Search results

Formula: - C252 H324 N12 -
Comments: Xinchang Wang; Yu Wang; Huayan Yang; Hongxun Fang; Ruixue Chen; Yibin Sun; Nanfeng Zheng; Kai Tan; Xin Lu; Zhongqun Tian; Xiaoyu Cao Assembled molecular face-rotating polyhedra to transfer chirality from two to three dimensions Nature Communications 7 (2016) 12469
Space group: R 3
Cell volume: 24185
Cell parameters: 23.3017; 23.3017; 51.4329; 90; 90; 120;

COD ID: 1548372

Formula: - C252 H324 N12 -
Comments: Xinchang Wang; Yu Wang; Huayan Yang; Hongxun Fang; Ruixue Chen; Yibin Sun; Nanfeng Zheng; Kai Tan; Xin Lu; Zhongqun Tian; Xiaoyu Cao Assembled molecular face-rotating polyhedra to transfer chirality from two to three dimensions Nature Communications 7 (2016) 12469
Space group: R 3
Cell volume: 24207.1
Cell parameters: 23.1134; 23.1134; 52.322; 90; 90; 120;

COD ID: 1548373

Formula: - C252 H324 N12 -
Comments: Xinchang Wang; Yu Wang; Huayan Yang; Hongxun Fang; Ruixue Chen; Yibin Sun; Nanfeng Zheng; Kai Tan; Xin Lu; Zhongqun Tian; Xiaoyu Cao Assembled molecular face-rotating polyhedra to transfer chirality from two to three dimensions Nature Communications 7 (2016) 12469
Space group: R 3
Cell volume: 23919
Cell parameters: 23.121; 23.121; 51.666; 90; 90; 120;

COD ID: 1548374

Formula: - C252 H324 N12 -
Comments: Xinchang Wang; Yu Wang; Huayan Yang; Hongxun Fang; Ruixue Chen; Yibin Sun; Nanfeng Zheng; Kai Tan; Xin Lu; Zhongqun Tian; Xiaoyu Cao Assembled molecular face-rotating polyhedra to transfer chirality from two to three dimensions Nature Communications 7 (2016) 12469
Space group: R 3
Cell volume: 24337.1
Cell parameters: 23.2072; 23.2072; 52.1786; 90; 90; 120;

COD ID: 1549250

Formula: - C103.75 H111.5 Cl15.5 N24 -
Comments: McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions (2018)
Space group: R 3
Cell volume: 8453.2
Cell parameters: 21.3987; 21.3987; 21.3164; 90; 90; 120;

COD ID: 1550830

Formula: - C6 H12 Fe Mg Na O18 -
Comments: Huskic, Igor; Novendra, Novendra; Lim, Dae-Woon; Topić, Filip; Titi, Hatem M.; Pekov, I. V.; Krivovichev, S.; Navrotsky, Alexandra; Kitagawa, Hiroshi; Friščić, Tomislav Functionality in Metal-Organic Framework Minerals: Proton Conductivity, Stability and Potential for Polymorphism Chemical Science (2019)
Space group: R 3
Cell volume: 2465.2
Cell parameters: 9.77454; 9.77454; 29.794; 90; 90; 120;

COD ID: 2003020
CIF file Original IUCr paper	Formula: - B2 Ba O2 - Comments: Xue, D. F.; Zhang, S. Y. Structure and Non-linear Optical Properties of β -Barium Borate Acta Crystallographica Section B 54(5) (1998) 652-656 Space group: R 3 Cell volume: 1729.64 Cell parameters: 12.532; 12.532; 12.717; 90; 90; 120;

COD ID: 2009566
CIF file Original IUCr paper	Formula: - H13 Mg O9 P - Comments: Powell, D. R.; Smith, S. K.; Ross, F. K.; Farrar, T. C. Neutron and X-ray diffraction study of magnesium phosphite hexahydrate, [Mg(H~2~O)~6~]^2+^[PHO~3~]^2{‒^} Acta Crystallographica Section C 50(3) (1994) 342-346 Space group: R 3 Cell volume: 614.47 Cell parameters: 8.8281; 8.8281; 9.104; 90; 90; 120;

COD ID: 2009567
CIF file Original IUCr paper	Formula: - H13 Mg O9 P - Comments: Powell, D. R.; Smith, S. K.; Ross, F. K.; Farrar, T. C. Neutron and X-ray diffraction study of magnesium phosphite hexahydrate, [Mg(H~2~O)~6~]^2+^[PHO~3~]^2{‒^} Acta Crystallographica Section C 50(3) (1994) 342-346 Space group: R 3 Cell volume: 623.2 Cell parameters: 8.868; 8.868; 9.15; 90; 90; 120;

COD ID: 2021261

Formula: - C42 H18 Dy3 N6 Na O73.5 Si W12 -
Comments: Derakhshanrad, Shadi; Mirzaei, Masoud; Najafi, Atefeh; Ritchie, Chris; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T. Surface-grafted lanthanoid complexes of the tungstosilicate polyanion [SiW~12~O~40~]^4{-^}: a synthetic, structural and computational investigation Acta Crystallographica Section C 74(11) (2018)
Space group: R 3
Cell volume: 6725.58
Cell parameters: 20.3334; 20.3334; 18.7836; 90; 90; 120;

COD ID: 2021262

Formula: - C21 H53 N3 Na O80 Pr3 Si W12 -
Comments: Derakhshanrad, Shadi; Mirzaei, Masoud; Najafi, Atefeh; Ritchie, Chris; Bauzá, Antonio; Frontera, Antonio; Mague, Joel T. Surface-grafted lanthanoid complexes of the tungstosilicate polyanion [SiW~12~O~40~]^4{-^}: a synthetic, structural and computational investigation Acta Crystallographica Section C 74(11) (2018)
Space group: R 3
Cell volume: 5992.8
Cell parameters: 18.119; 18.119; 21.078; 90; 90; 120;

COD ID: 2100040
CIF file Original IUCr paper	Formula: - C33 H33 N Si - Comments: Richard E. Marsh Space group <i>P</i>1: an update Acta Crystallographica Section B 61(3) (2005) 359-359 Space group: R 3 Cell volume: 5864.36 Cell parameters: 24.95; 24.95; 10.878; 90; 90; 120;

COD ID: 2237003

Formula: - C113 H90 Eu2 N6 O9 P6 S5 -
Comments: Thames, Anthony T.; White, Frankie D.; Pham, Lam N.; Xiang, Kang Rui; Sykora, Richard E. Tris(thiocyanato-κN)tris(triphenylphosphine oxide-κO)europium(III)‒(nitrato-κ^2^O,O')bis(thiocyanato-κN)tris(triphenylphosphine oxide-κO)europium(III) (1/1) Acta Crystallographica Section E 68(12) (2012) m1530
Space group: R 3
Cell volume: 7984.6
Cell parameters: 20.3249; 20.3249; 22.3186; 90; 90; 120;

COD ID: 2239507

Formula: - C21 H22 Cl N -
Comments: Diallo, Waly; Diop, Libasse; Plasseraud, Laurent; Cattey, Hélène Tribenzylammonium chloride Acta Crystallographica Section E 70(5) (2014) o618-o619
Space group: R 3
Cell volume: 1374.15
Cell parameters: 15.3833; 15.3833; 6.7051; 90; 90; 120;

COD ID: 2241604

Formula: - C117 H98 Cl3 Cu3 N13 O14 P6 -
Comments: Mathivathanan, Logesh; Cruz, Raquel; Raptis, Raphael G. A [Cu~3~(μ~3~-O)]‒pyrazolate metallacycle with terminal nitrate ligands exhibiting point group symmetry 3 Acta Crystallographica Section E 72(4) (2016) 492-494
Space group: R 3
Cell volume: 8467.3
Cell parameters: 23.038; 23.038; 18.4214; 90; 90; 120;

COD ID: 4032853

Formula: - C14 H18 F3 N O2 -
Comments: Dolfen, Jeroen; Boydas, Esma Birsen; Van Speybroeck, Veronique; Catak, Saron; Van Hecke, Kristof; D'hooghe, Matthias Asymmetric Synthesis of 3,4-Disubstituted 2-(Trifluoromethyl)pyrrolidines through Rearrangement of Chiral 2-(2,2,2-Trifluoro-1-hydroxyethyl)azetidines. The Journal of organic chemistry 82(19) (2017) 10092-10109
Space group: R 3
Cell volume: 6838.2
Cell parameters: 27.2782; 27.2782; 10.61163; 90; 90; 120;

COD ID: 4338473
CIF file	Formula: - Al27 B57 H54 O153 - Comments: Li, Qiaoqi; Lin, Cong; Zhou, Zhengyang; Ju, Jing; Li, Guobao; Lin, Jianhua; Gao, Wenliang; Cong, Rihong; Yang, Tao Systematic study of cr(3+) substitution into octahedra-based microporous aluminoborates. Inorganic chemistry 53(11) (2014) 5600-5608 Space group: R 3 Cell volume: 2953.5 Cell parameters: 22.031; 22.031; 7.0266; 90; 90; 120;

COD ID: 4341116
CIF file	Formula: - C140 H128.79 Cl16 Cu6 O15 P6 - Comments: Yang, Xiang-Yuan; Li, Yongxin; Pullarkat, Sumod A. A one-pot diastereoselective self assembly of C-stereogenic copper(i) diphosphine clusters. Inorganic chemistry 53(19) (2014) 10232-10239 Space group: R 3 Cell volume: 10480.3 Cell parameters: 17.3752; 17.3752; 40.085; 90; 90; 120;

COD ID: 4341117
CIF file	Formula: - C144.62 H115.25 Cl7.25 Cu6 F6 O6 P6 - Comments: Yang, Xiang-Yuan; Li, Yongxin; Pullarkat, Sumod A. A one-pot diastereoselective self assembly of C-stereogenic copper(i) diphosphine clusters. Inorganic chemistry 53(19) (2014) 10232-10239 Space group: R 3 Cell volume: 42511 Cell parameters: 33.8786; 33.8786; 42.7681; 90; 90; 120;

COD ID: 4341120
CIF file	Formula: - C142 H152 Cl38 Cu6 O24 P6 - Comments: Yang, Xiang-Yuan; Li, Yongxin; Pullarkat, Sumod A. A one-pot diastereoselective self assembly of C-stereogenic copper(i) diphosphine clusters. Inorganic chemistry 53(19) (2014) 10232-10239 Space group: R 3 Cell volume: 12391 Cell parameters: 29.118; 29.118; 16.8751; 90; 90; 120;

COD ID: 4343288

Formula: - C107 H201 Cu4 Er9 N4 O55 P6 -
Comments: Moreno Pineda, Eufemio; Heesing, Christian; Tuna, Floriana; Zheng, Yan-Zhen; McInnes, Eric J. L.; Schnack, Jürgen; Winpenny, Richard E. P. Copper Lanthanide Phosphonate Cages: Highly Symmetric {Cu3Ln9P6} and {Cu6Ln6P6} Clusters with C3v and D3h Symmetry. Inorganic chemistry (2015) 150610150327001
Space group: R 3
Cell volume: 11917.8
Cell parameters: 20.5114; 20.5114; 32.7097; 90; 90; 120;

COD ID: 4343289

Formula: - C107 H201 Cu4 Gd9 N4 O55 P6 -
Comments: Moreno Pineda, Eufemio; Heesing, Christian; Tuna, Floriana; Zheng, Yan-Zhen; McInnes, Eric J. L.; Schnack, Jürgen; Winpenny, Richard E. P. Copper Lanthanide Phosphonate Cages: Highly Symmetric {Cu3Ln9P6} and {Cu6Ln6P6} Clusters with C3v and D3h Symmetry. Inorganic chemistry (2015) 150610150327001
Space group: R 3
Cell volume: 12164.3
Cell parameters: 20.5695; 20.5695; 33.1977; 90; 90; 120;

COD ID: 4343291

Formula: - C107 H201 Cu4 Ho9 N4 O55 P6 -
Comments: Moreno Pineda, Eufemio; Heesing, Christian; Tuna, Floriana; Zheng, Yan-Zhen; McInnes, Eric J. L.; Schnack, Jürgen; Winpenny, Richard E. P. Copper Lanthanide Phosphonate Cages: Highly Symmetric {Cu3Ln9P6} and {Cu6Ln6P6} Clusters with C3v and D3h Symmetry. Inorganic chemistry (2015) 150610150327001
Space group: R 3
Cell volume: 12102.7
Cell parameters: 20.6225; 20.6225; 32.86; 90; 90; 120;

COD ID: 4343292

Formula: - C107 H201 Cu4 N4 O55 P6 Tb9 -
Comments: Moreno Pineda, Eufemio; Heesing, Christian; Tuna, Floriana; Zheng, Yan-Zhen; McInnes, Eric J. L.; Schnack, Jürgen; Winpenny, Richard E. P. Copper Lanthanide Phosphonate Cages: Highly Symmetric {Cu3Ln9P6} and {Cu6Ln6P6} Clusters with C3v and D3h Symmetry. Inorganic chemistry (2015) 150610150327001
Space group: R 3
Cell volume: 11960.8
Cell parameters: 20.5015; 20.5015; 32.8593; 90; 90; 120;

COD ID: 4343293

Formula: - C107 H201 Cu4 Dy9 N4 O55 P6 -
Comments: Moreno Pineda, Eufemio; Heesing, Christian; Tuna, Floriana; Zheng, Yan-Zhen; McInnes, Eric J. L.; Schnack, Jürgen; Winpenny, Richard E. P. Copper Lanthanide Phosphonate Cages: Highly Symmetric {Cu3Ln9P6} and {Cu6Ln6P6} Clusters with C3v and D3h Symmetry. Inorganic chemistry (2015) 150610150327001
Space group: R 3
Cell volume: 11954.1
Cell parameters: 20.5394; 20.5394; 32.7197; 90; 90; 120;

COD ID: 4345589

Formula: - C18 H25 F N3 Ni O2.5 -
Comments: Wenz, Jan; Kochan, Alexander; Wadepohl, Hubert; Gade, Lutz H. A Readily Accessible Chiral NNN Pincer Ligand with a Pyrrole Backbone and Its Ni(II) Chemistry: Syntheses, Structural Chemistry, and Bond Activations. Inorganic chemistry 56(6) (2017) 3631-3643
Space group: R 3
Cell volume: 8699.1
Cell parameters: 40.6952; 40.6952; 6.06539; 90; 90; 120;

COD ID: 4345977
CIF file	Formula: - C28 H33 F4 O3 S Sb - Comments: Yang, Mengxi; Gabbaï, François P Synthesis and Properties of Triarylhalostibonium Cations. Inorganic chemistry 56(15) (2017) 8644-8650 Space group: R 3 Cell volume: 8149.7 Cell parameters: 27.1408; 27.1408; 12.7751; 90; 90; 120;

COD ID: 4513710

Formula: - C78 H60 Br6 Fe O12 P3 -
Comments: Benmansour, Samia; Gómez-Claramunt, Patricia; Vallés-García, Cristina; Mínguez Espallargas, Guillermo; Gómez García, Carlos J. Key Role of the Cation in the Crystallization of Chiral Tris(Anilato)Metalate Magnetic Anions Crystal Growth & Design 16(1) (2016) 518
Space group: R 3
Cell volume: 5660.2
Cell parameters: 14.4289; 14.4289; 31.393; 90; 90; 120;

COD ID: 4514161

Formula: - C20 H20 N2 O3 -
Comments: Reay, Alan J.; Hammarback, L. Anders; Bray, Joshua T. W.; Sheridan, Thomas; Turnbull, David; Whitwood, Adrian C.; Fairlamb, Ian J. S. Mild and Regioselective Pd(OAc)2-Catalyzed C‒H Arylation of Tryptophans by [ArN2]X, Promoted by Tosic Acid ACS Catalysis (2017) 5174
Space group: R 3
Cell volume: 3985.41
Cell parameters: 21.2602; 21.2602; 10.1814; 90; 90; 120;

COD ID: 4514163

Formula: - C20 H19 Cl N2 O3 -
Comments: Reay, Alan J.; Hammarback, L. Anders; Bray, Joshua T. W.; Sheridan, Thomas; Turnbull, David; Whitwood, Adrian C.; Fairlamb, Ian J. S. Mild and Regioselective Pd(OAc)2-Catalyzed C‒H Arylation of Tryptophans by [ArN2]X, Promoted by Tosic Acid ACS Catalysis (2017) 5174
Space group: R 3
Cell volume: 4181.48
Cell parameters: 20.7806; 20.7806; 11.18107; 90; 90; 120;

COD ID: 6000095

Formula: - H3 Mo12 O40 P -
Comments: Marosi, L.; Platero, E. E.; Cifre, J.; Arean, C. O. Thermal dehydration of H3+xPVxM12-xO40 center dot yH(2)O Keggin type heteropolyacids; formation, thermal stability and structure of the anhydrous acids H3PM12O40, of the corresponding anhydrides PM12O38.5 and of a novel trihydrate H3PW12O40 3H(2)O Journal of Materials Chemistry 10 (2000) 1949-1955
Space group: R 3
Cell volume: 9982.15
Cell parameters: 11.48; 11.48; 87.46; 90; 90; 120;

COD ID: 6000644
CIF file	Formula: - As Li O4 Zn - Comments: Jensen, T. R.; Norby, P.; Hanson, J. C.; Simonsen, O.; Skou, E. M.; Stein, P. C.; Boye, H. A. Hydrothermal synthesis and crystal structure of alpha-LiZnAsO4 Journal of Materials Chemistry 8 (1998) 969-975 Space group: R 3 Cell volume: 1595.24 Cell parameters: 14.009; 14.009; 9.386; 90; 90; 120;

COD ID: 7029541

Formula: - C54 H57 Eu F9 N9 O12 S3 -
Comments: Neil, Emily R.; Funk, Alexander M.; Yufit, Dmitry S.; Parker, David Synthesis, stereocontrol and structural studies of highly luminescent chiral tris-amidepyridyl-triazacyclononane lanthanide complexes. Dalton transactions (Cambridge, England : 2003) 43(14) (2014) 5490-5504
Space group: R 3
Cell volume: 4650.6
Cell parameters: 21.6392; 21.6392; 11.4683; 90; 90; 120;

COD ID: 7029542

Formula: - C54 H57 Eu F9 N9 O12 S3 -
Comments: Neil, Emily R.; Funk, Alexander M.; Yufit, Dmitry S.; Parker, David Synthesis, stereocontrol and structural studies of highly luminescent chiral tris-amidepyridyl-triazacyclononane lanthanide complexes. Dalton transactions (Cambridge, England : 2003) 43(14) (2014) 5490-5504
Space group: R 3
Cell volume: 4665.9
Cell parameters: 21.6423; 21.6423; 11.5027; 90; 90; 120;

COD ID: 7029543

Formula: - C54 H57 F9 N9 O12 S3 Yb -
Comments: Neil, Emily R.; Funk, Alexander M.; Yufit, Dmitry S.; Parker, David Synthesis, stereocontrol and structural studies of highly luminescent chiral tris-amidepyridyl-triazacyclononane lanthanide complexes. Dalton transactions (Cambridge, England : 2003) 43(14) (2014) 5490-5504
Space group: R 3
Cell volume: 4619.4
Cell parameters: 21.836; 21.836; 11.1868; 90; 90; 120;

COD ID: 7044447

Formula: - C201 H201 Br Cu18 N45 Na O48 -
Comments: Chen, Zilu; Shen, Yanling; Li, Lingling; Zou, Hua-Hong; Fu, Xiaoxiao; Liu, Ziyuan; Wang, Kai; Liang, Fupei High-nuclearity heterometallic clusters with both anion and cation sandwiched by planar cluster units: synthesis, structure and properties Dalton Trans. (2017)
Space group: R 3
Cell volume: 15972.9
Cell parameters: 30.7836; 30.7836; 19.4632; 90; 90; 120;

COD ID: 7044449

Formula: - C201 H201 Cl Cu18 N45 Na O48 -
Comments: Chen, Zilu; Shen, Yanling; Li, Lingling; Zou, Hua-Hong; Fu, Xiaoxiao; Liu, Ziyuan; Wang, Kai; Liang, Fupei High-nuclearity heterometallic clusters with both anion and cation sandwiched by planar cluster units: synthesis, structure and properties Dalton Trans. (2017)
Space group: R 3
Cell volume: 15815.1
Cell parameters: 30.6756; 30.6756; 19.4069; 90; 90; 120;

COD ID: 7047288

Formula: - C21 H15.67 Gd2 N3 O15.33 -
Comments: Kumar, Manesh; Kariem, Mukaddus; Sheikh, Haq Nawaz; Frontera, Antonio; Seth, Saikat Kumar; Jassal, Amanpreet Kaur A series of 3D lanthanide coordination polymers decorated with a rigid 3,5-pyridinedicarboxylic acid linker: syntheses, structural diversity, DFT study, Hirshfeld surface analysis, luminescence and magnetic properties Dalton Transactions (2018)
Space group: R 3
Cell volume: 7225.28
Cell parameters: 19.5746; 19.5746; 21.774; 90; 90; 120;

COD ID: 7048786

Formula: - C36.33 H48 Cu F8 N4 O P1.33 -
Comments: Das, Biswanath; Bhadbhade, Mohan; Thapper, Anders; Ling, Chris D.; Colbran, Stephen Boyd A New Tri-nuclear Cu-carbonate Cluster Utilizing CO2 as C1-Building Block-Reactive Intermediates, Probable Mechanism, EPR and Magnetic Studies Dalton Transactions (2019)
Space group: R 3
Cell volume: 9616.4
Cell parameters: 19.423; 19.423; 29.434; 90; 90; 120;

COD ID: 7049754
CIF file	Formula: - C39.75 H36.5 Cl2.5 N O2 P2 Pd - Comments: Wang, Yingxia; Eichhoefer, Andreas; Weigend, Florian; Fenske, Dieter; Fuhr, Olaf The coordination behavior of 2,3-bis(diphenylphosphino)maleic-N-phenylimide towards copper, silver, gold and palladium Dalton Transactions (2019) Space group: R 3 Cell volume: 16555.1 Cell parameters: 37.7119; 37.7119; 13.4414; 90; 90; 120;

COD ID: 7109598
CIF file	Formula: - C36 H40 O3 S - Comments: Christopher S. Frampton; Kamal A. Ketuly; A. Hamid A. Hadi; James H. Gall; David D. MacNicol Engineering robust polar chiral clathrate crystals Chem.Commun. 49 (2013) 7198 Space group: R 3 Cell volume: 6956.34 Cell parameters: 27.2258; 27.2258; 10.8365; 90; 90; 120;

COD ID: 7109599
CIF file	Formula: - C109 H121 Cl4 O9.5 S3 - Comments: Christopher S. Frampton; Kamal A. Ketuly; A. Hamid A. Hadi; James H. Gall; David D. MacNicol Engineering robust polar chiral clathrate crystals Chem.Commun. 49 (2013) 7198 Space group: R 3 Cell volume: 7006.4 Cell parameters: 27.3283; 27.3283; 10.8327; 90; 90; 120;

COD ID: 7109600
CIF file	Formula: - C36 H40 O3 S - Comments: Christopher S. Frampton; Kamal A. Ketuly; A. Hamid A. Hadi; James H. Gall; David D. MacNicol Engineering robust polar chiral clathrate crystals Chem.Commun. 49 (2013) 7198 Space group: R 3 Cell volume: 6956.34 Cell parameters: 27.2258; 27.2258; 10.8365; 90; 90; 120;

COD ID: 7112070

Formula: - C20 H19 F N2 O3 -
Comments: Thomas J. Williams; Alan J. Reay; Adrian C. Whitwood; Ian J. S. Fairlamb A mild and selective Pd-mediated methodology for the synthesis of highly fluorescent 2-arylated tryptophans and tryptophan-containing peptides: a catalytic role for Pd0 nanoparticles? Chem.Commun. 50 (2014) 3052
Space group: R 3
Cell volume: 4012.2
Cell parameters: 21.0404; 21.0404; 10.4652; 90; 90; 120;

COD ID: 7119708

Formula: - C84.56 H83.22 Cl12.57 I1.8 N12 O2.95 Ru3 -
Comments: Ibáñez, S; Poyatos, M.; Peris, E. A D3h-symmetry hexaazatriphenylene-tris-N-heterocyclic carbene ligand and its coordination to iridium and gold: preliminary catalytic studies. Chemical communications (Cambridge, England) 53(26) (2017) 3733-3736
Space group: R 3
Cell volume: 8785.4
Cell parameters: 17.7983; 17.7983; 32.0239; 90; 90; 120;

COD ID: 7120210
CIF file	Formula: - C17 H13 Cl N4 O - Comments: Enders, Dieter; Mahajan, Suruchi; Chauhan, Pankaj; Kaya, Uğur; Deckers, Kristina; Rissanen, Kari Enantioselective synthesis of pyrazolone α-aminonitrile derivatives via an organocatalytic Strecker reaction Chem. Commun. (2017) Space group: R 3 Cell volume: 3609.37 Cell parameters: 19.5452; 19.5452; 10.9099; 90; 90; 120;

COD ID: 7123146
CIF file	Formula: - C24 H20 Br N O6 - Comments: Zhu, Shi-Ya; Zhang, Yuanzheng; Chen, Xin-Fa; Huang, Jun; Shi, Shihui; Hui, Xin-Ping Highly enantioselective synthesis of functionalized azepino[1,2-a]indoles via NHC-catalyzed [3+4] annulation Chemical Communications (2019) Space group: R 3 Cell volume: 4993.3 Cell parameters: 23.787; 23.787; 10.19; 90; 90; 120;

COD ID: 7123374
CIF file	Formula: - Cu17 Ga22 S88 Sn17 - Comments: Zhang, Jiaxu; Wang, Xiang; Lv, Jing; Li, Dong-Sheng; Wu, Tao A multivalent mixed-metal strategy for single-Cu±ion-bridged cluster-based chalcogenide open frameworks for sensitive nonenzymatic detection on glucose Chemical Communications (2019) Space group: R 3 Cell volume: 74349 Cell parameters: 51.949; 51.949; 31.812; 90; 90; 120;

COD ID: 7221983

Formula: - C57 H60 N6 O55 S3 Zn9 -
Comments: Tahier, Tayyibah; Oliver, Clive L. In situ variable-temperature single crystal X-ray diffraction studies of the single-crystal-to-single-crystal dehydration and rehydration of a mixed-ligand 2D zinc metal‒organic framework using trimesate and 4,4′-bipyridine-N,N′-dioxide as ligands CrystEngComm 17(46) (2015) 8946
Space group: R 3
Cell volume: 6574
Cell parameters: 18.816; 18.816; 21.441; 90; 90; 120;

COD ID: 7221984

Formula: - C57 H54 N6 O51.2 S3 Zn9 -
Comments: Tahier, Tayyibah; Oliver, Clive L. In situ variable-temperature single crystal X-ray diffraction studies of the single-crystal-to-single-crystal dehydration and rehydration of a mixed-ligand 2D zinc metal‒organic framework using trimesate and 4,4′-bipyridine-N,N′-dioxide as ligands CrystEngComm 17(46) (2015) 8946
Space group: R 3
Cell volume: 6601
Cell parameters: 18.798; 18.798; 21.57; 90; 90; 120;

COD ID: 7221985

Formula: - C57 H54 N6 O48.96 S3 Zn9 -
Comments: Tahier, Tayyibah; Oliver, Clive L. In situ variable-temperature single crystal X-ray diffraction studies of the single-crystal-to-single-crystal dehydration and rehydration of a mixed-ligand 2D zinc metal‒organic framework using trimesate and 4,4′-bipyridine-N,N′-dioxide as ligands CrystEngComm 17(46) (2015) 8946
Space group: R 3
Cell volume: 6568
Cell parameters: 18.795; 18.795; 21.47; 90; 90; 120;

COD ID: 7221986

Formula: - C57 H42 N6 O42 S3 Zn9 -
Comments: Tahier, Tayyibah; Oliver, Clive L. In situ variable-temperature single crystal X-ray diffraction studies of the single-crystal-to-single-crystal dehydration and rehydration of a mixed-ligand 2D zinc metal‒organic framework using trimesate and 4,4′-bipyridine-N,N′-dioxide as ligands CrystEngComm 17(46) (2015) 8946
Space group: R 3
Cell volume: 6696
Cell parameters: 18.889; 18.889; 21.67; 90; 90; 120;

COD ID: 7221987

Formula: - C57 H42 N6 O42 S3 Zn9 -
Comments: Tahier, Tayyibah; Oliver, Clive L. In situ variable-temperature single crystal X-ray diffraction studies of the single-crystal-to-single-crystal dehydration and rehydration of a mixed-ligand 2D zinc metal‒organic framework using trimesate and 4,4′-bipyridine-N,N′-dioxide as ligands CrystEngComm 17(46) (2015) 8946
Space group: R 3
Cell volume: 6482
Cell parameters: 18.723; 18.723; 21.353; 90; 90; 120;

COD ID: 7221988

Formula: - C57 H42 N6 O50.95 S3 Zn9 -
Comments: Tahier, Tayyibah; Oliver, Clive L. In situ variable-temperature single crystal X-ray diffraction studies of the single-crystal-to-single-crystal dehydration and rehydration of a mixed-ligand 2D zinc metal‒organic framework using trimesate and 4,4′-bipyridine-N,N′-dioxide as ligands CrystEngComm 17(46) (2015) 8946
Space group: R 3
Cell volume: 6568
Cell parameters: 18.815; 18.815; 21.425; 90; 90; 120;

COD ID: 7223982
CIF file	Formula: - C72 H43 Co3 N6 O13 - Comments: Shen, Jian-Qiang; Wei, Yong-Sheng; Liao, Pei-Qin; Lin, Rui-Biao; Zhou, Dong-Dong; Zhang, Jie-Peng; Chen, Xiao-Ming Unique (3,9)-connected porous coordination polymers constructed by tripodal ligands with bent arms CrystEngComm 18(22) (2016) 4115 Space group: R 3 Cell volume: 7159.7 Cell parameters: 20.186; 20.186; 20.2891; 90; 90; 120;

COD ID: 7224986
CIF file	Formula: - C12 H14 N12 O4 Zn2 - Comments: Cao, Chun-Shuai; Hu, Huan-Cheng; Xu, Hang; Qiao, Wan-Zhen; Zhao, Bin Two solvent-stable MOFs as a recyclable luminescent probe for detecting dichromate or chromate anions CrystEngComm 18(23) (2016) 4445 Space group: R 3 Cell volume: 1531.7 Cell parameters: 10.0316; 10.0316; 17.575; 90; 90; 120;

COD ID: 7225333