Crystallography Open Database

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4510289 CIFC16 H18 N4 Ni S2P -18.9684; 10.677; 10.956
67.46; 67.36; 83.94
893.21Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510292 CIFC30 H36 Mn N6 S2P -111.8301; 16.4075; 18.6847
72.304; 75.684; 77.015
3303.6Wöhlert, Susanne; Runčevski, Tomče; Dinnebier, Robert E.; Ebbinghaus, Stefan G.; Näther, Christian
Synthesis, Structures, Polymorphism, and Magnetic Properties of Transition Metal Thiocyanato Coordination Compounds
Crystal Growth & Design, 2014, 14, 1902
4510294 CIFC17 H33 Br N2P -111.009; 12.165; 23.177
94.727; 95.591; 110.903
2862.9Yang, Mei; Mallick, Bert; Mudring, Anja-Verena
A Systematic Study on the Mesomorphic Behavior of Asymmetrical 1-Alkyl-3-dodecylimidazolium Bromides
Crystal Growth & Design, 2014, 14, 1561
4510331 CIFC52 H32 N6 O8 Zn2P -112.4642; 12.5823; 15.269
104.357; 108.967; 90.771
2182.3Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510332 CIFC88 H56 Cd2 N12 O9P -111.605; 12.34; 14.606
99.002; 96.346; 116.734
1805.8Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510334 CIFC88 H56 N12 O10 Zn2P -111.5711; 12.1705; 14.5802
98.625; 94.455; 116.501
1792.3Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510335 CIFC136 H86 N12 O39 Zn9P -114.198; 14.443; 18.56
67.524; 71.377; 65.82
3147.9Xu, Bing; Xie, Juan; Hu, Huai-Ming; Yang, Xiao-Le; Dong, Fa-Xin; Yang, Meng-Lin; Xue, Gang-Lin
Synthesis, Crystal Structure, and Luminescence of Zn/Cd Coordination Polymers with a New Fuctionalized Terpyridyl Carboxylate Ligand
Crystal Growth & Design, 2014, 14, 1629
4510351 CIFC84 H84 Cd3 N18 O20P -110.3343; 13.2335; 17.7162
106.678; 92.95; 107.797
2184Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510352 CIFC94 H106 Cd3 N10 O28P -19.9516; 15.7818; 16.5509
110.421; 101.582; 90.029
2379.37Cao, Li-Hui; Wei, Yong-Li; Yang, Yang; Xu, Hong; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C. W.
Crystal Structures and Properties of Cd(II) Coordination Polymers Supported by a New Chiral Aromatic Polycarboxylate Ligand
Crystal Growth & Design, 2014, 14, 1827
4510360 CIFC20 H23 F6 Fe N2 O3 S2P -18.1848; 10.8195; 14.7741
76.019; 86.053; 70.005
1192.9Fornalczyk, Gregor; Valldor, Martin; Mathur, Sanjay
Monomeric Iron Heteroarylalkenolates: Structural Design Concepts and Investigations on Their Application in Chemical Vapor Deposition
Crystal Growth & Design, 2014, 14, 1811
4510367 CIFC8 H7 Cl O3P -18.571; 9.2373; 10.3612
91.818; 90.226; 93.118
818.69Coles, Simon J.; Threlfall, Terence L.; Tizzard, Graham J.
The Same but Different: Isostructural Polymorphs and the Case of 3-Chloromandelic Acid
Crystal Growth & Design, 2014, 14, 1623
4510372 CIFC22 H25 N3 O3P -19.397; 10.8925; 11.0095
65.728; 67.321; 77.584
945.71Braun, Doris E.; McMahon, Jennifer A.; Koztecki, Lien H.; Price, Sarah L.; Reutzel-Edens, Susan M.
Contrasting Polymorphism of Related Small Molecule Drugs Correlated and Guided by the Computed Crystal Energy Landscape
Crystal Growth & Design, 2014, 14, 2056
4510373 CIFC22 H25 N3 O3P -19.2754; 10.0504; 11.858
106.01; 108.236; 99.895
967.99Braun, Doris E.; McMahon, Jennifer A.; Koztecki, Lien H.; Price, Sarah L.; Reutzel-Edens, Susan M.
Contrasting Polymorphism of Related Small Molecule Drugs Correlated and Guided by the Computed Crystal Energy Landscape
Crystal Growth & Design, 2014, 14, 2056
4510385 CIFC13 H21 Na O4P -15.7035; 5.9553; 23.535
82.94; 84.447; 63.14
706.97Rossi, Patrizia; Macedi, Eleonora; Paoli, Paola; Bernazzani, Luca; Carignani, Elisa; Borsacchi, Silvia; Geppi, Marco
Solid‒Solid Transition between Hydrated Racemic Compound and Anhydrous Conglomerate in Na-Ibuprofen: A Combined X-ray Diffraction, Solid-State NMR, Calorimetric, and Computational Study
Crystal Growth & Design, 2014, 14, 2441
4510386 CIFC13 H21 Na O4P -15.7227; 5.9955; 23.661
83; 89.351; 63.032
717.26Rossi, Patrizia; Macedi, Eleonora; Paoli, Paola; Bernazzani, Luca; Carignani, Elisa; Borsacchi, Silvia; Geppi, Marco
Solid‒Solid Transition between Hydrated Racemic Compound and Anhydrous Conglomerate in Na-Ibuprofen: A Combined X-ray Diffraction, Solid-State NMR, Calorimetric, and Computational Study
Crystal Growth & Design, 2014, 14, 2441
4510387 CIFC13 H21 Na O4P -15.7272; 6.0052; 23.723
83.333; 89.081; 63.06
721.83Rossi, Patrizia; Macedi, Eleonora; Paoli, Paola; Bernazzani, Luca; Carignani, Elisa; Borsacchi, Silvia; Geppi, Marco
Solid‒Solid Transition between Hydrated Racemic Compound and Anhydrous Conglomerate in Na-Ibuprofen: A Combined X-ray Diffraction, Solid-State NMR, Calorimetric, and Computational Study
Crystal Growth & Design, 2014, 14, 2441
4510388 CIFC13 H21 Na O4P -15.7808; 6.0812; 23.998
95.309; 90.212; 117.137
746.54Rossi, Patrizia; Macedi, Eleonora; Paoli, Paola; Bernazzani, Luca; Carignani, Elisa; Borsacchi, Silvia; Geppi, Marco
Solid‒Solid Transition between Hydrated Racemic Compound and Anhydrous Conglomerate in Na-Ibuprofen: A Combined X-ray Diffraction, Solid-State NMR, Calorimetric, and Computational Study
Crystal Growth & Design, 2014, 14, 2441
4510392 CIFC23 H14 F6 N2P -110.0242; 16.1126; 25.623
106.177; 95.81; 100.358
3859.4Karasawa, Satoru; Hagihara, Ryusuke; Abe, Yuichiro; Harada, Naomi; Todo, Jun-ichi; Koga, Noboru
Crystal Structures, Thermal Properties, and Emission Behaviors ofN,N-R-Phenyl-7-amino-2,4-trifluoromethylquinoline Derivatives: Supercooled Liquid-to-Crystal Transformation Induced by Mechanical Stimuli
Crystal Growth & Design, 2014, 14, 2468
4510393 CIFC18 H12 F6 N2P -19.616; 9.852; 18.004
103.332; 98.571; 105.946
1554.2Karasawa, Satoru; Hagihara, Ryusuke; Abe, Yuichiro; Harada, Naomi; Todo, Jun-ichi; Koga, Noboru
Crystal Structures, Thermal Properties, and Emission Behaviors ofN,N-R-Phenyl-7-amino-2,4-trifluoromethylquinoline Derivatives: Supercooled Liquid-to-Crystal Transformation Induced by Mechanical Stimuli
Crystal Growth & Design, 2014, 14, 2468
4510398 CIFC19 H14 F6 N2P -18.858; 9.351; 11.404
81.884; 89.636; 65.688
850.8Karasawa, Satoru; Hagihara, Ryusuke; Abe, Yuichiro; Harada, Naomi; Todo, Jun-ichi; Koga, Noboru
Crystal Structures, Thermal Properties, and Emission Behaviors ofN,N-R-Phenyl-7-amino-2,4-trifluoromethylquinoline Derivatives: Supercooled Liquid-to-Crystal Transformation Induced by Mechanical Stimuli
Crystal Growth & Design, 2014, 14, 2468
4510401 CIFC25 H B Cl16 N6P -18.5924; 14.3712; 14.8152
113.893; 97.251; 93.484
1646.6Morse, Graham E.; Gong, Ivan; Kawar, Yazan; Lough, Alan J.; Bender, Timothy P.
Crystal and Solid-State Arrangement Trends of Halogenated Boron Subphthalocyanines
Crystal Growth & Design, 2014, 14, 2138
4510403 CIFC34.5 H12 B Br Cl12 N6P -18.6097; 14.8531; 15.6559
79.815; 74.727; 88.451
1900.5Morse, Graham E.; Gong, Ivan; Kawar, Yazan; Lough, Alan J.; Bender, Timothy P.
Crystal and Solid-State Arrangement Trends of Halogenated Boron Subphthalocyanines
Crystal Growth & Design, 2014, 14, 2138
4510405 CIFC24 B Cl13 N6P -18.6142; 12.4441; 13.806
89.047; 85.918; 88.701
1475.65Morse, Graham E.; Gong, Ivan; Kawar, Yazan; Lough, Alan J.; Bender, Timothy P.
Crystal and Solid-State Arrangement Trends of Halogenated Boron Subphthalocyanines
Crystal Growth & Design, 2014, 14, 2138
4510452 CIFC50 H50 N2 O8 S2P -112.5452; 13.1706; 13.9635
83.394; 83.929; 73.324
2189Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510453 CIFC30 H39 N O6 SP -18.9573; 9.1651; 20.0432
86.677; 86.805; 63.623
1470.8Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510454 CIFC30 H37 N O5 SP -19.2905; 12.7229; 13.1196
97.514; 108.613; 97.648
1431.59Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510455 CIFC32 H41 N O5 SP -110.4196; 12.7334; 13.6397
98.219; 107.747; 109.026
1569.3Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510456 CIFC29 H33 N O4 SP -19.4949; 10.9884; 13.8529
92.306; 95.015; 110.213
1347.28Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510457 CIFC60 H70 N2 O14 S2P -110.8859; 14.7685; 19.5931
69.419; 87.083; 77.81
2881.5Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510458 CIFC30 H35 N3 O5 SP -17.9064; 13.5759; 14.349
91.88; 102.104; 104.57
1451.5Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510461 CIFC24 H25 N O5 SP -18.8813; 10.3007; 13.0949
108.557; 94.862; 97.117
1117.07Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510462 CIFC86 H76 N4 O6 S2P -111.5015; 16.4403; 19.6538
96.2; 91.847; 109.329
3477.1Li, Ya-Nan; Huo, Li-Hua; Deng, Zhao-Peng; Zou, Xin; Zhu, Zhi-Biao; Zhao, Hui; Gao, Shan
Solvent Effect on the Supramolecular Patterns and Luminescent Properties of Organic Salts Comprising Naphthalene-1,5-disulfonic Acid and Triphenylmethylamine
Crystal Growth & Design, 2014, 14, 2381
4510473 CIFC54 H52 N8 Ni O8 S4P -112.2467; 12.6654; 20.006
100.451; 98.868; 114.245
2690.5Madhu, Vedichi; Das, Samar K.
Diverse Supramolecular Architectures Having Well-Defined Void Spaces Formed from a Pseudorotaxane Cation: Influential Role of Metal Dithiolate Coordination Complex Anions
Crystal Growth & Design, 2014, 14, 2343
4510474 CIFC54 H52 N8 O8 Pd S4P -112.2674; 12.6097; 20.1508
100.108; 99.267; 114.157
2704.3Madhu, Vedichi; Das, Samar K.
Diverse Supramolecular Architectures Having Well-Defined Void Spaces Formed from a Pseudorotaxane Cation: Influential Role of Metal Dithiolate Coordination Complex Anions
Crystal Growth & Design, 2014, 14, 2343
4510476 CIFC52 H52 N4 O8 S10 ZnP -112.2553; 13.983; 19.4427
96.987; 91.863; 114.797
2989.2Madhu, Vedichi; Das, Samar K.
Diverse Supramolecular Architectures Having Well-Defined Void Spaces Formed from a Pseudorotaxane Cation: Influential Role of Metal Dithiolate Coordination Complex Anions
Crystal Growth & Design, 2014, 14, 2343
4510484 CIFC24 H34 F N3 O3 SP -112.6945; 13.7444; 14.4954
98.502; 98.841; 105.949
2354.3Maddileti, D.; Swapna, Battini; Nangia, Ashwini
High Solubility Crystalline Pharmaceutical Forms of Blonanserin
Crystal Growth & Design, 2014, 14, 2557
4510490 CIFC35 H40 Cu2 N7 O16 TbP -110.473; 14.66; 15.205
104.618; 98.828; 99.501
2180.9Ghosh, Soumavo; Ida, Yumi; Ishida, Takayuki; Ghosh, Ashutosh
Linker Stoichiometry-Controlled Stepwise Supramolecular Growth of a Flexible Cu2Tb Single Molecule Magnet from Monomer to Dimer to One-Dimensional Chain
Crystal Growth & Design, 2014, 14, 2588
4510491 CIFC80 H92 Cu4 N16 O34 Tb2P -110.601; 14.724; 16.269
77.979; 85.861; 82.682
2460.8Ghosh, Soumavo; Ida, Yumi; Ishida, Takayuki; Ghosh, Ashutosh
Linker Stoichiometry-Controlled Stepwise Supramolecular Growth of a Flexible Cu2Tb Single Molecule Magnet from Monomer to Dimer to One-Dimensional Chain
Crystal Growth & Design, 2014, 14, 2588
4510493 CIFC40 H54 Cl4 Cu2 N14 O8P -17.845; 12.8786; 13.0629
64.44; 88.745; 81.227
1175.3Bhattacharya, Sudeshna; Sengupta, Satirtha; Bala, Sukhen; Goswami, Arijit; Ganguly, Sumi; Mondal, Raju
Pyrazole-Based Metallogels Showing an Unprecedented Colorimetric Ammonia Gas Sensing through Gel-to-Gel Transformation with a Rare Event of Time-Dependent Morphology Transformation
Crystal Growth & Design, 2014, 14, 2366
4510494 CIFC8 H14 Na2 O12P -16.1351; 6.3115; 9.1906
95.537; 96.302; 116.231
313.07Chanthapally, Anjana; Quah, Hong Sheng; Vittal, Jagadese J.
Solid-State Reactivity of Supramolecular Isomers: A Study of thes-Block Coordination Polymers
Crystal Growth & Design, 2014, 14, 2605
4510495 CIFC8 H14 Na2 O12P -16.1285; 7.7676; 8.0964
115.7; 101.316; 103.008
318.87Chanthapally, Anjana; Quah, Hong Sheng; Vittal, Jagadese J.
Solid-State Reactivity of Supramolecular Isomers: A Study of thes-Block Coordination Polymers
Crystal Growth & Design, 2014, 14, 2605
4510497 CIFC8 H16 Ba2 O14P -16.419; 7.9361; 8.911
103.757; 104.137; 106.945
397.04Chanthapally, Anjana; Quah, Hong Sheng; Vittal, Jagadese J.
Solid-State Reactivity of Supramolecular Isomers: A Study of thes-Block Coordination Polymers
Crystal Growth & Design, 2014, 14, 2605
4510505 CIFC202 H302 Cu2 N4 O133 U16P -116.5835; 20.1557; 21.1177
88.6196; 87.0438; 79.7935
6936.9Thuéry, Pierre
Increasing Complexity in the Uranyl Ion‒Kemp’s Triacid System: From One- and Two-Dimensional Polymers to Uranyl‒Copper(II) Dodeca- and Hexadecanuclear Species
Crystal Growth & Design, 2014, 14, 2665
4510507 CIFC120 H166 Cu6 O89 U10P -117.7344; 19.4751; 27.1156
83.831; 87.186; 82.214
9219.4Thuéry, Pierre
Increasing Complexity in the Uranyl Ion‒Kemp’s Triacid System: From One- and Two-Dimensional Polymers to Uranyl‒Copper(II) Dodeca- and Hexadecanuclear Species
Crystal Growth & Design, 2014, 14, 2665
4510508 CIFC22 H24 N6 O4 S5P -111.1939; 11.8157; 12.0646
110.959; 106.648; 104.205
1315.3Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510509 CIFC11 H14 Cl N3 O5 S2P -17.5147; 9.0185; 12.1146
90.801; 98.642; 109.424
763.7Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510512 CIFC11 H11 N3 S2P -18.941; 10.074; 13.822
92.594; 95.21; 105.985
1188.7Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510514 CIFC11 H13 N4 O3.5 S2P -110.551; 10.6973; 13.648
108.804; 96.519; 91.481
1445.6Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510515 CIFC11 H15 N3 O5 S3P -17.0435; 9.4168; 12.3566
85.815; 88.897; 71.023
772.96Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510516 CIFC11 H11 N3 S2P -15.7601; 8.871; 12.097
103.779; 96.286; 95.705
591.67Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510519 CIFC11 H12 Cl N3 S2P -19.64; 15.4273; 19.176
73.592; 86.432; 89.798
2730.1Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510520 CIFC11 H12 Cl N3 S2P -18.6544; 9.2851; 10.0278
65.682; 75.992; 64.045
658.36Phukan, Nithi; Baruah, Jubaraj B.
Polymorphs of 1-(5-Methylthiazol-2-yl)-3-phenylthiourea and Various Anion-Assisted Assemblies of Two Positional Isomers
Crystal Growth & Design, 2014, 14, 2640
4510530 CIFC34 H18 F10 O2P -17.4146; 11.1034; 17.304
86.917; 79.945; 74.085
1348.9Schwarzer, Anke; Weber, Edwin
Penta- and Decafluorinated Dibenzalacetones: Synthesis, Crystal Structure, and Cocrystallization Experiments
Crystal Growth & Design, 2014, 14, 2335
4510531 CIFC46 H50 F2 N6 O5P -16.084; 10.2978; 16.1737
100.93; 92.6382; 95.9415
987.35Be̅rziņš, Agris; Skarbulis, Edgards; Rekis, Toms; Actiņš, Andris
On the Formation of Droperidol Solvates: Characterization of Structure and Properties
Crystal Growth & Design, 2014, 14, 2654
4510533 CIFC22.5 H24 F N3 O2.5P -16.0504; 10.2207; 16.11
101.397; 93.445; 97.022
965.62Be̅rziņš, Agris; Skarbulis, Edgards; Rekis, Toms; Actiņš, Andris
On the Formation of Droperidol Solvates: Characterization of Structure and Properties
Crystal Growth & Design, 2014, 14, 2654
4510534 CIFC22 H24 F N3 O3P -16.3199; 10.1525; 15.7463
102.691; 91.775; 100.403
966.81Be̅rziņš, Agris; Skarbulis, Edgards; Rekis, Toms; Actiņš, Andris
On the Formation of Droperidol Solvates: Characterization of Structure and Properties
Crystal Growth & Design, 2014, 14, 2654
4510535 CIFC22 H23 F N3 O2.5P -16.2743; 10.156; 15.7786
102.253; 92.501; 99.46
965.95Be̅rziņš, Agris; Skarbulis, Edgards; Rekis, Toms; Actiņš, Andris
On the Formation of Droperidol Solvates: Characterization of Structure and Properties
Crystal Growth & Design, 2014, 14, 2654
4510537 CIFC22 H22 F N3 O2P -16.278; 10.0865; 16.3969
103.098; 92.855; 99.419
993.57Be̅rziņš, Agris; Skarbulis, Edgards; Rekis, Toms; Actiņš, Andris
On the Formation of Droperidol Solvates: Characterization of Structure and Properties
Crystal Growth & Design, 2014, 14, 2654
4510539 CIFC7 H9 N3 O2P -16.4717; 7.9214; 8.6745
72.412; 86.116; 69.625
397.04Mazur, Liliana; Jarzembska, Katarzyna N.; Kamiński, Radosław; Woźniak, Krzysztof; Pindelska, Edyta; Zielińska-Pisklak, Monika
Substituent and Solvent Effects on Intermolecular Interactions in Crystals ofN-Acylhydrazone Derivatives: Single-Crystal X-ray, Solid-State NMR, and Computational Studies
Crystal Growth & Design, 2014, 14, 2263
4510547 CIFC52 H60 Cl8 Hg2 N4 S10P -113.637; 14.171; 17.781
91.749; 93.012; 111.296
3192.6Guzmán-Percástegui, Edmundo; Zakharov, Lev N.; Alvarado-Rodríguez, José G.; Carnes, Matthew E.; Johnson, Darren W.
Synthesis of a Self-Assembled Hg(II)-Dithiocarbamate Metallomacrocycle
Crystal Growth & Design, 2014, 14, 2087
4510555 CIFC64 H57 Cd3 N4 O16.5P -113.968; 14.611; 20.566
75.25; 85.51; 69
3788.9Liu, Lu; Ding, Jie; Huang, Chao; Li, Ming; Hou, Hongwei; Fan, Yaoting
Polynuclear CdIIPolymers: Crystal Structures, Topologies, and the Photodegradation for Organic Dye Contaminants
Crystal Growth & Design, 2014, 14, 3035
4510556 CIFC74 H61 Cd3 N6 O17.5 S2P -112.072; 14.124; 14.338
104.16; 104.51; 114.4
1980.2Liu, Lu; Ding, Jie; Huang, Chao; Li, Ming; Hou, Hongwei; Fan, Yaoting
Polynuclear CdIIPolymers: Crystal Structures, Topologies, and the Photodegradation for Organic Dye Contaminants
Crystal Growth & Design, 2014, 14, 3035
4510557 CIFC104 H78 Cd6 N4 O33P -19.3011; 13.991; 19.562
95.54; 99.9; 103.17
2417.2Liu, Lu; Ding, Jie; Huang, Chao; Li, Ming; Hou, Hongwei; Fan, Yaoting
Polynuclear CdIIPolymers: Crystal Structures, Topologies, and the Photodegradation for Organic Dye Contaminants
Crystal Growth & Design, 2014, 14, 3035
4510558 CIFC24 H44 N4 O20 P4P -112.8225; 13.3153; 13.7615
65.496; 64.074; 61.25
1789.3Hoque, Md. Najbul; Das, Gopal
Cationic Tripodal Receptor Assisted Formation of Anion and Anion‒Water Clusters: Structural Interpretation of Dihydrogen Phosphate Cluster and Sulfate‒Water Tetramer [(SO4)2‒(H2O)2]4‒
Crystal Growth & Design, 2014, 14, 2962
4510560 CIFC24 H36 N4 O12 S2P -110.5903; 12.1999; 12.693
92.034; 107.203; 110.886
1445.28Hoque, Md. Najbul; Das, Gopal
Cationic Tripodal Receptor Assisted Formation of Anion and Anion‒Water Clusters: Structural Interpretation of Dihydrogen Phosphate Cluster and Sulfate‒Water Tetramer [(SO4)2‒(H2O)2]4‒
Crystal Growth & Design, 2014, 14, 2962
4510561 CIFC24 H36 N4 O15 S3P -112.365; 12.677; 12.679
72.785; 62.375; 65.503
1589.1Hoque, Md. Najbul; Das, Gopal
Cationic Tripodal Receptor Assisted Formation of Anion and Anion‒Water Clusters: Structural Interpretation of Dihydrogen Phosphate Cluster and Sulfate‒Water Tetramer [(SO4)2‒(H2O)2]4‒
Crystal Growth & Design, 2014, 14, 2962
4510562 CIFC24 H36 N8 O16P -111.7044; 12.3409; 12.4485
65.908; 85.936; 84.8
1633.58Hoque, Md. Najbul; Das, Gopal
Cationic Tripodal Receptor Assisted Formation of Anion and Anion‒Water Clusters: Structural Interpretation of Dihydrogen Phosphate Cluster and Sulfate‒Water Tetramer [(SO4)2‒(H2O)2]4‒
Crystal Growth & Design, 2014, 14, 2962
4510571 CIFC7 H6 N2 O2 SP -13.9782; 12.3361; 16.5248
86.113; 87.119; 82.639
801.72Eccles, Kevin S.; Morrison, Robin E.; Maguire, Anita R.; Lawrence, Simon E.
Crystal Landscape of Primary Aromatic Thioamides
Crystal Growth & Design, 2014, 14, 2753
4510575 CIFC7 H6 F N SP -14.0185; 10.95; 16.068
94.801; 94.631; 90.063
702.2Eccles, Kevin S.; Morrison, Robin E.; Maguire, Anita R.; Lawrence, Simon E.
Crystal Landscape of Primary Aromatic Thioamides
Crystal Growth & Design, 2014, 14, 2753
4510577 CIFC7 H6 Cl N SP -14.042; 5.6966; 16.617
91.143; 95.903; 92.81
380.01Eccles, Kevin S.; Morrison, Robin E.; Maguire, Anita R.; Lawrence, Simon E.
Crystal Landscape of Primary Aromatic Thioamides
Crystal Growth & Design, 2014, 14, 2753
4510579 CIFC8 H7 N O10 UP -17.8201; 8.1694; 10.2669
106.698; 103.2; 90.842
609.38Cantos, Paula M.; Cahill, Christopher L.
A Family of UO22±-5-Nitro-1,3-dicarboxylate Hybrid Materials: Structural Variation As a Function of pH and Structure Directing Species
Crystal Growth & Design, 2014, 14, 3044
4510580 CIFC44 H42 N6 O32 U3P -19.5699; 11.0566; 14.7236
94.826; 95.469; 112.878
1416.3Cantos, Paula M.; Cahill, Christopher L.
A Family of UO22±-5-Nitro-1,3-dicarboxylate Hybrid Materials: Structural Variation As a Function of pH and Structure Directing Species
Crystal Growth & Design, 2014, 14, 3044
4510581 CIFC22 H24 N3 O18 U2P -110.6646; 11.0897; 14.724
106.806; 95.727; 113.001
1489.1Cantos, Paula M.; Cahill, Christopher L.
A Family of UO22±-5-Nitro-1,3-dicarboxylate Hybrid Materials: Structural Variation As a Function of pH and Structure Directing Species
Crystal Growth & Design, 2014, 14, 3044
4510583 CIFC135 H181 Cl9 Co9 N36 O9 P3P -118.446; 21.371; 25.362
69.974; 83.293; 64.7
8487Sahoo, Dipankar; Suriyanarayanan, Ramakirushnan; Chandrasekhar, Vadapalli
A 30-Membered Nonanuclear Cobalt(II) Macrocycle Containing Phosphonate-Bridged Trinuclear Subunits
Crystal Growth & Design, 2014, 14, 2725
4510590 CIFC36 H26 Ag6 Co N28 O42 W12P -111.83; 12.709; 14.789
105.033; 99.809; 115.518
1833.6Li, Meng-Ting; Sha, Jing-Quan; Zong, Xi-Ming; Sun, Jing-Wen; Yan, Peng-Fei; Li, Liang; Yang, Xiao-Ning
Assembly of Polyoxometalate-Based Hybrids with Different Helical Channels upon Subtle Ligand Variation
Crystal Growth & Design, 2014, 14, 2794
4510591 CIFC36 H20 Ag7 Ge N28 O47 W12P -112.387; 13.14; 14.969
104.87; 99.856; 116.097
1998.3Li, Meng-Ting; Sha, Jing-Quan; Zong, Xi-Ming; Sun, Jing-Wen; Yan, Peng-Fei; Li, Liang; Yang, Xiao-Ning
Assembly of Polyoxometalate-Based Hybrids with Different Helical Channels upon Subtle Ligand Variation
Crystal Growth & Design, 2014, 14, 2794
4510593 CIFC13 H13 Cl N4 O4 S2P -17.5577; 10.3747; 12.0879
68.516; 75.433; 70.585
822.65Suresh, Kuthuru; Nangia, Ashwini
Lornoxicam Salts: Crystal Structures, Conformations, and Solubility
Crystal Growth & Design, 2014, 14, 2945
4510815 CIFC27 H27 N3 O12P -19.3808; 9.452; 15.2326
96.684; 97.284; 105.658
1273.88Song, Jia-Xi; Yan, Yan; Yao, Jia; Chen, Jia-Mei; Lu, Tong-Bu
Improving the Solubility of Lenalidomide via Cocrystals
Crystal Growth & Design, 2014, 14, 3069
4510817 CIFC20 H19 N3 O7P -18.643; 8.9364; 13.4003
86.348; 79.738; 65.391
925.88Song, Jia-Xi; Yan, Yan; Yao, Jia; Chen, Jia-Mei; Lu, Tong-Bu
Improving the Solubility of Lenalidomide via Cocrystals
Crystal Growth & Design, 2014, 14, 3069
4510826 CIFC80 H72 Ag12 F24 N8 O26.5P -113.654; 14.19; 15.105
77.671; 76.944; 70.973
2663.9Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510827 CIFC55 H49 Ag9 F18 N4 O17P -110.9216; 13.425; 26.111
76.311; 88.568; 72.997
3553.1Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510828 CIFC58 H55 Ag9 F18 N4 O17P -110.9575; 13.3587; 27.408
76.029; 89.12; 72.503
3706Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510829 CIFC56 H41 Ag8 F18 N8 O15P -19.9298; 13.4301; 14.8808
65.92; 84.082; 76.82
1763.9Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510830 CIFC29 H23 Ag4 F9 N4 O7P -19.9222; 13.5535; 14.6566
67.604; 84.94; 75.939
1767.7Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510831 CIFC25 H23 Ag4 F9 N4 O7P -110.143; 13.139; 14.3959
63.58; 88.212; 72.382
1625.5Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510832 CIFC32 H27 Ag4 F9 N4 O6P -19.6275; 14.4359; 14.9142
67.025; 74.899; 85.478
1841.9Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510833 CIFC32 H30 Ag6 F12 N4 O11P -112.7745; 14.18; 14.5221
70.86; 88.158; 73.63
2379.1Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510834 CIFC30 H32 Ag6 F12 N4 O8P -112.7287; 12.9642; 14.91
107.235; 103.377; 108.095
2087.2Yang, Jin; Hu, Ting; Mak, Thomas C. W.
Flexible Bis(imidazole) Mediated Assembly of Silver(I)‒Organic Frameworks with Ethynide and Trifluoroacetate Ligands
Crystal Growth & Design, 2014, 14, 2990
4510863 CIFC108 H142 N4 Ni8 O28 P2 S8P -112.519; 13.07; 21.475
73.351; 89.769; 70.849
3164Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Gai, Yanli; Wu, Mingyan; Bawaked, Salem M.; Mokhtar, Mohamed; AL-Thabaiti, Shaeel A.; Hong, Maochun
Generalized Synthesis of Calixarene-Based High-Nuclearity M4nNanocages (M = Ni or Co;n= 2‒6)
Crystal Growth & Design, 2014, 14, 3116
4510864 CIFC114 H116 Cl0 N6 Ni8 O28 P2 S8P -112.304; 12.449; 21.118
84.197; 78.94; 75.862
3073Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Gai, Yanli; Wu, Mingyan; Bawaked, Salem M.; Mokhtar, Mohamed; AL-Thabaiti, Shaeel A.; Hong, Maochun
Generalized Synthesis of Calixarene-Based High-Nuclearity M4nNanocages (M = Ni or Co;n= 2‒6)
Crystal Growth & Design, 2014, 14, 3116
4510869 CIFC414 H514 Cl0 Co40 N2 O124 P16 S40P -126.2994; 33.3014; 37.9859
79.778; 85.964; 66.865
30107.3Su, Kongzhao; Jiang, Feilong; Qian, Jinjie; Gai, Yanli; Wu, Mingyan; Bawaked, Salem M.; Mokhtar, Mohamed; AL-Thabaiti, Shaeel A.; Hong, Maochun
Generalized Synthesis of Calixarene-Based High-Nuclearity M4nNanocages (M = Ni or Co;n= 2‒6)
Crystal Growth & Design, 2014, 14, 3116
4510875 CIFC15 H19 N3 O6P -15.8455; 11.6845; 12.5762
78.856; 82.443; 84.035
832.73George, Fanny; Tumanov, Nikolay; Norberg, Bernadette; Robeyns, Koen; Filinchuk, Yaroslav; Wouters, Johan; Leyssens, Tom
Does Chirality Influence the Tendency toward Cocrystal Formation?
Crystal Growth & Design, 2014, 14, 2880
4510883 CIFC43 H42 Co2 F12 N7 O15P -111.443; 11.8242; 21.1005
103.125; 91.599; 104.59
2679.8Croitor, Lilia; Coropceanu, Eduard B.; Chisca, Diana; Baca, Svetlana G.; van Leusen, Jan; Kögerler, Paul; Bourosh, Polina; Kravtsov, Victor Ch.; Grabco, Daria; Pyrtsac, Constantin; Fonari, Marina S.
Effects of Anion and Bipyridyl Bridging Ligand Identity on the Co(II) Coordination Networks
Crystal Growth & Design, 2014, 14, 3015
4511003 CIFC56 H29 Ag11 F21 N3 O14P -112.268; 12.301; 24.005
81.779; 80.323; 70.373
3348.9Hau, Sam C. K.; Mak, Thomas C. W.
Organosilver(I) Framework Assembly with Trifluoroacetate and Diethynyl-Functionalized Isomeric Stilbenes
Crystal Growth & Design, 2014, 14, 3567
4511007 CIFC61 H31 Ag16.5 F37.5 O35P -116.628; 17.478; 17.9012
73.796; 89.955; 82.319
4947.4Hau, Sam C. K.; Mak, Thomas C. W.
Organosilver(I) Framework Assembly with Trifluoroacetate and Diethynyl-Functionalized Isomeric Stilbenes
Crystal Growth & Design, 2014, 14, 3567
4511008 CIFC104 H66 Ag22 F48 N9 O36P -111.3037; 11.8495; 27.6552
80.746; 87.808; 76.235
3551Hau, Sam C. K.; Mak, Thomas C. W.
Organosilver(I) Framework Assembly with Trifluoroacetate and Diethynyl-Functionalized Isomeric Stilbenes
Crystal Growth & Design, 2014, 14, 3567
4511199 CIFC56 H32 I4 N6 O6 SnP -110.9162; 12.1614; 13.2689
63.262; 83.086; 69.742
1474.55Nandi, Goutam; Titi, Hatem M.; Goldberg, Israel
Exploring Supramolecular Self-Assembly of Metalloporphyrin Tectons by Halogen Bonding. 2
Crystal Growth & Design, 2014, 14, 3557
4511203 CIFC49 H27 I4 Mo N6 O3P -115.8194; 16.4413; 22.4957
75.395; 71.085; 87.063
5353.2Nandi, Goutam; Titi, Hatem M.; Goldberg, Israel
Exploring Supramolecular Self-Assembly of Metalloporphyrin Tectons by Halogen Bonding. 2
Crystal Growth & Design, 2014, 14, 3557
4511206 CIFC50 H27 Br5 Mo N5 O3P -19.8873; 16.2858; 16.7259
109.494; 105.496; 105.315
2253.97Nandi, Goutam; Titi, Hatem M.; Goldberg, Israel
Exploring Supramolecular Self-Assembly of Metalloporphyrin Tectons by Halogen Bonding. 2
Crystal Growth & Design, 2014, 14, 3557
4511225 CIFC75 H58 Gd2 N5 O16P -116.346; 17.081; 17.163
68.749; 86.941; 66.545
4074Singh, Ruchi; Mrozinski, Jerzy; Bharadwaj, Parimal K.
Solvent-Induced Carboxylate Shift and Movement of an Anthryl Side-Group in Single-Crystal to Single-Crystal Structural Dynamics in a Gadolinium Coordination Polymer
Crystal Growth & Design, 2014, 14, 3623
4511227 CIFC75 H59 Gd2 N5 O15P -115.418; 16.274; 17.876
109.838; 93.621; 111.141
3846Singh, Ruchi; Mrozinski, Jerzy; Bharadwaj, Parimal K.
Solvent-Induced Carboxylate Shift and Movement of an Anthryl Side-Group in Single-Crystal to Single-Crystal Structural Dynamics in a Gadolinium Coordination Polymer
Crystal Growth & Design, 2014, 14, 3623
4511229 CIFC13 H19 Cl2 N OP -17.7478; 8.1124; 13.1768
117.03; 81.34; 89
725.85Vladiskovic, Chiara; Masciocchi, Norberto
Persistency of a Two-Fold Embrace in Crystalline Phases of Bupropion Hydrohalides: A Thoroughab InitioX-ray Powder Diffraction Study
Crystal Growth & Design, 2014, 14, 3603
4511230 CIFC13 H19 Cl I N OP -17.9819; 8.2163; 13.7557
84.51; 84.75; 63.07
799.4Vladiskovic, Chiara; Masciocchi, Norberto
Persistency of a Two-Fold Embrace in Crystalline Phases of Bupropion Hydrohalides: A Thoroughab InitioX-ray Powder Diffraction Study
Crystal Growth & Design, 2014, 14, 3603
4511234 CIFC13 H19 Cl2 N OP -17.5154; 7.8712; 13.7033
88.12; 86.41; 67.78
748.91Vladiskovic, Chiara; Masciocchi, Norberto
Persistency of a Two-Fold Embrace in Crystalline Phases of Bupropion Hydrohalides: A Thoroughab InitioX-ray Powder Diffraction Study
Crystal Growth & Design, 2014, 14, 3603
4511235 CIFC44 H52 Cl2 F2 N2 O10P -111.961; 12.954; 14.825
114; 99.25; 90.72
2063.4Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.
Pharmaceutical Salts of Haloperidol with Some Carboxylic Acids and Artificial Sweeteners: Hydrate Formation, Polymorphism, and Physicochemical Properties
Crystal Growth & Design, 2014, 14, 2542
4511237 CIFC23 H29 Cl F N O6P -18.7151; 10.152; 14.454
97.42; 98.87; 114.92
1118.7Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.
Pharmaceutical Salts of Haloperidol with Some Carboxylic Acids and Artificial Sweeteners: Hydrate Formation, Polymorphism, and Physicochemical Properties
Crystal Growth & Design, 2014, 14, 2542
4511238 CIFC23 H30 Cl F N O6P -18.6026; 10.585; 13.862
108.39; 101.96; 99.31
1136.2Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.
Pharmaceutical Salts of Haloperidol with Some Carboxylic Acids and Artificial Sweeteners: Hydrate Formation, Polymorphism, and Physicochemical Properties
Crystal Growth & Design, 2014, 14, 2542
4511239 CIFC23 H31 Cl F N O6P -18.7476; 10.374; 13.837
105.57; 100.04; 96.1
1175.5Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.
Pharmaceutical Salts of Haloperidol with Some Carboxylic Acids and Artificial Sweeteners: Hydrate Formation, Polymorphism, and Physicochemical Properties
Crystal Growth & Design, 2014, 14, 2542
4511242 CIFC27 H36 Cl F N2 O5 SP -18.4571; 9.768; 17.989
87.28; 86.32; 68.48
1379.2Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.
Pharmaceutical Salts of Haloperidol with Some Carboxylic Acids and Artificial Sweeteners: Hydrate Formation, Polymorphism, and Physicochemical Properties
Crystal Growth & Design, 2014, 14, 2542
4511244 CIFC25 H28 Cl F N2 O6 SP -19.534; 10.12; 14.36
88.15; 83.73; 65.69
1255Aitipamula, Srinivasulu; Wong, Annie B. H.; Chow, Pui Shan; Tan, Reginald B. H.
Pharmaceutical Salts of Haloperidol with Some Carboxylic Acids and Artificial Sweeteners: Hydrate Formation, Polymorphism, and Physicochemical Properties
Crystal Growth & Design, 2014, 14, 2542
4511249 CIFC8 H4 F4 N2 OP -15.009; 8.499; 10.854
103.871; 101.076; 104.493
418.41Pérez-Torralba, Marta; García, M. Ángeles; López, Concepción; Torralba, M. Carmen; Torres, M. Rosario; Claramunt, Rosa M.; Elguero, José
Structural Investigation of Weak Intermolecular Interactions (Hydrogen and Halogen Bonds) in Fluorine-Substituted Benzimidazoles
Crystal Growth & Design, 2014, 14, 3499
4511255 CIFC16 H30 N4 O8 P2 S2P -14.8022; 10.3715; 12.108
99.771; 93.061; 99.947
583.24Lie, Sharon; Maris, Thierry; Wuest, James D.
Molecular Networks Created by Charge-Assisted Hydrogen Bonding in Phosphonate, Phosphate, and Sulfonate Salts of Bis(amidines)
Crystal Growth & Design, 2014, 14, 3658
4511256 CIFC14 H25 N4 O10 P3 SP -17.513; 11.899; 12.077
95.688; 94.235; 94.317
1067.7Lie, Sharon; Maris, Thierry; Wuest, James D.
Molecular Networks Created by Charge-Assisted Hydrogen Bonding in Phosphonate, Phosphate, and Sulfonate Salts of Bis(amidines)
Crystal Growth & Design, 2014, 14, 3658
4511257 CIFC42 H50 N8 O10 S6P -18.4966; 10.1445; 15.0176
74.608; 81.509; 66.496
1143.17Lie, Sharon; Maris, Thierry; Wuest, James D.
Molecular Networks Created by Charge-Assisted Hydrogen Bonding in Phosphonate, Phosphate, and Sulfonate Salts of Bis(amidines)
Crystal Growth & Design, 2014, 14, 3658
4511258 CIFC72 H60 Mn2 N8 O14P -111.0242; 12.0925; 13.6836
83.092; 69.498; 68.645
1591.25Mistri, Soumen; Zangrando, Ennio; Figuerola, Albert; Adhikary, Amit; Konar, Sanjit; Cano, Joan; Manna, Subal Chandra
Syntheses, Crystal Structures, and Magnetic Properties of Metal‒Organic Hybrid Materials of Mn(II)/Co(II): Three-Fold Interpenetrated α-Polonium-like Network in One of Them
Crystal Growth & Design, 2014, 14, 3276
4511259 CIFC22 H30 Co N2 O13P -17.5539; 8.4979; 20.6375
87.947; 83.923; 72.251
1254.6Mistri, Soumen; Zangrando, Ennio; Figuerola, Albert; Adhikary, Amit; Konar, Sanjit; Cano, Joan; Manna, Subal Chandra
Syntheses, Crystal Structures, and Magnetic Properties of Metal‒Organic Hybrid Materials of Mn(II)/Co(II): Three-Fold Interpenetrated α-Polonium-like Network in One of Them
Crystal Growth & Design, 2014, 14, 3276
4511260 CIFC24 H21 Co N2 O4.5P -19.721; 10.9804; 11.479
97.966; 96.212; 98.244
1190.6Mistri, Soumen; Zangrando, Ennio; Figuerola, Albert; Adhikary, Amit; Konar, Sanjit; Cano, Joan; Manna, Subal Chandra
Syntheses, Crystal Structures, and Magnetic Properties of Metal‒Organic Hybrid Materials of Mn(II)/Co(II): Three-Fold Interpenetrated α-Polonium-like Network in One of Them
Crystal Growth & Design, 2014, 14, 3276
4511265 CIFC5 H8 N6 OP -18.861; 9.424; 9.49
69.25; 73.03; 73.75
694.9Li, Peng; Alduhaish, Osamah; Arman, Hadi D.; Wang, Hailong; Alfooty, Khalid; Chen, Banglin
Solvent Dependent Structures of Hydrogen-Bonded Organic Frameworks of 2,6-Diaminopurine
Crystal Growth & Design, 2014, 14, 3634
4511283 CIFC54 H60 Co3 N12 O21P -18.99; 12.728; 13.252
91.192; 92.755; 109.691
1424.9Rachuri, Yadagiri; Bisht, Kamal Kumar; Suresh, Eringathodi
Two-Dimensional Coordination Polymers Comprising Mixed Tripodal Ligands for Selective Colorimetric Detection of Water and Iodine Capture
Crystal Growth & Design, 2014, 14, 3300
4511284 CIFC54 H58 Cu3 N12 O21P -18.7506; 10.73; 18.933
92.997; 103.096; 102.456
1681.1Rachuri, Yadagiri; Bisht, Kamal Kumar; Suresh, Eringathodi
Two-Dimensional Coordination Polymers Comprising Mixed Tripodal Ligands for Selective Colorimetric Detection of Water and Iodine Capture
Crystal Growth & Design, 2014, 14, 3300
4511290 CIFC31 H37 F3 N4 O7P -19.8775; 13.1864; 13.4772
64.1344; 84.4473; 74.7636
1523.69Iwata, Kentaro; Kojima, Takashi; Ikeda, Yukihiro
Solid Form Selection of Highly Solvating TAK-441 Exhibiting Solvate-Trapping Polymorphism
Crystal Growth & Design, 2014, 14, 3335
4511291 CIFC28 H31 F3 N4 O6P -19.997; 13.0749; 13.4367
63.551; 84.122; 75.542
1522.6Iwata, Kentaro; Kojima, Takashi; Ikeda, Yukihiro
Solid Form Selection of Highly Solvating TAK-441 Exhibiting Solvate-Trapping Polymorphism
Crystal Growth & Design, 2014, 14, 3335
4511292 CIFC32 H39 F3 N4 O7P -110.41717; 11.4906; 13.219
80.8342; 80.6465; 82.4192
1532.18Iwata, Kentaro; Kojima, Takashi; Ikeda, Yukihiro
Solid Form Selection of Highly Solvating TAK-441 Exhibiting Solvate-Trapping Polymorphism
Crystal Growth & Design, 2014, 14, 3335
4511293 CIFC28 H31 F3 N4 O6P -110.7573; 11.4193; 13.7386
74.026; 83.878; 80.058
1595.01Iwata, Kentaro; Kojima, Takashi; Ikeda, Yukihiro
Solid Form Selection of Highly Solvating TAK-441 Exhibiting Solvate-Trapping Polymorphism
Crystal Growth & Design, 2014, 14, 3335
4511298 CIFC56 H40 Cl2 N OP -19.5933; 9.795; 23.4843
99.652; 94.184; 100.588
2126.2Staehle, Ira O.; Rodríguez-Molina, Braulio; Khan, Saeed I.; Garcia-Garibay, Miguel A.
Engineered Photochromism in Crystalline Salicylidene Anilines by Facilitating Rotation to Reach the Coloredtrans-Keto Form
Crystal Growth & Design, 2014, 14, 3667
4511387 CIFC44 H68 Cu2 N4 O20P -18.7497; 9.2024; 16.6861
88.893; 79.897; 64.008
1186.4Dias, Sara S. P.; André, Vânia; Kłak, Julia; Duarte, M. Teresa; Kirillov, Alexander M.
Topological Diversity of Supramolecular Networks Constructed from Copper(II) Aminoalcohol Blocks and 2,6-Naphthalenedicarboxylate Linkers: Self-Assembly Synthesis, Structural Features, and Magnetic Properties
Crystal Growth & Design, 2014, 14, 3398
4511389 CIFC14 H23 Cu N O5P -17.7386; 8.5225; 13.6748
85.096; 85.617; 63.198
801.32Dias, Sara S. P.; André, Vânia; Kłak, Julia; Duarte, M. Teresa; Kirillov, Alexander M.
Topological Diversity of Supramolecular Networks Constructed from Copper(II) Aminoalcohol Blocks and 2,6-Naphthalenedicarboxylate Linkers: Self-Assembly Synthesis, Structural Features, and Magnetic Properties
Crystal Growth & Design, 2014, 14, 3398
4511400 CIFC66 H58 N6 O38 S8 Zn7P -115.5168; 16.779; 18.7394
94.142; 113.527; 110.215
4070.6He, Yan-Ping; Tan, Yan-Xi; Zhang, Jian
Organic Cation Templated Synthesis of Three Zinc‒2,5-Thiophenedicarboxylate Frameworks for Selective Gas Sorption
Crystal Growth & Design, 2014, 14, 3493
4511401 CIFC14 H12 Co N3 O6P -17.813; 7.9406; 11.6727
100.09; 95.843; 99.374
697.09Wang, Xiu-li; Sui, Fang-fang; Lin, Hong-yan; Zhang, Ju-wen; Liu, Guo-cheng
Multifunctional Cobalt(II) Coordination Polymers Tuned by Flexible Bis(pyridylamide) Ligands with Different Spacers and Polycarboxylates
Crystal Growth & Design, 2014, 14, 3438
4511404 CIFC16 H20 Co N3 O8P -18.5578; 10.1318; 11.8526
69.808; 78.753; 74.67
924.1Wang, Xiu-li; Sui, Fang-fang; Lin, Hong-yan; Zhang, Ju-wen; Liu, Guo-cheng
Multifunctional Cobalt(II) Coordination Polymers Tuned by Flexible Bis(pyridylamide) Ligands with Different Spacers and Polycarboxylates
Crystal Growth & Design, 2014, 14, 3438
4511406 CIFC23 H20 Co N4 O9P -110.1586; 10.22; 12.7787
79.125; 71.981; 72.383
1195.83Wang, Xiu-li; Sui, Fang-fang; Lin, Hong-yan; Zhang, Ju-wen; Liu, Guo-cheng
Multifunctional Cobalt(II) Coordination Polymers Tuned by Flexible Bis(pyridylamide) Ligands with Different Spacers and Polycarboxylates
Crystal Growth & Design, 2014, 14, 3438
4511407 CIFC29 H38 Co N4 O12P -19.5278; 10.1157; 17.7684
97.959; 90.3; 110.198
1589.1Wang, Xiu-li; Sui, Fang-fang; Lin, Hong-yan; Zhang, Ju-wen; Liu, Guo-cheng
Multifunctional Cobalt(II) Coordination Polymers Tuned by Flexible Bis(pyridylamide) Ligands with Different Spacers and Polycarboxylates
Crystal Growth & Design, 2014, 14, 3438
4511409 CIFC44 H44 Co2 N8 O16P -110.1112; 15.943; 16.764
111.325; 103.68; 102.598
2303.8Wang, Xiu-li; Sui, Fang-fang; Lin, Hong-yan; Zhang, Ju-wen; Liu, Guo-cheng
Multifunctional Cobalt(II) Coordination Polymers Tuned by Flexible Bis(pyridylamide) Ligands with Different Spacers and Polycarboxylates
Crystal Growth & Design, 2014, 14, 3438
4511410 CIFC32 H39 Co2 N6 O12P -111.1531; 12.9963; 13.4198
75.916; 75.109; 70.039
1740.8Wang, Xiu-li; Sui, Fang-fang; Lin, Hong-yan; Zhang, Ju-wen; Liu, Guo-cheng
Multifunctional Cobalt(II) Coordination Polymers Tuned by Flexible Bis(pyridylamide) Ligands with Different Spacers and Polycarboxylates
Crystal Growth & Design, 2014, 14, 3438
4511418 CIFC12 H26 O12 P4 Zn3P -18.685; 9.9739; 12.8831
100.409; 104.701; 90.945
1059.4Gagnon, Kevin J.; Teat, Simon J.; Beal, Zachary J.; Embry, Alyssa M.; Strayer, Megan E.; Clearfield, Abraham
Isoreticular Investigation into the Formation of Four New Zinc Alkylbisphosphonate Families
Crystal Growth & Design, 2014, 14, 3612
4511532 CIFC12 H9 Cl3 N2 O SnP -17.1208; 8.4113; 13.02
72.212; 87.797; 74.341
714.17Guzmán-Percástegui, Edmundo; Alvarado-Rodríguez, José G.; Cruz-Borbolla, Julián; Andrade-López, Noemí; Vázquez-García, Rosa A.; Nava-Galindo, Rigo N.; Pandiyan, Thangarasu
Subtle C‒H···Hal (Hal = Cl, Br) Bonding as Predominant Synthon in the Assembly of Supramolecular Architectures Based on Luminescent Tin(IV) Complexes. Crystallography, Hirshfeld Surfaces, DFT Calculations, and Fluorescence
Crystal Growth & Design, 2014, 14, 3742
4511535 CIFC25 H22 Cl2 N2 O SnP -19.3066; 9.524; 14.0942
104.361; 94.016; 98.977
1187.65Guzmán-Percástegui, Edmundo; Alvarado-Rodríguez, José G.; Cruz-Borbolla, Julián; Andrade-López, Noemí; Vázquez-García, Rosa A.; Nava-Galindo, Rigo N.; Pandiyan, Thangarasu
Subtle C‒H···Hal (Hal = Cl, Br) Bonding as Predominant Synthon in the Assembly of Supramolecular Architectures Based on Luminescent Tin(IV) Complexes. Crystallography, Hirshfeld Surfaces, DFT Calculations, and Fluorescence
Crystal Growth & Design, 2014, 14, 3742
4511539 CIFC24 H12 F6 I4P -17.0104; 9.1585; 10.9366
80.332; 73.993; 84.208
664.26Lemouchi, Cyprien; Yamamoto, Hiroshi M.; Kato, Reizo; Simonov, Sergey; Zorina, Leokadiya; Rodríguez-Fortea, Antonio; Canadell, Enric; Wzietek, Pawel; Iliopoulos, Konstantinos; Gindre, Denis; Chrysos, Michael; Batail, Patrick
Reversible Control of Crystalline Rotors by Squeezing Their Hydrogen Bond Cloud Across a Halogen Bond-Mediated Phase Transition
Crystal Growth & Design, 2014, 14, 3375
4511540 CIFC24 H12 F6 I4P -19.0986; 11.2261; 13.7829
112.913; 96.345; 93.942
1279.14Lemouchi, Cyprien; Yamamoto, Hiroshi M.; Kato, Reizo; Simonov, Sergey; Zorina, Leokadiya; Rodríguez-Fortea, Antonio; Canadell, Enric; Wzietek, Pawel; Iliopoulos, Konstantinos; Gindre, Denis; Chrysos, Michael; Batail, Patrick
Reversible Control of Crystalline Rotors by Squeezing Their Hydrogen Bond Cloud Across a Halogen Bond-Mediated Phase Transition
Crystal Growth & Design, 2014, 14, 3375
4511541 CIFC28 H38 Cl4 N4 O12 ZnP -19.835; 12.723; 14.592
84.277; 87.288; 76.841
1768.5Chakraborty, Prateeti; Adhikary, Jaydeep; Samanta, Sugata; Escudero, Daniel; Castro, Abril C.; Swart, Marcel; Ghosh, Sanjib; Bauzá, Antonio; Frontera, Antonio; Zangrando, Ennio; Das, Debasis
Combined Experimental and Theoretical Investigation of Ligand and Anion Controlled Complex Formation with Unprecedented Structural Features and Photoluminescence Properties of Zinc(II) Complexes
Crystal Growth & Design, 2014, 14, 4111
4511542 CIFC28 H36 Cl2 N6 O6 S2 Zn2P -19.0372; 12.5384; 15.1211
89.705; 86.941; 84.171
1702.1Chakraborty, Prateeti; Adhikary, Jaydeep; Samanta, Sugata; Escudero, Daniel; Castro, Abril C.; Swart, Marcel; Ghosh, Sanjib; Bauzá, Antonio; Frontera, Antonio; Zangrando, Ennio; Das, Debasis
Combined Experimental and Theoretical Investigation of Ligand and Anion Controlled Complex Formation with Unprecedented Structural Features and Photoluminescence Properties of Zinc(II) Complexes
Crystal Growth & Design, 2014, 14, 4111
4511575 CIFC14 H10 Cu N2 O12 UP -15.3553; 7.685; 10.951
104.448; 90.485; 100.058
429.09Kerr, Andrew T.; Cahill, Christopher L.
CuPYDC Metalloligands and Postsynthetic Rearrangement/Metalation as Routes to Bimetallic Uranyl Containing Hybrid Materials: Syntheses, Structures, and Fluorescence
Crystal Growth & Design, 2014, 14, 4094
4511577 CIFC14 H12 Cu N2 O13 UP -19.344; 10.249; 11.295
90.275; 113.058; 110.556
919.1Kerr, Andrew T.; Cahill, Christopher L.
CuPYDC Metalloligands and Postsynthetic Rearrangement/Metalation as Routes to Bimetallic Uranyl Containing Hybrid Materials: Syntheses, Structures, and Fluorescence
Crystal Growth & Design, 2014, 14, 4094
4511579 CIFC18 H13 B Br N2 O3P -17.095; 10.015; 13.341
90.954; 95.037; 93.988
941.8SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511581 CIFC30 H24 B I N4 O3P -18.996; 12.502; 14.051
109.397; 94.074; 110.188
1367.9SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511583 CIFC19 H15 B I N O2P -17.384; 11.183; 12.07
110.297; 103.06; 94.72
896.4SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511584 CIFC30 H24 B Br N4 O3P -18.982; 12.482; 13.945
109.23; 95.719; 110.223
1344.4SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511585 CIFC18 H14 B Cl N2 O2P -16.939; 9.959; 12.125
80.167; 87.694; 83.066
819.4SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511587 CIFC18 H14 B Br N2 O2P -17.621; 9.054; 11.668
80.58; 88.21; 84.07
789.9SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511588 CIFC19 H15 B Br N O2P -17.218; 11.132; 11.861
109.402; 104.453; 94.515
856.7SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511589 CIFC18 H14 B Cl N2 O2P -17.506; 9.118; 11.635
79.24; 88.39; 84.33
778.4SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511590 CIFC48 H42 B2 I2 N6 O4P -110.129; 10.9; 12.521
69.96; 66.85; 70.21
1160.4SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511592 CIFC18 H18 B Cl N2 O3P -112.259; 12.938; 13.211
96.91; 116.79; 99.83
1796SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511594 CIFC18 H18 B Br N2 O3P -112.301; 12.969; 13.309
96.25; 116.94; 100.13
1819.8SeethaLekshmi, Sunil; Varughese, Sunil; Giri, Lopamudra; Pedireddi, V. R.
Molecular Complexes of 4-Halophenylboronic Acids: A Systematic Exploration of Isostructurality and Structural Landscape
Crystal Growth & Design, 2014, 14, 4143
4511602 CIFC43 H43 Ga O13P -19.8894; 11.9645; 18.8117
104.566; 102.641; 91.839
2093.11Halevas, E.; Hatzidimitriou, A.; Bertmer, M.; Vangelis, A. A.; Antzara, A.; Mateescu, C.; Salifoglou, A.
Structure Lattice-Dimensionality and Spectroscopic Property Correlations in Novel Binary and Ternary Materials of Group 13 Elements with α-Hydroxycarboxylic Benzilic Acid and Phenanthroline
Crystal Growth & Design, 2014, 14, 4041
4511603 CIFC61 H57 In N2 O14P -113.3766; 14.8033; 16.1009
93.531; 103.123; 114.206
2788.7Halevas, E.; Hatzidimitriou, A.; Bertmer, M.; Vangelis, A. A.; Antzara, A.; Mateescu, C.; Salifoglou, A.
Structure Lattice-Dimensionality and Spectroscopic Property Correlations in Novel Binary and Ternary Materials of Group 13 Elements with α-Hydroxycarboxylic Benzilic Acid and Phenanthroline
Crystal Growth & Design, 2014, 14, 4041
4511604 CIFC31 H27 B N2 O7P -18.728; 11.925; 14.66
105.473; 100.16; 103.095
1386Halevas, E.; Hatzidimitriou, A.; Bertmer, M.; Vangelis, A. A.; Antzara, A.; Mateescu, C.; Salifoglou, A.
Structure Lattice-Dimensionality and Spectroscopic Property Correlations in Novel Binary and Ternary Materials of Group 13 Elements with α-Hydroxycarboxylic Benzilic Acid and Phenanthroline
Crystal Growth & Design, 2014, 14, 4041
4511618 CIFC14 H14 N2 O4P -15.4131; 6.0085; 9.9526
87.699; 84.94; 73.561
309.22Cherukuvada, Suryanarayan; Guru Row, Tayur N.
Comprehending the Formation of Eutectics and Cocrystals in Terms of Design and Their Structural Interrelationships
Crystal Growth & Design, 2014, 14, 4187
4511619 CIFC18 H22 N4 O6P -17.1751; 10.1669; 12.6992
82.037; 81.412; 88.251
907.12Cherukuvada, Suryanarayan; Guru Row, Tayur N.
Comprehending the Formation of Eutectics and Cocrystals in Terms of Design and Their Structural Interrelationships
Crystal Growth & Design, 2014, 14, 4187
4511634 CIFC151.95 H223.4 Br3 N6 O46.75P -118.4096; 20.188; 23.4074
73.34; 68.043; 79.237
7698.7Fowler, Drew A.; Pfeiffer, Constance R.; Teat, Simon J.; Baker, Gary A.; Atwood, Jerry L.
Solvent-Modulated Formation of “Pac-man” and Capsular Host‒Guest Bilayers from a Dicationic Ionic Liquid andC-Butylpyrogallol[4]arene
Crystal Growth & Design, 2014, 14, 4199
4511641 CIFC28 H36 N2 O20 U3P -18.9367; 9.4944; 11.9769
83.967; 73.74; 67.598
901.95Thuéry, Pierre; Harrowfield, Jack
Uranyl Ion Complexes with all-cis-1,3,5-Cyclohexanetricarboxylate: Unexpected Framework and Nanotubular Assemblies
Crystal Growth & Design, 2014, 14, 4214
4511646 CIFC44 H38 N30 Na6 O19 W2P -19.55; 11.309; 16.008
85.285; 88.604; 65.217
1564.2Podgajny, Robert; Pinkowicz, Dawid; Czarnecki, Bernard; Kozieł, Marcin; Chorąży, Szymon; Wis, Magdalena; Nitek, Wojciech; Rams, Michał; Sieklucka, Barbara
Role of Pyrazine-N,N′-dioxide in [W(CN)8]n−-Based Hybrid Networks: Anion−π Interactions
Crystal Growth & Design, 2014, 14, 4030
4511648 CIFC62 H28 Mn6 N40 O22 W4P -116.27; 16.578; 19.748
108.69; 94.85; 97.985
4949Podgajny, Robert; Pinkowicz, Dawid; Czarnecki, Bernard; Kozieł, Marcin; Chorąży, Szymon; Wis, Magdalena; Nitek, Wojciech; Rams, Michał; Sieklucka, Barbara
Role of Pyrazine-N,N′-dioxide in [W(CN)8]n−-Based Hybrid Networks: Anion−π Interactions
Crystal Growth & Design, 2014, 14, 4030
4511668 CIFC160 H138P -113.3072; 20.3766; 21.6407
73.832; 83.605; 83.898
5583.4Ghiassi, Kamran B.; Chen, Susanne Y.; Prinz, Peter; de Meijere, Armin; Olmstead, Marilyn M.; Balch, Alan L.
Cocrystallization of C60or C70with the Bowl-Shaped Hydrocarbon Hexakis[(E)-3,3-dimethyl-1-butenyl]benzene To Form Chains of Clamshell Assemblies
Crystal Growth & Design, 2014, 14, 4005
4511672 CIFC32 H36 N8 O14 Zn2P -19.5986; 9.6754; 10.1798
79.665; 82.116; 87.581
921.12Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Zelentsov, Vyacheslav I.; Datsko, Tatiana Ya.; Fonari, Marina S.
Polymeric Luminescent Zn(II) and Cd(II) Dicarboxylates Decorated by Oxime Ligands: Tuning the Dimensionality and Adsorption Capacity
Crystal Growth & Design, 2014, 14, 3935
4511673 CIFC28 H32 B2 Cd2 F8 N8 O10P -18.0455; 11.0296; 12.2367
81.545; 72.039; 69.327
965.55Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Zelentsov, Vyacheslav I.; Datsko, Tatiana Ya.; Fonari, Marina S.
Polymeric Luminescent Zn(II) and Cd(II) Dicarboxylates Decorated by Oxime Ligands: Tuning the Dimensionality and Adsorption Capacity
Crystal Growth & Design, 2014, 14, 3935
4511679 CIFC18 H20 N4 O6 ZnP -18.2196; 9.2915; 14.0247
77.376; 84.259; 75.489
1010.7Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Zelentsov, Vyacheslav I.; Datsko, Tatiana Ya.; Fonari, Marina S.
Polymeric Luminescent Zn(II) and Cd(II) Dicarboxylates Decorated by Oxime Ligands: Tuning the Dimensionality and Adsorption Capacity
Crystal Growth & Design, 2014, 14, 3935
4511680 CIFC21 H27 Cd N5 O7P -19.9339; 10.8715; 13.3713
66.832; 86.057; 73.598
1272.1Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Zelentsov, Vyacheslav I.; Datsko, Tatiana Ya.; Fonari, Marina S.
Polymeric Luminescent Zn(II) and Cd(II) Dicarboxylates Decorated by Oxime Ligands: Tuning the Dimensionality and Adsorption Capacity
Crystal Growth & Design, 2014, 14, 3935
4511684 CIFC23 H15 B F2 O2P -17.8733; 9.6661; 13.1775
95.832; 102.659; 114.486
869.32Alemany, Pere; D’Aléo, Anthony; Giorgi, Michel; Canadell, Enric; Fages, Frédéric
C‒H···BF2O2Interactions in Crystals: A Case for Boron Hydrogen Bonding?
Crystal Growth & Design, 2014, 14, 3700
4511689 CIFC50 H56 O17P -112.5436; 13.1759; 14.583
68.605; 87.655; 82.533
2225Pfeiffer, Constance R.; Fowler, Drew A.; Atwood, Jerry L.
Endo vs Exo Bowl: Complexation of Xanthone by Pyrogallol[4]arenes
Crystal Growth & Design, 2014, 14, 4205
4511691 CIFC52 H58 O16 SP -112.2183; 12.2447; 17.2323
86.549; 83.574; 64.197
2306.3Pfeiffer, Constance R.; Fowler, Drew A.; Atwood, Jerry L.
Endo vs Exo Bowl: Complexation of Xanthone by Pyrogallol[4]arenes
Crystal Growth & Design, 2014, 14, 4205
4511692 CIFC53 H60 O16P -112.7479; 13.0603; 14.191
98.372; 90.522; 98.042
2313.47Pfeiffer, Constance R.; Fowler, Drew A.; Atwood, Jerry L.
Endo vs Exo Bowl: Complexation of Xanthone by Pyrogallol[4]arenes
Crystal Growth & Design, 2014, 14, 4205
4511693 CIFC57 H62 N2 O14P -112.4166; 12.4314; 19.473
72.312; 83.962; 60.7
2493.9Pfeiffer, Constance R.; Fowler, Drew A.; Atwood, Jerry L.
Endo vs Exo Bowl: Complexation of Xanthone by Pyrogallol[4]arenes
Crystal Growth & Design, 2014, 14, 4205
4511694 CIFC62.07 H83.3 O17.35P -112.7989; 15.169; 16.067
75.896; 73.037; 87.394
2892.6Pfeiffer, Constance R.; Fowler, Drew A.; Atwood, Jerry L.
Endo vs Exo Bowl: Complexation of Xanthone by Pyrogallol[4]arenes
Crystal Growth & Design, 2014, 14, 4205
4511695 CIFC57 H68 O16P -112.7772; 13.0828; 15.464
97.204; 90.784; 97.8
2539.6Pfeiffer, Constance R.; Fowler, Drew A.; Atwood, Jerry L.
Endo vs Exo Bowl: Complexation of Xanthone by Pyrogallol[4]arenes
Crystal Growth & Design, 2014, 14, 4205
4511696 CIFC28 H36 Cd4 Cl8 N4 O4P -19.513; 10.681; 10.952
98.71; 98.47; 115.03
968.5Mobin, Shaikh M.; Mishra, Veenu; Chaudhary, Archana; Rai, Dhirendra K.; Golov, Andrey A.; Mathur, Pradeep
Acid-Driven Dimensionality Control of Cd(II) Complexes: From Discrete Double Open Cubane to One- and Three-Dimensional Networks
Crystal Growth & Design, 2014, 14, 4124
4511704 CIFC20 H22 Cu N4 O8P -16.3708; 6.8768; 12.2249
95.797; 97.358; 105.452
506.83Chen, Shui-Sheng; Liu, Qing; Zhao, Yue; Qiao, Rui; Sheng, Liang-Quan; Liu, Zhao-Di; Yang, Song; Song, Cong-Fu
New Metal‒Organic Frameworks Constructed from the 4-Imidazole-Carboxylate Ligand: Structural Diversities, Luminescence, and Gas Adsorption Properties
Crystal Growth & Design, 2014, 14, 3727
4511712 CIFC20 H16 N4 O5 ZnP -18.4831; 10.06; 12.0787
113.522; 92.857; 105.586
895.88Chen, Shui-Sheng; Liu, Qing; Zhao, Yue; Qiao, Rui; Sheng, Liang-Quan; Liu, Zhao-Di; Yang, Song; Song, Cong-Fu
New Metal‒Organic Frameworks Constructed from the 4-Imidazole-Carboxylate Ligand: Structural Diversities, Luminescence, and Gas Adsorption Properties
Crystal Growth & Design, 2014, 14, 3727
4511716 CIFC19 H22 N4 O6P -16.7833; 11.0656; 13.3501
70.288; 87.062; 84.885
939.36Krasnov, Konstantin A.; Khrustalev, Victor N.
Diastereoselective T-Reaction of 1-Alkyl-5-(5-nitro-2-N-morpholino-benzylidene)barbituric Acids in the Solid State: Synthesis of 1-Alkyl-2,4,6-trioxoperhydropyrimidino-5-spiro-10′-(7′-nitro-1′,3′,4′,9′,10′,10a′-hexahydro-2′-oxa)-4a′-azaphenanthrenes and Their 2′-Thia Analogues
Crystal Growth & Design, 2014, 14, 3975
4511717 CIFC56 H67.5 N4 O27.75 S4P -114.066; 17.611; 24.426
98.68; 95.62; 91.79
5946Wang, Kui; Yang, En-Cui; Zhao, Xiao-Jun; Dou, Hong-Xi; Liu, Yu
Molecular Binding Behaviors of Sulfonated Calixarenes with Phenanthroline-diium in Aqueous Solution and Solid State: Cavity Size Governing Capsule Formation
Crystal Growth & Design, 2014, 14, 4631
4511718 CIFC52 H44 N4 O20 S8P -112.354; 14.404; 16.103
69.19; 88.31; 82.76
2656.8Wang, Kui; Yang, En-Cui; Zhao, Xiao-Jun; Dou, Hong-Xi; Liu, Yu
Molecular Binding Behaviors of Sulfonated Calixarenes with Phenanthroline-diium in Aqueous Solution and Solid State: Cavity Size Governing Capsule Formation
Crystal Growth & Design, 2014, 14, 4631
4511719 CIFC63 H71 N4 O30.5 S5P -111.177; 14.903; 19.97
95.73; 93.96; 94.51
3289.6Wang, Kui; Yang, En-Cui; Zhao, Xiao-Jun; Dou, Hong-Xi; Liu, Yu
Molecular Binding Behaviors of Sulfonated Calixarenes with Phenanthroline-diium in Aqueous Solution and Solid State: Cavity Size Governing Capsule Formation
Crystal Growth & Design, 2014, 14, 4631
4511733 CIFC36 H18 Cu6 N6 O12 S6P -112.3691; 12.3715; 15.6775
90.07; 113.174; 119.983
1850.4Kundu, Tanaya; Jana, Ajay Kumar; Natarajan, Srinivasan
Stepwise Crystallization: Illustrative Examples of the Use of Metalloligands [Cu6(mna)6]6‒and [Ag6(Hmna)2(mna)4]4‒(H2mna= 2-Mercapto Nicotinic Acid) in the Formation of Heterometallic Two- and Three-Dimensional Assemblies withbrucite,pcu, andsqlTopologies
Crystal Growth & Design, 2014, 14, 4531
4511735 CIFC18 H24 Cu3 Mn2 N3 O16 S3P -112.3484; 12.466; 14.098
97.148; 108.384; 119.315
1690.7Kundu, Tanaya; Jana, Ajay Kumar; Natarajan, Srinivasan
Stepwise Crystallization: Illustrative Examples of the Use of Metalloligands [Cu6(mna)6]6‒and [Ag6(Hmna)2(mna)4]4‒(H2mna= 2-Mercapto Nicotinic Acid) in the Formation of Heterometallic Two- and Three-Dimensional Assemblies withbrucite,pcu, andsqlTopologies
Crystal Growth & Design, 2014, 14, 4531
4511738 CIFC10 H4 Li2 O8P -15.0422; 7.1471; 7.2031
83.237; 76.586; 81.731
248.91Aliev, Sokhrab B.; Samsonenko, Denis G.; Rakhmanova, Mariana I.; Dybtsev, Danil N.; Fedin, Vladimir P.
Syntheses and Structural Characterization of Lithium Carboxylate Frameworks and Guest-Dependent Photoluminescence Study
Crystal Growth & Design, 2014, 14, 4355
4511742 CIFC14 H16 Mo6 N4 O19P -17.741; 9.604; 10.2
113.291; 107.492; 92.45
652.9Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Li
Assembly of Six Polyoxometalate-Based Hybrid Compounds from a Simple Supramolecule to a Complicated Pseudorotaxane Framework via Tuning the pH of the Reaction Systems
Crystal Growth & Design, 2014, 14, 4450
4511743 CIFC21 H22 Cu Mo4 N6 O14P -111.4391; 11.9757; 12.3265
67.301; 87.752; 73.715
1490.78Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Li
Assembly of Six Polyoxometalate-Based Hybrid Compounds from a Simple Supramolecule to a Complicated Pseudorotaxane Framework via Tuning the pH of the Reaction Systems
Crystal Growth & Design, 2014, 14, 4450
4511744 CIFC28 H31 N8 O40 P W12P -19.9705; 11.4405; 13.258
76.876; 78.266; 65.948
1334.4Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Li
Assembly of Six Polyoxometalate-Based Hybrid Compounds from a Simple Supramolecule to a Complicated Pseudorotaxane Framework via Tuning the pH of the Reaction Systems
Crystal Growth & Design, 2014, 14, 4450
4511746 CIFC49 H55 Cu N14 O65 P2 W18P -114.505; 15.007; 22.506
88.425; 83.881; 81.521
4818Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Li
Assembly of Six Polyoxometalate-Based Hybrid Compounds from a Simple Supramolecule to a Complicated Pseudorotaxane Framework via Tuning the pH of the Reaction Systems
Crystal Growth & Design, 2014, 14, 4450
4511790 CIFC32 H24 N2 O2P -15.8501; 7.8284; 13.0761
74.624; 83.442; 86.913
573.46Calvo-Castro, Jesus; Warzecha, Monika; Kennedy, Alan R.; McHugh, Callum J.; McLean, Andrew J.
Impact of Systematic Structural Variation on the Energetics of π‒π Stacking Interactions and Associated Computed Charge Transfer Integrals of Crystalline Diketopyrrolopyrroles
Crystal Growth & Design, 2014, 14, 4849
4511791 CIFC14 H6 Cl2 Cu N5 O2 SP -17.9661; 8.3365; 14.932
76.996; 89.811; 63.693
860.83Pinkowicz, Dawid; Li, Zhanyong; Pietrzyk, Piotr; Rams, Michał
New Thiadiazole Dioxide Bridging Ligand with a Stable Radical Form for the Construction of Magnetic Coordination Chains
Crystal Growth & Design, 2014, 14, 4878
4511799 CIFC49 H36 Cl6 N6 O8 Zn2P -17.6168; 9.243; 19.802
101.716; 98.529; 94.415
1341.7Park, Minwoo; Kim, Hyeun; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Host‒Guest Chemistry of 1D Suprachannels and Dihalomethane Molecules: Metallacyclodimeric Ensembles Consisting of Zinc(II)-2,7-bis(nicotinoyloxy)naphthalene Complexes
Crystal Growth & Design, 2014, 14, 4461
4511800 CIFC45 H29 Br4 Cl3 N4 O8 Zn2P -18.3082; 9.5031; 15.9217
84.604; 89.685; 84.055
1244.76Park, Minwoo; Kim, Hyeun; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Host‒Guest Chemistry of 1D Suprachannels and Dihalomethane Molecules: Metallacyclodimeric Ensembles Consisting of Zinc(II)-2,7-bis(nicotinoyloxy)naphthalene Complexes
Crystal Growth & Design, 2014, 14, 4461
4511801 CIFC93 H66 Br18 N8 O16 Zn4P -17.7533; 38.95; 9.3528
90; 95.634; 90
2810.8Park, Minwoo; Kim, Hyeun; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Host‒Guest Chemistry of 1D Suprachannels and Dihalomethane Molecules: Metallacyclodimeric Ensembles Consisting of Zinc(II)-2,7-bis(nicotinoyloxy)naphthalene Complexes
Crystal Growth & Design, 2014, 14, 4461
4511802 CIFC45 H30 Cl2 I4 N4 O8 Zn2P -19.7602; 17.0271; 17.4437
115.223; 96.034; 94.901
2580.54Park, Minwoo; Kim, Hyeun; Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Host‒Guest Chemistry of 1D Suprachannels and Dihalomethane Molecules: Metallacyclodimeric Ensembles Consisting of Zinc(II)-2,7-bis(nicotinoyloxy)naphthalene Complexes
Crystal Growth & Design, 2014, 14, 4461
4511811 CIFC20 H11 Cl3 F6 Fe O2P -17.35; 8.248; 17.977
87.036; 89.136; 71.771
1033.7Emami, Seyedali; Paz, Filipe A. Almeida; Mendes, Adélio; Gales, Luís
Toward the Construction of 3D Dipeptide‒Metal Frameworks
Crystal Growth & Design, 2014, 14, 4777
4511813 CIFC20 H14 N2P -13.9187; 11.9054; 16.2554
100.98; 91.214; 94.833
741.31Sonoda, Yoriko; Goto, Midori; Norikane, Yasuo; Azumi, Reiko
Crystal Structures and Fluorescence Spectroscopic Properties of Cyano-Substituted Diphenylhexatrienes
Crystal Growth & Design, 2014, 14, 4781
4511815 CIFC20 H14 N2P -15.4806; 12.043; 12.301
71.769; 79.633; 78.979
750.6Sonoda, Yoriko; Goto, Midori; Norikane, Yasuo; Azumi, Reiko
Crystal Structures and Fluorescence Spectroscopic Properties of Cyano-Substituted Diphenylhexatrienes
Crystal Growth & Design, 2014, 14, 4781
4511817 CIFC30 H22 Co N4 O10P -110.519; 12.038; 13.1
95.687; 111.148; 112.522
1373.8Wu, Jing-Yun; Hsiao, Cheng-Chu; Chiang, Ming-Hsi
Concomitant Crystallization of Genuine Supramolecular Isomeric Rhombus Grid and Ribbon
Crystal Growth & Design, 2014, 14, 4321
4511824 CIFC6 H7 F N3 O3P -14.9209; 8.6115; 9.4689
72.466; 75.129; 89.747
368.64da Silva, Cecília C. P.; Pepino, Rebeka de O.; de Melo, Cristiane C.; Tenorio, Juan C.; Ellena, Javier
Controlled Synthesis of New 5-Fluorocytosine Cocrystals Based on the pKaRule
Crystal Growth & Design, 2014, 14, 4383

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