Crystallography Open Database
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| 4508654 | CIF | C60 H52 Co N6 O23 S8 | P b c a | 19.576; 21.306; 29.998 90; 90; 90 | 12512 | Liu, Yu; Guo, Dong-Sheng; Zhang, Heng-Yi; Kang, Shu; Song, Hai-Bin Diverse Conformation and Extended Structure ofp-Sulfonatothiacalix[4]arene Manipulated by Guest Molecules Crystal Growth & Design, 2006, 6, 1399 |
| 4508655 | CIF | C15 H13 Co N3 O6 | P 1 21/c 1 | 9.179; 8.7296; 19.4811 90; 91.315; 90 | 1560.6 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi One-Dimensional Chains, Two-Dimensional Corrugated Sheets Having a Cross-Linked Helix in Metal−Organic Frameworks: Exploring Hydrogen-Bond Capable Backbones and Ligating Topologies in Mixed Ligand Systems Crystal Growth & Design, 2006, 6, 1903 |
| 4508656 | CIF | C15 H13 N3 O6 Zn | P 1 21/c 1 | 9.1935; 8.8044; 19.555 90; 91.111; 90 | 1582.5 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi One-Dimensional Chains, Two-Dimensional Corrugated Sheets Having a Cross-Linked Helix in Metal−Organic Frameworks: Exploring Hydrogen-Bond Capable Backbones and Ligating Topologies in Mixed Ligand Systems Crystal Growth & Design, 2006, 6, 1903 |
| 4508657 | CIF | C15 H17 N3 O8 Zn | C 1 2/c 1 | 28.4154; 7.3477; 17.0939 90; 108.469; 90 | 3385.2 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi One-Dimensional Chains, Two-Dimensional Corrugated Sheets Having a Cross-Linked Helix in Metal−Organic Frameworks: Exploring Hydrogen-Bond Capable Backbones and Ligating Topologies in Mixed Ligand Systems Crystal Growth & Design, 2006, 6, 1903 |
| 4508658 | CIF | C15 H19 Co N3 O9 | P -1 | 7.8921; 10.213; 11.6733 104.831; 95.276; 90.161 | 905.4 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi One-Dimensional Chains, Two-Dimensional Corrugated Sheets Having a Cross-Linked Helix in Metal−Organic Frameworks: Exploring Hydrogen-Bond Capable Backbones and Ligating Topologies in Mixed Ligand Systems Crystal Growth & Design, 2006, 6, 1903 |
| 4508659 | CIF | C15 H11 N3 O5 Zn | P 1 21/n 1 | 7.2357; 19.1593; 10.7206 90; 104.729; 90 | 1437.37 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi One-Dimensional Chains, Two-Dimensional Corrugated Sheets Having a Cross-Linked Helix in Metal−Organic Frameworks: Exploring Hydrogen-Bond Capable Backbones and Ligating Topologies in Mixed Ligand Systems Crystal Growth & Design, 2006, 6, 1903 |
| 4508660 | CIF | C15 H15 Cd N3 O8 | C 1 2 1 | 24.139; 9.1383; 8.2704 90; 107.591; 90 | 1739.1 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi One-Dimensional Chains, Two-Dimensional Corrugated Sheets Having a Cross-Linked Helix in Metal−Organic Frameworks: Exploring Hydrogen-Bond Capable Backbones and Ligating Topologies in Mixed Ligand Systems Crystal Growth & Design, 2006, 6, 1903 |
| 4508661 | CIF | C7 H7 Cd N O6 | P 1 21/c 1 | 7.8756; 15.9779; 8.085 90; 114.554; 90 | 925.38 | Li, Ming; Xiang, Jiangfeng; Yuan, Liangjie; Wu, Simin; Chen, Shuoping; Sun, Jutang Syntheses, Structures, and Photoluminescence of Three Novel Coordination Polymers Constructed from Dimeric d10Metal Units Crystal Growth & Design, 2006, 6, 2036 |
| 4508662 | CIF | C7 H7 N O6 Zn | P 1 21/n 1 | 5.4085; 11.3846; 13.6955 90; 94.129; 90 | 841.09 | Li, Ming; Xiang, Jiangfeng; Yuan, Liangjie; Wu, Simin; Chen, Shuoping; Sun, Jutang Syntheses, Structures, and Photoluminescence of Three Novel Coordination Polymers Constructed from Dimeric d10Metal Units Crystal Growth & Design, 2006, 6, 2036 |
| 4508663 | CIF | C42 H10 La2 N6 O30 Zn3 | P -1 | 7.4469; 12.569; 17.759 96.125; 99.935; 100.517 | 1593.3 | Li, Ming; Xiang, Jiangfeng; Yuan, Liangjie; Wu, Simin; Chen, Shuoping; Sun, Jutang Syntheses, Structures, and Photoluminescence of Three Novel Coordination Polymers Constructed from Dimeric d10Metal Units Crystal Growth & Design, 2006, 6, 2036 |
| 4508664 | CIF | C21 H22 N4 O2 | P 1 21 1 | 6.3407; 25.017; 12.4354 90; 102.64; 90 | 1924.8 | Baures, Paul W.; Caldwell, Adam W.; Cashman, Chris R.; Masse, Marie T.; Van Arnam, Ethan B.; Conry, Rebecca R. The Influence by Substituents on the Intermolecular Hydrogen-Bonding Interactions in Imidazole-4,5-dicarboxylic Acid Derivatives Crystal Growth & Design, 2006, 6, 2047 |
| 4508665 | CIF | C20 H19 N3 O3 | P 21 21 21 | 9.8752; 11.6167; 16.2401 90; 90; 90 | 1863 | Baures, Paul W.; Caldwell, Adam W.; Cashman, Chris R.; Masse, Marie T.; Van Arnam, Ethan B.; Conry, Rebecca R. The Influence by Substituents on the Intermolecular Hydrogen-Bonding Interactions in Imidazole-4,5-dicarboxylic Acid Derivatives Crystal Growth & Design, 2006, 6, 2047 |
| 4508666 | CIF | C54 H66 N30 O19 | P -1 | 14.56; 15.007; 15.239 83.05; 81.65; 81.72 | 3243 | Wang, Zhi-Bin; Zhu, Hui-Fang; Zhao, Min; Li, Yi-Zhi; Okamura, Taka-aki; Sun, Wei-Yin; Chen, Hui-Lan; Ueyama, Norikazu Silver(I) Ion Assisted Assembly of One-Dimensional Polyrotaxanes Incorporating Cucurbit[6]uril Crystal Growth & Design, 2006, 6, 1420 |
| 4508667 | CIF | C108 H160 Ag2 N62 O58 | C 1 2/c 1 | 31.3049; 12.034; 22.227 90; 110.43; 90 | 7846.7 | Wang, Zhi-Bin; Zhu, Hui-Fang; Zhao, Min; Li, Yi-Zhi; Okamura, Taka-aki; Sun, Wei-Yin; Chen, Hui-Lan; Ueyama, Norikazu Silver(I) Ion Assisted Assembly of One-Dimensional Polyrotaxanes Incorporating Cucurbit[6]uril Crystal Growth & Design, 2006, 6, 1420 |
| 4508668 | CIF | C56 H80 Ag N31 O31 | P -1 | 13.716; 14.257; 18.69 81.43; 76.57; 83.52 | 3504 | Wang, Zhi-Bin; Zhu, Hui-Fang; Zhao, Min; Li, Yi-Zhi; Okamura, Taka-aki; Sun, Wei-Yin; Chen, Hui-Lan; Ueyama, Norikazu Silver(I) Ion Assisted Assembly of One-Dimensional Polyrotaxanes Incorporating Cucurbit[6]uril Crystal Growth & Design, 2006, 6, 1420 |
| 4508669 | CIF | C56 H73 Ag Cl3 N28 O30.5 | P -1 | 14.132; 16.266; 30.62 99.91; 91.37; 92.56 | 6923 | Wang, Zhi-Bin; Zhu, Hui-Fang; Zhao, Min; Li, Yi-Zhi; Okamura, Taka-aki; Sun, Wei-Yin; Chen, Hui-Lan; Ueyama, Norikazu Silver(I) Ion Assisted Assembly of One-Dimensional Polyrotaxanes Incorporating Cucurbit[6]uril Crystal Growth & Design, 2006, 6, 1420 |
| 4508670 | CIF | C6 H5 I | P b c n | 15.27; 11.071; 7.703 90; 90; 90 | 1302.2 | Merz, Klaus Substitution Effect on Crystal Packings of Iodobenzonitriles and Iodophenols Crystal Growth & Design, 2006, 6, 1615 |
| 4508671 | CIF | C7 H4 I N | P 1 21/n 1 | 7.683; 4.16; 21.603 90; 92.528; 90 | 689.8 | Merz, Klaus Substitution Effect on Crystal Packings of Iodobenzonitriles and Iodophenols Crystal Growth & Design, 2006, 6, 1615 |
| 4508672 | CIF | C6 H5 I O | P 21 21 21 | 4.629; 9.534; 14.913 90; 90; 90 | 658.2 | Merz, Klaus Substitution Effect on Crystal Packings of Iodobenzonitriles and Iodophenols Crystal Growth & Design, 2006, 6, 1615 |
| 4508673 | CIF | C6 H5 I O | I 41/a :2 | 15.76; 15.76; 10.39 90; 90; 90 | 2581 | Merz, Klaus Substitution Effect on Crystal Packings of Iodobenzonitriles and Iodophenols Crystal Growth & Design, 2006, 6, 1615 |
| 4508674 | CIF | C42 H79 Mo6 N3 O18 | P 1 21/c 1 | 12.84; 22.688; 19.722 90; 104.54; 90 | 5561 | Zhu, Yi; Xiao, Zicheng; Ge, Ning; Wang, Na; Wei, Yongge; Wang, Yuan Naphthyl Amines as Novel Organoimido Ligands for Design of POM-Based Organic−Inorganic Hybrids: Synthesis, Structural Characterization, and Supramolecular Assembly of (Bu4N)2[Mo6O18N(Naph-1)] Crystal Growth & Design, 2006, 6, 1620 |
| 4508675 | CIF | C13 H14 Cl2 N4 S Zn | P 1 21/c 1 | 7.6049; 15.2204; 13.8276 90; 90.828; 90 | 1600.4 | Zhang, Xuanjun; Zhou, Xiao-Ping; Li, Dan Anion-Directed Assembly of Macrocycle and Helix Crystal Growth & Design, 2006, 6, 1440 |
| 4508676 | CIF | C15 H14 N6 S3 Zn | P 1 21/c 1 | 14.5933; 5.7422; 23.212 90; 106.128; 90 | 1868.6 | Zhang, Xuanjun; Zhou, Xiao-Ping; Li, Dan Anion-Directed Assembly of Macrocycle and Helix Crystal Growth & Design, 2006, 6, 1440 |
| 4508677 | CIF | C28 H36 Cd Cl2 N8 O2 S2 | C 1 2/m 1 | 9.428; 22.396; 7.908 90; 105.951; 90 | 1605.5 | Zhang, Xuanjun; Zhou, Xiao-Ping; Li, Dan Anion-Directed Assembly of Macrocycle and Helix Crystal Growth & Design, 2006, 6, 1440 |
| 4508678 | CIF | C28 H28 Cd N10 S4 | C 1 2/c 1 | 23.4096; 11.0338; 15.3731 90; 126.411; 90 | 3195.6 | Zhang, Xuanjun; Zhou, Xiao-Ping; Li, Dan Anion-Directed Assembly of Macrocycle and Helix Crystal Growth & Design, 2006, 6, 1440 |
| 4508679 | CIF | C20 H12 F2 N O3 | P -1 | 9.207; 9.775; 10.656 106.63; 95.219; 113.286 | 821 | Chopra, Deepak; Guru Row, Tayur N. Solvatomorphism in 3-Fluorobenzoylaminophenyl 3-Fluorobenzoate: A Subtle Interplay of Strong Hydrogen Bonds and Weak Intermolecular Interactions Involving Disordered Fluorine Crystal Growth & Design, 2006, 6, 1267 |
| 4508680 | CIF | C23 H17 F2 N O3 | P -1 | 7.9036; 10.2216; 12.435 95.269; 95.215; 96.239 | 989.2 | Chopra, Deepak; Guru Row, Tayur N. Solvatomorphism in 3-Fluorobenzoylaminophenyl 3-Fluorobenzoate: A Subtle Interplay of Strong Hydrogen Bonds and Weak Intermolecular Interactions Involving Disordered Fluorine Crystal Growth & Design, 2006, 6, 1267 |
| 4508681 | CIF | C9 H16 N O2 | P 1 21/n 1 | 8.345; 6.4396; 18.615 90; 96.02; 90 | 994.8 | Yuge, Tetsuharu; Miyata, Mikiji; Tohnai, Norimitsu Novel Design of Tunable Organic Clay Mimic Structures Based on the Connection of One-Dimensional Supramolecular Synthons Crystal Growth & Design, 2006, 6, 1271 |
| 4508682 | CIF | C12 H18 N O2 | C 1 2/c 1 | 17.146; 6.448; 22.899 90; 89.73; 90 | 2531.6 | Yuge, Tetsuharu; Miyata, Mikiji; Tohnai, Norimitsu Novel Design of Tunable Organic Clay Mimic Structures Based on the Connection of One-Dimensional Supramolecular Synthons Crystal Growth & Design, 2006, 6, 1271 |
| 4508683 | CIF | C18 H32 N2 O4 | P 1 21/c 1 | 17.87; 6.2519; 18.688 90; 111.01; 90 | 1949 | Yuge, Tetsuharu; Miyata, Mikiji; Tohnai, Norimitsu Novel Design of Tunable Organic Clay Mimic Structures Based on the Connection of One-Dimensional Supramolecular Synthons Crystal Growth & Design, 2006, 6, 1271 |
| 4508684 | CIF | C37 H29 Cu2 F12 N7 O6 P2 | P 1 | 7.8264; 10.0763; 14.114 70.216; 75.354; 81.848 | 1011.4 | Wang, Pingshan; Moorefield, Charles N.; Panzner, Matthew; Newkome, George R. TerpyridineCuIIPolycarboxylate Crystal Reorganization to One- and Two-Dimensional Nanostructures: Crystal Disassembly and Reassembly Crystal Growth & Design, 2006, 6, 1563 |
| 4508685 | CIF | C31 H22 Cu2 N6 O13 | P 1 21/c 1 | 12.603; 10.602; 25.621 90; 95.971; 90 | 3404.8 | Wang, Pingshan; Moorefield, Charles N.; Panzner, Matthew; Newkome, George R. TerpyridineCuIIPolycarboxylate Crystal Reorganization to One- and Two-Dimensional Nanostructures: Crystal Disassembly and Reassembly Crystal Growth & Design, 2006, 6, 1563 |
| 4508686 | CIF | C10 H10 Cu N2 O5 | P 1 21/c 1 | 7.3361; 10.7496; 14.028 90; 90.778; 90 | 1106.1 | Eubank, Jarrod F.; Walsh, Rosa D.; Poddar, Pankaj; Srikanth, Hariharan; Larsen, Randy W.; Eddaoudi, Mohamed Metal−Organic Framework Diversity via Heterocoordination of a Multifunctional Ligand: SrAl2and a Novel (3,4)-Connected Network Crystal Growth & Design, 2006, 6, 1453 |
| 4508687 | CIF | C25 H25 N5 O10 Zn2 | P b c a | 14.04; 14.345; 27.756 90; 90; 90 | 5590 | Eubank, Jarrod F.; Walsh, Rosa D.; Poddar, Pankaj; Srikanth, Hariharan; Larsen, Randy W.; Eddaoudi, Mohamed Metal−Organic Framework Diversity via Heterocoordination of a Multifunctional Ligand: SrAl2and a Novel (3,4)-Connected Network Crystal Growth & Design, 2006, 6, 1453 |
| 4508688 | CIF | C8 H12 Cu2 Mo N12 | F d d 2 | 16.388; 23.059; 9.008 90; 90; 90 | 3404 | Hozumi, Toshiya; Nuida, Tomohiro; Hashimoto, Kazuhito; Ohkoshi, Shin-ichi Crystal Structure and Nonlinear Optical Effect of a Pyroelectric Crystal Composed of a Cyano-Bridged Cu−Mo Assembly Crystal Growth & Design, 2006, 6, 1736 |
| 4508689 | CIF | C23 H19 N3 O5 | P 21 21 21 | 4.535; 17.557; 24.498 90; 90; 90 | 1950.6 | Fridman, Natalya; Speiser, Shammai; Kaftory, Menahem Chromotropic Behavior of Lophine Nitro-Derivatives Crystal Growth & Design, 2006, 6, 2281 |
| 4508690 | CIF | C27 H27 N3 O7 | P -1 | 8.954; 9.943; 14.841 90.99; 97.6; 105.38 | 1260.9 | Fridman, Natalya; Speiser, Shammai; Kaftory, Menahem Chromotropic Behavior of Lophine Nitro-Derivatives Crystal Growth & Design, 2006, 6, 2281 |
| 4508691 | CIF | C30 H25 N3 O7 | C 1 c 1 | 20.256; 17.013; 7.942 90; 107.56; 90 | 2609.4 | Fridman, Natalya; Speiser, Shammai; Kaftory, Menahem Chromotropic Behavior of Lophine Nitro-Derivatives Crystal Growth & Design, 2006, 6, 2281 |
| 4508692 | CIF | C23 H19 N3 O5.18 | P 1 21/c 1 | 13.486; 12.28; 12.404 90; 92.69; 90 | 2051.9 | Fridman, Natalya; Speiser, Shammai; Kaftory, Menahem Chromotropic Behavior of Lophine Nitro-Derivatives Crystal Growth & Design, 2006, 6, 2281 |
| 4508693 | CIF | C23 H19 N3 O3 | P -1 | 6.63; 8.975; 16.408 88.73; 89.67; 79.51 | 959.8 | Fridman, Natalya; Speiser, Shammai; Kaftory, Menahem Chromotropic Behavior of Lophine Nitro-Derivatives Crystal Growth & Design, 2006, 6, 2281 |
| 4508694 | CIF | C25 H23 N3 O4 | P -1 | 8.095; 9.525; 14.306 93.67; 96.6; 96.91 | 1084.4 | Fridman, Natalya; Speiser, Shammai; Kaftory, Menahem Chromotropic Behavior of Lophine Nitro-Derivatives Crystal Growth & Design, 2006, 6, 2281 |
| 4508695 | CIF | C28 H18 N2 O4 Zn | P 1 21/n 1 | 11.682; 16.8; 12.929 90; 105.4; 90 | 2446.3 | Wang, Xin-Long; Qin, Chao; Wang, En-Bo; Xu, Lin Supramolecular Self-Assembly of Zigzag Coordination Polymer Chains: A Fascinating Three-Dimensional Polycatenated Network Featuring an Uneven “Density of Catenations” and a Three-Dimensional Porous Network Crystal Growth & Design, 2006, 6, 2061 |
| 4508696 | CIF | C28 H22 Cd N2 O6 | P 1 21/n 1 | 10.257; 18.988; 15.296 90; 105.51; 90 | 2870.6 | Wang, Xin-Long; Qin, Chao; Wang, En-Bo; Xu, Lin Supramolecular Self-Assembly of Zigzag Coordination Polymer Chains: A Fascinating Three-Dimensional Polycatenated Network Featuring an Uneven “Density of Catenations” and a Three-Dimensional Porous Network Crystal Growth & Design, 2006, 6, 2061 |
| 4508697 | CIF | C40 H38 N4 O2 | P 1 21/c 1 | 12.762; 12.001; 12.175 90; 117.98; 90 | 1646.7 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508698 | CIF | C38 H34 N6 O2 S | C 1 2/c 1 | 20.254; 11.561; 30.395 90; 99.89; 90 | 7011 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508699 | CIF | C39 H32 N4 O5 S | P -1 | 11.057; 12.024; 13.433 74.34; 83.28; 84.33 | 1703.6 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508700 | CIF | C40 H24 N6 O4 S | P 1 21/c 1 | 17.143; 19.147; 11.536 90; 96.79; 90 | 3760 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508701 | CIF | C36 H28 N4 S | C 1 2/c 1 | 23.728; 9.962; 12.387 90; 104.43; 90 | 2835.6 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508702 | CIF | C44 H42 N4 O8 | P -1 | 10.121; 14.163; 15.828 66.47; 82.71; 69.57 | 1949.1 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508703 | CIF | C42 H40 N6 O2 | P 1 21/c 1 | 6.216; 17.198; 16.983 90; 93.35; 90 | 1812.4 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508704 | CIF | C43 H40 N5 O10 | P -1 | 10.671; 12.175; 18.115 70.58; 87.17; 68.83 | 2063.1 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508705 | CIF | C44 H48 N4 O8 S | P 1 21/c 1 | 17.535; 25.094; 20.924 90; 113.45; 90 | 8447 | Fridman, N.; Speiser, S.; Kaftory, M. Structures and Chromogenic Properties of Bisimidazole Derivatives Crystal Growth & Design, 2006, 6, 1653 |
| 4508706 | CIF | C18 H12 B2 O4 | C 1 2/c 1 | 11.2128; 5.9293; 22.0413 90; 95.928; 90 | 1457.6 | Niu, Weijun; Smith, Mark D.; Lavigne, John J. Substituent Effects on the Structure and Supramolecular Assembly of Bis(dioxaborole)s Derived from 1,2,4,5-Tetrahydroxybenzene Crystal Growth & Design, 2006, 6, 1274 |
| 4508707 | CIF | C24 H24 B2 O6 | P -1 | 5.884; 6.1283; 15.614 83.34; 88.191; 68.8 | 521.35 | Niu, Weijun; Smith, Mark D.; Lavigne, John J. Substituent Effects on the Structure and Supramolecular Assembly of Bis(dioxaborole)s Derived from 1,2,4,5-Tetrahydroxybenzene Crystal Growth & Design, 2006, 6, 1274 |
| 4508708 | CIF | C24 H24 B2 O6 | P -1 | 6.3967; 6.9843; 12.2171 95.919; 104.683; 96.679 | 519.39 | Niu, Weijun; Smith, Mark D.; Lavigne, John J. Substituent Effects on the Structure and Supramolecular Assembly of Bis(dioxaborole)s Derived from 1,2,4,5-Tetrahydroxybenzene Crystal Growth & Design, 2006, 6, 1274 |
| 4508709 | CIF | C5 H5 Cl N2 | P 1 21/n 1 | 6.446; 8.022; 11.991 90; 104.51; 90 | 600.3 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508710 | CIF | C5 H4 Br N O | P n a 21 | 11.5563; 12.7285; 3.8875 90; 90; 90 | 571.83 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508711 | CIF | C5 H4 Cl N O | F d d 2 | 23.069; 25.231; 3.8429 90; 90; 90 | 2236.8 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508712 | CIF | C5 H4 I N O | P n a 21 | 11.5329; 12.8331; 4.2475 90; 90; 90 | 628.64 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508713 | CIF | C6 H7 N O | C 1 2/c 1 | 11.053; 9.6151; 11.316 90; 100.64; 90 | 1181.9 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508714 | CIF | C6 H4 Br N O2 | P 21 21 21 | 3.8571; 12.3235; 12.5884 90; 90; 90 | 598.36 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508715 | CIF | C5 H4 Cl N O2 | P n a 21 | 11.2712; 12.7754; 3.7794 90; 90; 90 | 544.21 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508716 | CIF | C5 H5 N O2 | P -1 | 6.3536; 6.5014; 6.9499 113.794; 99.65; 106.93 | 237.59 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508717 | CIF | C6 H7 N O2 | P 1 21/c 1 | 4.6258; 10.3353; 12.677 90; 99.27; 90 | 598.16 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508718 | CIF | C5 H5 Br N2 | P 1 21 1 | 7.9689; 13.1908; 11.6096 90; 104.686; 90 | 1180.49 | Saha, Binoy K.; Nangia, Ashwini; Nicoud, Jean-François Using Halogen···Halogen Interactions to Direct Noncentrosymmetric Crystal Packing in Dipolar Organic Molecules Crystal Growth & Design, 2006, 6, 1278 |
| 4508719 | CIF | C24 H26 | P 1 21/c 1 | 16.5263; 6.073; 9.0693 90; 100.973; 90 | 893.59 | Filatov, Alexander S.; Rogachev, Andrey Yu.; Petrukhina, Marina A. Gas-Phase Assembling of Dirhodium Units into a Novel Organometallic Ladder: Structural and DFT Study Crystal Growth & Design, 2006, 6, 1479 |
| 4508720 | CIF | C40 H26 F24 O16 Rh4 | P -1 | 8.3981; 8.6539; 17.9261 98.837; 97.208; 103.312 | 1235.1 | Filatov, Alexander S.; Rogachev, Andrey Yu.; Petrukhina, Marina A. Gas-Phase Assembling of Dirhodium Units into a Novel Organometallic Ladder: Structural and DFT Study Crystal Growth & Design, 2006, 6, 1479 |
| 4508721 | CIF | C7 H16 I N | P 1 21/n 1 | 7.338; 12.1335; 10.6396 90; 94.978; 90 | 943.73 | Henderson, Wesley A.; Young, Jr., Victor G.; Fylstra, Paul; De Long, Hugh C.; Trulove, Paul C. Crystal Packing, Steric Effects, and Heteroatoms: Comparison of N,N-Dimethylpyrrolidinium, Piperidinium, and Morpholinium Iodide Salts Crystal Growth & Design, 2006, 6, 1645-1648 |
| 4508722 | CIF | C31 H32 O11 S | P 1 21 1 | 14.115; 11.592; 17.743 90; 92.529; 90 | 2900.3 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508723 | CIF | C35.5 H35 O11 S | C 1 2 1 | 31.182; 11.2219; 22.715 90; 109.948; 90 | 7471.6 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508724 | CIF | C32.38 H34.75 Cl2.75 O11 S | C 1 2 1 | 30.561; 10.925; 22.255 90; 114.922; 90 | 6739 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508725 | CIF | C35.5 H40 O11.25 S | C 1 2 1 | 31.047; 11.2665; 22.631 90; 109.88; 90 | 7444 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508726 | CIF | C37.75 H39.25 N1.5 O11.38 S | C 1 2 1 | 30.623; 11.129; 22.529 90; 111.05; 90 | 7166 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508727 | CIF | C36.5 H43 O13.75 S | P 1 21 1 | 15.937; 11.054; 22.206 90; 108.432; 90 | 3711.3 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508728 | CIF | C35.25 H37.5 O12 S | C 1 2 1 | 30.675; 11.218; 22.323 90; 113.729; 90 | 7032 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508729 | CIF | C35.75 H35.75 N0.88 O11.38 S | C 1 2 1 | 30.896; 10.9667; 22.408 90; 111.469; 90 | 7065.6 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508730 | CIF | C36 H42 O13.25 S | P 1 21 1 | 15.966; 11.068; 22.264 90; 108.676; 90 | 3727.1 | Manoj, K.; Gonnade, Rajesh G.; Bhadbhade, Mohan M.; Shashidhar, Mysore S. Subtle Crossover from C−H···O to SO···CO Short Contacts in the Association of Diastereomers of 2,4(6)-Di-O-benzoyl-6(4)-O-[(1S)-10-camphorsulfonyl]-myo-inositol 1,3,5-Orthoformate upon Formation of Pseudopolymorphs Crystal Growth & Design, 2006, 6, 1485 |
| 4508731 | CIF | C33 H31.5 Au Cl Cu2 N6.5 O8 | P -1 | 10.6431; 13.1303; 27.821 82.913; 84.926; 71.503 | 3653.9 | Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius Rational Design of Supramolecular Gridlike Layers and Zigzag Chains through a Unique Interplay of d10−d10and π−π Stacking Interactions Crystal Growth & Design, 2006, 6, 1671 |
| 4508732 | CIF | C33 H31.5 Ag Cl Cu2 N6.5 O8 | P -1 | 10.5948; 13.1741; 27.89 82.883; 85.199; 71.672 | 3662.7 | Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius Rational Design of Supramolecular Gridlike Layers and Zigzag Chains through a Unique Interplay of d10−d10and π−π Stacking Interactions Crystal Growth & Design, 2006, 6, 1671 |
| 4508733 | CIF | C36 H30 Ag Cl Cu2 N6 O8 | P -1 | 11.2946; 13.2756; 28.455 82.17; 81.393; 69.467 | 3934.4 | Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius Rational Design of Supramolecular Gridlike Layers and Zigzag Chains through a Unique Interplay of d10−d10and π−π Stacking Interactions Crystal Growth & Design, 2006, 6, 1671 |
| 4508734 | CIF | C36 H30 Au Cl Cu2 N6 O8 | P -1 | 12.2575; 13.6244; 23.0234 90.406; 100.333; 94.192 | 3771.7 | Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius Rational Design of Supramolecular Gridlike Layers and Zigzag Chains through a Unique Interplay of d10−d10and π−π Stacking Interactions Crystal Growth & Design, 2006, 6, 1671 |
| 4508735 | CIF | C37 H31.5 Au Cl Cu2 N6.5 O8 | P -1 | 11.1506; 13.4704; 28.35 83.315; 82.568; 68.127 | 3907.7 | Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius Rational Design of Supramolecular Gridlike Layers and Zigzag Chains through a Unique Interplay of d10−d10and π−π Stacking Interactions Crystal Growth & Design, 2006, 6, 1671 |
| 4508736 | CIF | C19 H13 Ag Cu N4 O2 | C 1 2/c 1 | 20.2704; 10.254; 17.732 90; 94.988; 90 | 3671.7 | Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius Rational Design of Supramolecular Gridlike Layers and Zigzag Chains through a Unique Interplay of d10−d10and π−π Stacking Interactions Crystal Growth & Design, 2006, 6, 1671 |
| 4508737 | CIF | C62 H65 Cl8 N22 O5.5 Zn4 | P 1 21/n 1 | 20.0353; 9.0755; 21.8692 90; 96.769; 90 | 3948.8 | Mooibroek, Tiddo J.; Teat, Simon J.; Massera, Chiara; Gamez, Patrick; Reedijk, Jan Crystallographic and Theoretical Evidence of Acetonitrile−π Interactions with the Electron-Deficient 1,3,5-Triazine Ring Crystal Growth & Design, 2006, 6, 1569 |
| 4508738 | CIF | C65 H57 Cl12 N4 O8 P | P 1 21/c 1 | 11.025; 25.8624; 24.504 90; 99.042; 90 | 6900.07 | Sénéchal-David, Katell; Toupet, Loïc; Maury, Olivier; Le Bozec, Hubert Supramolecular Solid-State Interactions between Helicene-like Terpyridinium Cation and Tris(tetrachloro-benzenediolato)phosphate(V) (TRISPHAT) Anion Crystal Growth & Design, 2006, 6, 1493 |
| 4508739 | CIF | C14 H18 Ag2 F8 O8 S4 | P -1 | 6.7508; 8.3046; 10.8924 87.794; 83.849; 83.473 | 602.99 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508740 | CIF | C6 H16 Ag2 N2 O6 S4 | P b c a | 8.9793; 16.7321; 21.4072 90; 90; 90 | 3216.27 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508741 | CIF | C6 H16 Ag2 Cl2 O8 S4 | P c a 21 | 20.8995; 8.8901; 9.4567 90; 90; 90 | 1757.04 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508742 | CIF | C6 H16 Ag2 Cl2 O8 S4 | P 1 21/c 1 | 18.0705; 11.3354; 8.5295 90; 93.624; 90 | 1743.66 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508743 | CIF | C20 H30 Ag2 O6 S6 | P b c a | 10.992; 8.7129; 28.4137 90; 90; 90 | 2721.24 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508744 | CIF | C5 H8 Ag F3 O2 S2 | P c a 21 | 10.4756; 10.8952; 8.9067 90; 90; 90 | 1016.56 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508745 | CIF | C7 H8 Ag F7 O2 S2 | P c a 21 | 10.7139; 13.4083; 8.9523 90; 90; 90 | 1286.04 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508746 | CIF | C8 H16 Ag2 F6 O6 S6 | P 1 21/c 1 | 9.0925; 21.6699; 11.0192 90; 90.147; 90 | 2171.15 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508747 | CIF | C10 H13 Ag O2 S2 | P -1 | 6.8647; 7.6822; 12.3591 78.926; 87.441; 74.335 | 615.858 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508748 | CIF | C4 H11 Ag O3 S3 | P 1 21/n 1 | 9.6279; 7.4958; 13.572 90; 91.702; 90 | 979.04 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Influence of the Anion on the Structure of Bis(methylthio)methane Supramolecular Coordination Complexes Crystal Growth & Design, 2006, 6, 2674 |
| 4508749 | CIF | C10 H8 Br4 Cu N2 | P -1 | 6.0656; 7.3703; 8.6387 100.94; 95.16; 112.1 | 345.75 | Awwadi, Firas F.; Willett, Roger D.; Haddad, Salim F.; Twamley, Brendan The Electrostatic Nature of Aryl−Bromine−Halide Synthons: The Role of Aryl−Bromine−Halide Synthons in the Crystal Structures of thetrans-Bis(2-bromopyridine)dihalocopper(II) andtrans-Bis(3-bromopyridine)dihalocopper(II) Complexes Crystal Growth & Design, 2006, 6, 1833 |
| 4508750 | CIF | C10 H8 Br2 Cl2 Cu N2 | P 1 21/n 1 | 8.49; 6.3858; 12.712 90; 96.46; 90 | 684.8 | Awwadi, Firas F.; Willett, Roger D.; Haddad, Salim F.; Twamley, Brendan The Electrostatic Nature of Aryl−Bromine−Halide Synthons: The Role of Aryl−Bromine−Halide Synthons in the Crystal Structures of thetrans-Bis(2-bromopyridine)dihalocopper(II) andtrans-Bis(3-bromopyridine)dihalocopper(II) Complexes Crystal Growth & Design, 2006, 6, 1833 |
| 4508751 | CIF | C10 H8 Br4 Cu N2 | P 1 21/c 1 | 3.9355; 13.929; 12.236 90; 90.337; 90 | 670.7 | Awwadi, Firas F.; Willett, Roger D.; Haddad, Salim F.; Twamley, Brendan The Electrostatic Nature of Aryl−Bromine−Halide Synthons: The Role of Aryl−Bromine−Halide Synthons in the Crystal Structures of thetrans-Bis(2-bromopyridine)dihalocopper(II) andtrans-Bis(3-bromopyridine)dihalocopper(II) Complexes Crystal Growth & Design, 2006, 6, 1833 |
| 4508752 | CIF | C14 H12 N2 O4 Zn | C 1 2/c 1 | 9.575; 13.793; 10.567 90; 106.02; 90 | 1341.4 | García-Couceiro, Urko; Castillo, Oscar; Luque, Antonio; García-Terán, Juan P.; Beobide, Garikoitz; Román, Pascual Rational Design of 2D Magnetic Metal−Organic Coordination Polymers Assembled from Oxalato and Dipyridyl Spacers Crystal Growth & Design, 2006, 6, 1839 |
| 4508753 | CIF | C14 H12 Mn N2 O4 | C 1 2/c 1 | 9.485; 13.935; 10.987 90; 105.22; 90 | 1401.3 | García-Couceiro, Urko; Castillo, Oscar; Luque, Antonio; García-Terán, Juan P.; Beobide, Garikoitz; Román, Pascual Rational Design of 2D Magnetic Metal−Organic Coordination Polymers Assembled from Oxalato and Dipyridyl Spacers Crystal Growth & Design, 2006, 6, 1839 |
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