with a High Capacity for Ethylene Purification. Journal of the American Chemical Society, 2019, 141, 5014-5020 |
| 4134229 | CIF | C246 H215 Cl O7 | P n n a | 34.4289; 27.4149; 23.4214 90; 90; 90 | 22106.6 | Urieta-Mora, Javier; Krug, Marcel; Alex, Wiebke; Perles, Josefina; Fernandez, Israel; Molina-Ontoria, Agustín; Guldi, Dirk M.; Martín, Nazario Homo and Hetero Molecular 3D Nanographenes Employing a Cyclooctatetraene Scaffold. Journal of the American Chemical Society, 2019 |
| 4134454 | CIF | C18 H11 F10 N2 O0.5 Pd | P n n a | 8.612; 14.566; 15.189 90; 90; 90 | 1905.3 | Budiman, Yudha P.; Jayaraman, Arumugam; Friedrich, Alexandra; Kerner, Florian; Radius, Udo; Marder, Todd B. Palladium-Catalyzed Homocoupling of Highly Fluorinated Arylboronates: Studies of the Influence of Strongly vs Weakly Coordinating Solvents on the Reductive Elimination Process. Journal of the American Chemical Society, 2020, 142, 6036-6050 |
| 4135047 | CIF | C69 H82 Br4 Co2 F12 N8 O7 P2 | P n n a | 26.1933; 14.6636; 20.6104 90; 90; 90 | 7916.2 | Gransbury, Gemma K.; Livesay, Brooke N.; Janetzki, Jett T.; Hay, Moya A.; Gable, Robert W.; Shores, Matthew P.; Starikova, Alyona; Boskovic, Colette Understanding the Origin of One- or Two-Step Valence Tautomeric Transitions in Bis(dioxolene)-Bridged Dinuclear Cobalt Complexes. Journal of the American Chemical Society, 2020 |
| 4135052 | CIF | C68 H79 Br4 Co2 F12 N8 O6.5 P2 | P n n a | 26.0671; 14.5259; 20.4819 90; 90; 90 | 7755.43 | Gransbury, Gemma K.; Livesay, Brooke N.; Janetzki, Jett T.; Hay, Moya A.; Gable, Robert W.; Shores, Matthew P.; Starikova, Alyona; Boskovic, Colette Understanding the Origin of One- or Two-Step Valence Tautomeric Transitions in Bis(dioxolene)-Bridged Dinuclear Cobalt Complexes. Journal of the American Chemical Society, 2020 |
| 4135053 | CIF | C67 H76 Br4 Co2 F12 N8 O6 P2 | P n n a | 26.2505; 14.6662; 20.6389 90; 90; 90 | 7945.9 | Gransbury, Gemma K.; Livesay, Brooke N.; Janetzki, Jett T.; Hay, Moya A.; Gable, Robert W.; Shores, Matthew P.; Starikova, Alyona; Boskovic, Colette Understanding the Origin of One- or Two-Step Valence Tautomeric Transitions in Bis(dioxolene)-Bridged Dinuclear Cobalt Complexes. Journal of the American Chemical Society, 2020 |
| 4135055 | CIF | C69 H82 Br4 Co2 F12 N8 O7 P2 | P n n a | 26.024; 14.4389; 20.3551 90; 90; 90 | 7648.59 | Gransbury, Gemma K.; Livesay, Brooke N.; Janetzki, Jett T.; Hay, Moya A.; Gable, Robert W.; Shores, Matthew P.; Starikova, Alyona; Boskovic, Colette Understanding the Origin of One- or Two-Step Valence Tautomeric Transitions in Bis(dioxolene)-Bridged Dinuclear Cobalt Complexes. Journal of the American Chemical Society, 2020 |
| 4135057 | CIF | C67 H76 Br4 Co2 F12 N8 O6 P2 | P n n a | 26.0119; 14.2861; 20.1208 90; 90; 90 | 7477.06 | Gransbury, Gemma K.; Livesay, Brooke N.; Janetzki, Jett T.; Hay, Moya A.; Gable, Robert W.; Shores, Matthew P.; Starikova, Alyona; Boskovic, Colette Understanding the Origin of One- or Two-Step Valence Tautomeric Transitions in Bis(dioxolene)-Bridged Dinuclear Cobalt Complexes. Journal of the American Chemical Society, 2020 |
| 4135086 | CIF | C12 H9 N3 O3 | P n n a | 22.3314; 13.9004; 7.2164 90; 90; 90 | 2240.08 | Levesque, Alexandre; Maris, Thierry; Wuest, James D. ROY Reclaims Its Crown: New Ways to Increase Polymorphic Diversity. Journal of the American Chemical Society, 2020 |
| 4135632 | CIF | C6 H3 Cu N4 | P n n a | 10.9436; 8.6154; 10.0156 90; 90; 90 | 944.31 | Geng, Shubo; Lin, En; Li, Xia; Liu, Wansheng; Wang, Ting; Wang, Zhifang; Sensharma, Debobroto; Darwish, Shaza; Andaloussi, Yassin H.; Pham, Tony; Cheng, Peng; Zaworotko, Michael J.; Chen, Yao; Zhang, Zhenjie Scalable Room-Temperature Synthesis of Highly Robust Ethane-Selective Metal-Organic Frameworks for Efficient Ethylene Purification. Journal of the American Chemical Society, 2021, 143, 8654-8660 |
| 4135633 | CIF | C2.75 H0.5 Br0.5 Cu0.5 N2 | P n n a | 10.9748; 8.5812; 10.0596 90; 90; 90 | 947.38 | Geng, Shubo; Lin, En; Li, Xia; Liu, Wansheng; Wang, Ting; Wang, Zhifang; Sensharma, Debobroto; Darwish, Shaza; Andaloussi, Yassin H.; Pham, Tony; Cheng, Peng; Zaworotko, Michael J.; Chen, Yao; Zhang, Zhenjie Scalable Room-Temperature Synthesis of Highly Robust Ethane-Selective Metal-Organic Frameworks for Efficient Ethylene Purification. Journal of the American Chemical Society, 2021, 143, 8654-8660 |
| 4135634 | CIF | C3 H1.5 Br0.5 Cu0.5 N2 | P n n a | 10.9745; 8.6056; 10.0876 90; 90; 90 | 952.7 | Geng, Shubo; Lin, En; Li, Xia; Liu, Wansheng; Wang, Ting; Wang, Zhifang; Sensharma, Debobroto; Darwish, Shaza; Andaloussi, Yassin H.; Pham, Tony; Cheng, Peng; Zaworotko, Michael J.; Chen, Yao; Zhang, Zhenjie Scalable Room-Temperature Synthesis of Highly Robust Ethane-Selective Metal-Organic Frameworks for Efficient Ethylene Purification. Journal of the American Chemical Society, 2021, 143, 8654-8660 |
| 4135635 | CIF | C2.5 Br0.5 Cu0.5 N2 | P n n a | 11.0306; 8.6572; 10.0114 90; 90; 90 | 956 | Geng, Shubo; Lin, En; Li, Xia; Liu, Wansheng; Wang, Ting; Wang, Zhifang; Sensharma, Debobroto; Darwish, Shaza; Andaloussi, Yassin H.; Pham, Tony; Cheng, Peng; Zaworotko, Michael J.; Chen, Yao; Zhang, Zhenjie Scalable Room-Temperature Synthesis of Highly Robust Ethane-Selective Metal-Organic Frameworks for Efficient Ethylene Purification. Journal of the American Chemical Society, 2021, 143, 8654-8660 |
| 4301619 | CIF | C26 H36 N6 Ni O11 | P n n a | 7.5162; 27.7143; 13.7502 90; 90; 90 | 2864.25 | Eugenio Coronado; Carlos Giménez-Saiz; Francisco M. Romero; Ana Tarazón Metal Complexes of a Picolinate-Based Nitronyl Nitroxide Free Radical Inorganic Chemistry, 2009, 48, 2205-2214 |
| 4301620 | CIF | C26 H36 Co N6 O11 | P n n a | 7.5667; 27.8458; 13.8927 90; 90; 90 | 2927.2 | Eugenio Coronado; Carlos Giménez-Saiz; Francisco M. Romero; Ana Tarazón Metal Complexes of a Picolinate-Based Nitronyl Nitroxide Free Radical Inorganic Chemistry, 2009, 48, 2205-2214 |
| 4301621 | CIF | C26 H36 N6 O11 Zn | P n n a | 7.5397; 27.9622; 13.9281 90; 90; 90 | 2936.41 | Eugenio Coronado; Carlos Giménez-Saiz; Francisco M. Romero; Ana Tarazón Metal Complexes of a Picolinate-Based Nitronyl Nitroxide Free Radical Inorganic Chemistry, 2009, 48, 2205-2214 |
| 4301622 | CIF | C26 H36 Mn N6 O11 | P n n a | 7.528; 28.011; 14.071 90; 90; 90 | 2967.11 | Eugenio Coronado; Carlos Giménez-Saiz; Francisco M. Romero; Ana Tarazón Metal Complexes of a Picolinate-Based Nitronyl Nitroxide Free Radical Inorganic Chemistry, 2009, 48, 2205-2214 |
| 4303676 | CIF | C14 H6 Ag3 Gd N2 O11 | P n n a | 8.2092; 14.487; 13.848 90; 90; 90 | 1646.9 | Xiao-Qing Zhao; Bin Zhao; Shi Wei; Peng Cheng Synthesis, Structures, and Luminescent and Magnetic Properties of Ln-Ag Heterometal-Organic Frameworks Inorganic Chemistry, 2009, 48, 11048-11057 |
| 4303677 | CIF | C14 H6 Ag3 N2 O11 Tb | P n n a | 8.2405; 14.5013; 13.8205 90; 90; 90 | 1651.5 | Xiao-Qing Zhao; Bin Zhao; Shi Wei; Peng Cheng Synthesis, Structures, and Luminescent and Magnetic Properties of Ln-Ag Heterometal-Organic Frameworks Inorganic Chemistry, 2009, 48, 11048-11057 |
| 4303678 | CIF | C14 H6 Ag3 Dy N2 O11 | P n n a | 8.2603; 14.53; 13.796 90; 90; 90 | 1655.8 | Xiao-Qing Zhao; Bin Zhao; Shi Wei; Peng Cheng Synthesis, Structures, and Luminescent and Magnetic Properties of Ln-Ag Heterometal-Organic Frameworks Inorganic Chemistry, 2009, 48, 11048-11057 |
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