Crystallography Open Database
Search results
Result: there are 1728 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Crystal growth & design' volume of publication is 14
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 4510064 | CIF | C109 H121 Br3 O12 | R -3 :H | 26.8516; 26.8516; 10.9156 90; 90; 120 | 6815.8 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510065 | CIF | C109 H120 Cl4 O12 | R -3 :H | 26.8671; 26.8671; 10.8701 90; 90; 120 | 6795.3 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510066 | CIF | C114 H125 Cl O12 | R -3 :H | 26.9382; 26.9382; 10.8315 90; 90; 120 | 6807 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510067 | CIF | C114 H125 I O12 | R -3 :H | 26.971; 26.971; 10.7851 90; 90; 120 | 6794.4 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510068 | CIF | C114 H125 Br O12 | R -3 :H | 26.9737; 26.9737; 10.8105 90; 90; 120 | 6811.7 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510069 | CIF | C57 H66 O7 | R -3 :H | 26.8442; 26.8442; 10.9227 90; 90; 120 | 6816.5 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510070 | CIF | C115 H128 O12 | R -3 :H | 26.9804; 26.9804; 10.8173 90; 90; 120 | 6819.4 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510071 | CIF | C114 H126 O12 | R -3 :H | 26.904; 26.904; 10.885 90; 90; 120 | 6823.3 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510072 | CIF | C58 H68 O7 | R -3 :H | 26.8873; 26.8873; 10.9267 90; 90; 120 | 6840.9 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510073 | CIF | C113 H129 N O12 | R -3 :H | 26.9547; 26.9547; 10.9143 90; 90; 120 | 6867.5 | Lee, Jackson J.; Sobolev, Alexandre N.; Turner, Michael J.; Fuller, Rebecca O.; Iversen, Bo B.; Koutsantonis, George A.; Spackman, Mark A. Molecular Imprisonment: Host Response to Guest Location, Orientation, and Dynamics in Clathrates of Dianin’s Compound Crystal Growth & Design, 2014, 14, 1296 |
| 4510074 | CIF | C21 H17 N5 | C 1 c 1 | 42.009; 5.9508; 13.5541 90; 92.817; 90 | 3384.3 | Laird, Rebecca C.; Nguyen, Nam P.; Rusch, Sara F.; Baltrusaitis, Jonas; Macgillivray, Leonard R. Noncentrosymmetric Packings Influenced by Electronic Properties of Products of Click Reactions. Crystal growth & design, 2014, 14, 893-896 |
| 4510075 | CIF | C20 H15 N5 | C 1 c 1 | 37.7; 5.7148; 7.2827 90; 96.164; 90 | 1560 | Laird, Rebecca C.; Nguyen, Nam P.; Rusch, Sara F.; Baltrusaitis, Jonas; Macgillivray, Leonard R. Noncentrosymmetric Packings Influenced by Electronic Properties of Products of Click Reactions. Crystal growth & design, 2014, 14, 893-896 |
| 4510076 | CIF | C24 H22 N4 S2 | P 1 21/n 1 | 10.667; 18.767; 11.252 90; 93.53; 90 | 2248.2 | Dubey, Rashmi; Singh, Praveen; Singh, Ajeet K.; Yadav, Manoj K.; Swati, D.; Vinayak, Manjula; Puerta, Carmen; Valerga, Pedro; Ravi Kumar, K.; Sridhar, B.; Tewari, Ashish K. Polymorphic Signature of the Anti-inflammatory Activity of 2,2′-{[1,2-Phenylenebis(methylene)]bis(sulfanediyl)}bis(4,6-dimethylnicotinonitrile) Crystal Growth & Design, 2014, 14, 1347 |
| 4510077 | CIF | C24 H22 N4 S2 | P 1 21/n 1 | 10.6469; 18.7554; 11.2374 90; 93.539; 90 | 2239.7 | Dubey, Rashmi; Singh, Praveen; Singh, Ajeet K.; Yadav, Manoj K.; Swati, D.; Vinayak, Manjula; Puerta, Carmen; Valerga, Pedro; Ravi Kumar, K.; Sridhar, B.; Tewari, Ashish K. Polymorphic Signature of the Anti-inflammatory Activity of 2,2′-{[1,2-Phenylenebis(methylene)]bis(sulfanediyl)}bis(4,6-dimethylnicotinonitrile) Crystal Growth & Design, 2014, 14, 1347 |
| 4510078 | CIF | C24 H22 N4 S2 | P 1 21/c 1 | 15.815; 18.657; 14.626 90; 92.98; 90 | 4309.7 | Dubey, Rashmi; Singh, Praveen; Singh, Ajeet K.; Yadav, Manoj K.; Swati, D.; Vinayak, Manjula; Puerta, Carmen; Valerga, Pedro; Ravi Kumar, K.; Sridhar, B.; Tewari, Ashish K. Polymorphic Signature of the Anti-inflammatory Activity of 2,2′-{[1,2-Phenylenebis(methylene)]bis(sulfanediyl)}bis(4,6-dimethylnicotinonitrile) Crystal Growth & Design, 2014, 14, 1347 |
| 4510079 | CIF | C17 H15 N2 O5 Zn | P 64 2 2 | 11.5714; 11.5714; 22.773 90; 90; 120 | 2640.7 | Yang, Jin-Xia; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen Tuning Different Kinds of Entangled Networks by Varying N-Donor Ligands: From Self-Penetrating to Multi-interpenetrating Crystal Growth & Design, 2014, 14, 1047 |
| 4510080 | CIF | C17 H30 N7 O9 Zn | P -1 | 8.301; 11.146; 13.363 86.427; 84.122; 83.573 | 1220.5 | Yang, Jin-Xia; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen Tuning Different Kinds of Entangled Networks by Varying N-Donor Ligands: From Self-Penetrating to Multi-interpenetrating Crystal Growth & Design, 2014, 14, 1047 |
| 4510081 | CIF | C14 H16 N4 O4 Zn | P -1 | 8.1767; 9.8286; 10.5904 96.118; 110.718; 98.952 | 774.24 | Yang, Jin-Xia; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen Tuning Different Kinds of Entangled Networks by Varying N-Donor Ligands: From Self-Penetrating to Multi-interpenetrating Crystal Growth & Design, 2014, 14, 1047 |
| 4510082 | CIF | C36 H32 N8 O11 Zn2 | P 21 21 21 | 14.774; 15.653; 16.871 90; 90; 90 | 3902 | Yang, Jin-Xia; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen Tuning Different Kinds of Entangled Networks by Varying N-Donor Ligands: From Self-Penetrating to Multi-interpenetrating Crystal Growth & Design, 2014, 14, 1047 |
| 4510083 | CIF | C24 H24 N4 O9 Zn2 | C 1 2/c 1 | 17.37; 12.694; 12.332 90; 92.587; 90 | 2716.4 | Yang, Jin-Xia; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen Tuning Different Kinds of Entangled Networks by Varying N-Donor Ligands: From Self-Penetrating to Multi-interpenetrating Crystal Growth & Design, 2014, 14, 1047 |
| 4510084 | CIF | C80 H30 F30 O22 Pb6 | P 21 21 21 | 12.581; 26.347; 29.852 90; 90; 90 | 9895 | Santra, Atanu; Bharadwaj, Parimal K. Solvent-Induced Structural Diversity of Partially Fluorinated, Stable Pb(II) Metal‒Organic Frameworks and Their Luminescence Properties Crystal Growth & Design, 2014, 14, 1476 |
| 4510085 | CIF | C34 H18 F12 O10 Pb3 | C 1 2/c 1 | 32.565; 14.331; 18.549 90; 114.87; 90 | 7854 | Santra, Atanu; Bharadwaj, Parimal K. Solvent-Induced Structural Diversity of Partially Fluorinated, Stable Pb(II) Metal‒Organic Frameworks and Their Luminescence Properties Crystal Growth & Design, 2014, 14, 1476 |
| 4510086 | CIF | C35 H20 F12 O10 Pb3 | C 1 2/c 1 | 32.486; 14.351; 18.557 90; 114.461; 90 | 7875 | Santra, Atanu; Bharadwaj, Parimal K. Solvent-Induced Structural Diversity of Partially Fluorinated, Stable Pb(II) Metal‒Organic Frameworks and Their Luminescence Properties Crystal Growth & Design, 2014, 14, 1476 |
| 4510087 | CIF | C36 H22 F12 O10 Pb3 | C 1 2/c 1 | 32.434; 14.341; 18.581 90; 114.342; 90 | 7874 | Santra, Atanu; Bharadwaj, Parimal K. Solvent-Induced Structural Diversity of Partially Fluorinated, Stable Pb(II) Metal‒Organic Frameworks and Their Luminescence Properties Crystal Growth & Design, 2014, 14, 1476 |
| 4510088 | CIF | C78 H24 F24 O21 Pb6 | C 1 2/c 1 | 44.582; 14.441; 29.792 90; 120.92; 90 | 16455 | Santra, Atanu; Bharadwaj, Parimal K. Solvent-Induced Structural Diversity of Partially Fluorinated, Stable Pb(II) Metal‒Organic Frameworks and Their Luminescence Properties Crystal Growth & Design, 2014, 14, 1476 |
| 4510089 | CIF | C54 H40 Cd2 N8 O16 | C 1 2/c 1 | 46.715; 9.674; 32.798 90; 100.79; 90 | 14560 | Sen, Susan; Yamada, Teppei; Kitagawa, Hiroshi; Bharadwaj, Parimal K. 3D Coordination Polymer of Cd(II) with an Imidazolium-Based Linker Showing Parallel Polycatenation Forming Channels with Aligned Imidazolium Groups Crystal Growth & Design, 2014, 14, 1240 |
| 4510090 | CIF | C15 H19 N3 O4 | P 21 21 21 | 7.2754; 16.048; 25.129 90; 90; 90 | 2934 | Braga, Dario; Chelazzi, Laura; Grepioni, Fabrizia; Nanna, Saverio; Rubini, Katia; Curzi, Marco; Giaffreda, Stefano; Saxell, Heidi E.; Bratz, Matthias; Chiodo, Tiziana Imazamox: A Quest for Polymorphic Modifications of a Chiral and Racemic Herbicide Crystal Growth & Design, 2014, 14, 1430 |
| 4510091 | CIF | C15 H19 N3 O4 | P 1 21 1 | 7.262; 7.837; 27.115 90; 96.43; 90 | 1533.5 | Braga, Dario; Chelazzi, Laura; Grepioni, Fabrizia; Nanna, Saverio; Rubini, Katia; Curzi, Marco; Giaffreda, Stefano; Saxell, Heidi E.; Bratz, Matthias; Chiodo, Tiziana Imazamox: A Quest for Polymorphic Modifications of a Chiral and Racemic Herbicide Crystal Growth & Design, 2014, 14, 1430 |
| 4510092 | CIF | C15 H19 N3 O4 | P 21 21 21 | 7.2139; 14.9348; 27.803 90; 90; 90 | 2995.4 | Braga, Dario; Chelazzi, Laura; Grepioni, Fabrizia; Nanna, Saverio; Rubini, Katia; Curzi, Marco; Giaffreda, Stefano; Saxell, Heidi E.; Bratz, Matthias; Chiodo, Tiziana Imazamox: A Quest for Polymorphic Modifications of a Chiral and Racemic Herbicide Crystal Growth & Design, 2014, 14, 1430 |
| 4510093 | CIF | C15 H19 N3 O4 | P 21 21 21 | 6.1344; 12.3989; 19.8456 90; 90; 90 | 1509.45 | Braga, Dario; Chelazzi, Laura; Grepioni, Fabrizia; Nanna, Saverio; Rubini, Katia; Curzi, Marco; Giaffreda, Stefano; Saxell, Heidi E.; Bratz, Matthias; Chiodo, Tiziana Imazamox: A Quest for Polymorphic Modifications of a Chiral and Racemic Herbicide Crystal Growth & Design, 2014, 14, 1430 |
| 4510094 | CIF | C54 H34 Li2 N0 O12 | R 3 2 :H | 28.0967; 28.0967; 22.9666 90; 90; 120 | 15701.4 | Clough, Andrew; Zheng, Shou-Tian; Zhao, Xiang; Lin, Qipu; Feng, Pingyun; Bu, Xianhui New Lithium Ion Clusters for Construction of Porous MOFs Crystal Growth & Design, 2014, 14, 897 |
| 4510095 | CIF | C22 H22 Li4 N2 O13 | I -4 3 d | 21.1288; 21.1288; 21.1288 90; 90; 90 | 9432.4 | Clough, Andrew; Zheng, Shou-Tian; Zhao, Xiang; Lin, Qipu; Feng, Pingyun; Bu, Xianhui New Lithium Ion Clusters for Construction of Porous MOFs Crystal Growth & Design, 2014, 14, 897 |
| 4510096 | CIF | C114 H162 Cu6 N30 O48 | R -3 :H | 20.852; 20.852; 56.734 90; 90; 120 | 21363 | El Bakkali, Hanan; Choquesillo-Lazarte, Duane; Domínguez-Martín, Alicia; Pérez-Toro, M. Inmaculada; Lezama, L.; González-Pérez, Josefa M.; Castiñeiras, Alfonso; Niclós-Gutiérrez, Juan Cocrystallization of Mononuclear and Trinuclear Metallacycle Molecules from an Aqueous Mixed-Ligand Copper(II) Solution Crystal Growth & Design, 2014, 14, 889 |
| 4510097 | CIF | C13 H11 N3 O2 | C 1 2/c 1 | 13.299; 8.0627; 22.101 90; 100.795; 90 | 2327.9 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510098 | CIF | C13 H10 N2 O3 | P 1 21/c 1 | 7.279; 11.601; 13.669 90; 100.809; 90 | 1133.8 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510099 | CIF | C14 H12 N2 O3 | P -1 | 7.4624; 7.7677; 10.981 91.289; 95.146; 102.19 | 619.1 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510100 | CIF | C13 H9 N3 O4 | P 1 21/c 1 | 7.47; 6.7036; 24.933 90; 104.302; 90 | 1209.85 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510101 | CIF | C26 H24 N2 O6 | P 1 21/c 1 | 9.0486; 10.8727; 23.603 90; 98.1; 90 | 2299 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510102 | CIF | C20 H20 N4 O5 | P 1 21/c 1 | 17.085; 5.193; 22.891 90; 112.28; 90 | 1879 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510103 | CIF | C28 H28 N2 O6 | P -1 | 11.481; 17.733; 18.57 76.543; 88.68; 81.754 | 3639 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510104 | CIF | C26 H22 N4 O8 | P 1 21/c 1 | 8.874; 6.631; 21.677 90; 110.72; 90 | 1193 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510105 | CIF | C13 H14 N2 O3 | P 1 21/c 1 | 10.0131; 9.7642; 12.7953 90; 99.809; 90 | 1232.71 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510106 | CIF | C13 H18 N2 O4 | P -1 | 8.968; 9.451; 9.637 108.53; 105.05; 103.4 | 702.458 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510107 | CIF | C14 H21 N3 O4 | P -1 | 9.3411; 9.6823; 10.1738 67.609; 67.912; 88.549 | 780.8 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510108 | CIF | C14 H16 N2 O3 | P -1 | 7.9027; 9.251; 9.692 70.636; 77.528; 79.727 | 648.3 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510109 | CIF | C23 H26 N2 O6 | P -1 | 9.612; 10.0841; 12.239 72.85; 84.64; 71.17 | 1072.9 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510110 | CIF | C15 H20 N2 O3 | C 1 c 1 | 6.6469; 12.9935; 16.782 90; 94.544; 90 | 1444.8 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510111 | CIF | C15 H22 N2 O4 | P 1 21/c 1 | 11.0254; 11.0167; 16.124 90; 127.876; 90 | 1545.9 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid‒Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510112 | CIF | C14 H18 N2 O3 | P 1 21/c 1 | 11.47; 10.6498; 13.027 90; 121.303; 90 | 1359.6 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
| 4510113 | CIF | C14 H15 N3 O4 | C 1 c 1 | 11.2644; 11.2611; 21.64 90; 91.271; 90 | 2744.3 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid–Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

