Crystallography Open Database
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Searching journal of publication like 'Crystal Growth & Design'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
4502440 | CIF | V | I m -3 m | 3.0278; 3.0278; 3.0278 90; 90; 90 | 27.758 | Zolotoyabko, E.; Caspi, E. N.; Fieramosca, J. S.; Von Dreele, R. B.; Marin, F.; Mor, G.; Addadi, L.; Weiner, S.; Politi, Y. Differences between Bond Lengths in Biogenic and Geological Calcite Crystal Growth & Design, 2010, 10, 1207 |
4502442 | CIF | V | I m -3 m | 3.0321; 3.0321; 3.0321 90; 90; 90 | 27.876 | Zolotoyabko, E.; Caspi, E. N.; Fieramosca, J. S.; Von Dreele, R. B.; Marin, F.; Mor, G.; Addadi, L.; Weiner, S.; Politi, Y. Differences between Bond Lengths in Biogenic and Geological Calcite Crystal Growth & Design, 2010, 10, 1207 |
4505652 | CIF | Cu0.68 Ge0.02 Sn0.3 | P 63/m m c | 2.7603; 2.7603; 4.3275 90; 90; 120 | 28.555 | Purdy, Andrew P.; Case, Sean; George, Clifford Ammonothermal Crystal Growth of Germanium and Its Alloys: Synthesis of a Hollow Metallic Crystal Crystal Growth & Design, 2003, 3, 121 |
4505653 | CIF | Ag0.72 Ge0.02 Sn0.26 | P 63/m m c | 2.9491; 2.9491; 4.7734 90; 90; 120 | 35.953 | Purdy, Andrew P.; Case, Sean; George, Clifford Ammonothermal Crystal Growth of Germanium and Its Alloys: Synthesis of a Hollow Metallic Crystal Crystal Growth & Design, 2003, 3, 121 |
4512485 | CIF | Ba Li0.2 N0.19 O2.81 Ta0.8 | P m -3 m | 4.10778; 4.10778; 4.10778 90; 90; 90 | 69.3141 | Kim, Young-Il; Paik, Younkee; Avdeev, Maxim Intercalation Route to Complex Perovskites AM0.2Ta0.8O2.8N0.2(A = Sr, Ba; M = Li, Na): Neutron Diffraction and Nuclear Magnetic Resonance Study Crystal Growth & Design, 2015, 15, 53 |
4512484 | CIF | Ba N0.3 Na0.18 O2.7 Ta0.82 | P m -3 m | 4.13059; 4.13059; 4.13059 90; 90; 90 | 70.4752 | Kim, Young-Il; Paik, Younkee; Avdeev, Maxim Intercalation Route to Complex Perovskites AM0.2Ta0.8O2.8N0.2(A = Sr, Ba; M = Li, Na): Neutron Diffraction and Nuclear Magnetic Resonance Study Crystal Growth & Design, 2015, 15, 53 |
4501852 | CIF | As Fe Li | P 4/n m m :2 | 3.7678; 3.7678; 6.3151 90; 90; 90 | 89.651 | Morozov, Igor; Boltalin, Alexander; Volkova, Olga; Vasiliev, Alexander; Kataeva, Olga; Stockert, Ulrike; Abdel-Hafiez, Mahmoud; Bombor, Dirk; Bachmann, Anne; Harnagea, Luminita; Fuchs, Madeleine; Grafe, Hans-Joachim; Behr, Günter; Klingeler, Rüdiger; Borisenko, Sergey; Hess, Christian; Wurmehl, Sabine; Büchner, Bernd Single Crystal Growth and Characterization of Superconducting LiFeAs Crystal Growth & Design, 2010, 10, 4428 |
4505482 | CIF | Co Li O2 | R -3 m :H | 2.815; 2.815; 14.0516 90; 90; 120 | 96.43 | Lin, Qiyin; Li, Qing’an; Gray, Kenneth E.; Mitchell, John F. Vapor Growth and Chemical Delithiation of Stoichiometric LiCoO2Crystals Crystal Growth & Design, 2012, 12, 1232 |
4509949 | CIF | Bi Cl O | P 4/n m m :2 | 3.88551; 3.88551; 7.3489 90; 90; 90 | 110.948 | Biswas, Anupam; Das, Raja; Dey, Chandan; Banerjee, Rahul; Poddar, Pankaj Ligand-Free One-Step Synthesis of {001} Faceted Semiconducting BiOCl Single Crystals and Their Photocatalytic Activity Crystal Growth & Design, 2014, 14, 236 |
4509345 | CIF | Co Ga5 Yb | P 4/m m m | 4.19; 4.19; 6.727 90; 90; 90 | 118.1 | Okudzeto, Edem K.; Kuga, Kentarou; Nakatsuji, Satoru; Chan, Julia Y. Crystal Growth, Transport, and Magnetic Properties of YbCoGa5 Crystal Growth & Design, 2009, 9, 1956 |
4504974 | CIF | C2 H5 N O2 | P 1 n 1 | 4.8887; 5.7541; 5.4419 90; 116.682; 90 | 136.78 | Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine Crystal Growth & Design, 2005, 5, 1415 |
4507987 | CIF | C2 H2 O4 | P 1 21/c 1 | 5.317; 5.9435; 5.3988 90; 116.21; 90 | 153.07 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4507988 | CIF | C2 H2 O4 | P 1 21/c 1 | 5.3369; 5.957; 5.4144 90; 116.18; 90 | 154.48 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4513001 | CIF | C2 H5 N O2 | P 1 21 1 | 5.0749; 6.1692; 5.388 90; 113.393; 90 | 154.82 | Jiang, Qi; Shtukenberg, Alexander G.; Ward, Michael D.; Hu, Chunhua Non-Topotactic Phase Transformations in Single Crystals of β-Glycine Crystal Growth & Design, 2015, 15, 2568 |
4507989 | CIF | C2 H2 O4 | P 1 21/c 1 | 5.3333; 5.9723; 5.4187 90; 115.99; 90 | 155.14 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4505645 | CIF | C2 H5 N O2 | P 1 21 1 | 5.0785; 6.1923; 5.3869 90; 113.346; 90 | 155.54 | Ferrari, Elena S.; Davey, Roger J.; Cross, Wendy I.; Gillon, Amy L.; Towler, Christopher S. Crystallization in Polymorphic Systems: The Solution-Mediated Transformation of β to α Glycine Crystal Growth & Design, 2003, 3, 53 |
4507990 | CIF | C2 H2 O4 | P 1 21/c 1 | 5.3385; 5.9978; 5.4376 90; 116.12; 90 | 156.33 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4507991 | CIF | C2 H2 O4 | P 1 21/c 1 | 5.3266; 6.0126; 5.4456 90; 115.8; 90 | 157.02 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4507226 | CIF | Si | F d -3 m :2 | 5.43; 5.43; 5.43 90; 90; 90 | 160.103 | Stefanoski, S.; Blosser, M. C.; Nolas, G. S. Pressure Effects on the Size of Type-I and Type-II Si-Clathrates Synthesized by Spark Plasma Sintering Crystal Growth & Design, 2013, 13, 195 |
4500157 | CIF | Ce Cu2 Si2 | I 4/m m m | 4.092; 4.092; 9.91 90; 90; 90 | 165.94 | Cao, Chongde; Deppe, Micha; Behr, Günter; Löser, Wolfgang; Wizent, Nadja; Kataeva, Olga; Büchner, Bernd Single Crystal Growth of the CeCu2Si2Intermetallic Compound by a Vertical Floating Zone Method Crystal Growth & Design, 2011, 11, 431 |
4516578 | CIF | C4 H4 N2 | P 1 21/n 1 | 9.265; 5.433; 3.479 90; 96.15; 90 | 174.1 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4516577 | CIF | C4 H4 N2 | P 1 21/n 1 | 9.267; 5.516; 3.544 90; 94.91; 90 | 180.5 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4506380 | CIF | C6 H6 B2 F2 O4 | P -1 | 4.9838; 5.2569; 7.423 74.671; 84.636; 89 | 186.73 | Durka, Krzysztof; Jarzembska, Katarzyna N.; Kamiński, Radosław; Luliński, Sergiusz; Serwatowski, Janusz; Woźniak, Krzysztof Structural and Energetic Landscape of Fluorinated 1,4-Phenylenediboronic Acids Crystal Growth & Design, 2012, 12, 3720 |
4516576 | CIF | C4 H4 N2 | P 1 21/n 1 | 9.313; 5.683; 3.583 90; 93.1; 90 | 189.4 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4516575 | CIF | C4 H4 N2 | P m n n | 9.307; 5.706; 3.623 90; 90; 90 | 192.4 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4511818 | CIF | F Fe O3 Sr2 | P 4/n m m :2 | 3.8644; 3.8644; 13.1678 90; 90; 90 | 196.642 | Tsujimoto, Yoshihiro; Matsushita, Yoshitaka; Hayashi, Naoaki; Yamaura, Kazunari; Uchikoshi, Tetsuo Anion Order-to-Disorder Transition in Layered Iron Oxyfluoride Sr2FeO3F Single Crystals Crystal Growth & Design, 2014, 14, 4278 |
4516574 | CIF | C4 H4 N2 | P m n n | 9.301; 5.735; 3.712 90; 90; 90 | 198 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4518920 | CIF | As2 Cl K O6 | P 6 m m | 5.2774; 5.2774; 8.3169 90; 90; 120 | 200.601 | Domański, Mateusz A.; Kraszewski, Karol; Paluch, Piotr; Guńka, Piotr A. Arsenic(III)-oxide Intercalates with Potassium Chloride: Water-Induced Varieties and New Synthesis Methods Crystal Growth & Design, 2021 |
4516573 | CIF | C4 H4 N2 | P m n n | 9.312; 5.835; 3.743 90; 90; 90 | 203.4 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4516572 | CIF | C4 H4 N2 | P m n n | 9.333; 5.848; 3.7735 90; 90; 90 | 205.96 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4507992 | CIF | C3 H4 O4 | P -1 | 5.1539; 5.324; 8.1688 108.04; 101.306; 95.29 | 206.16 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4507993 | CIF | C3 H4 O4 | P -1 | 5.1579; 5.3225; 8.195 108.09; 101.24; 95.26 | 206.94 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4503066 | CIF | C H4 O | P 21 21 21 | 4.6469; 4.9285; 9.0403 90; 90; 90 | 207.04 | Kirchner, Michael T.; Das, Dinabandhu; Boese, Roland Cocrystallization with Acetylene: Molecular Complex with Methanol Crystal Growth & Design, 2008, 8, 763 |
4507994 | CIF | C3 H4 O4 | P -1 | 5.1592; 5.3308; 8.2401 108.181; 101.107; 95.225 | 208.48 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4518918 | CIF | As4 Cl K O6 | P 6/m m m | 5.2255; 5.2255; 8.8479 90; 90; 120 | 209.231 | Domański, Mateusz A.; Kraszewski, Karol; Paluch, Piotr; Guńka, Piotr A. Arsenic(III)-oxide Intercalates with Potassium Chloride: Water-Induced Varieties and New Synthesis Methods Crystal Growth & Design, 2021 |
4507995 | CIF | C3 H4 O4 | P -1 | 5.1578; 5.3301; 8.292 108.262; 100.971; 95.138 | 209.78 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4507996 | CIF | C3 H4 O4 | P -1 | 5.155; 5.335; 8.3448 108.4; 100.78; 95.059 | 211.24 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4507997 | CIF | C3 H4 O4 | P -1 | 5.1582; 5.34; 8.4024 108.486; 100.712; 94.95 | 213.04 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4503067 | CIF | C H4 O | C m c 21 | 6.401; 7.22; 4.647 90; 90; 90 | 214.76 | Kirchner, Michael T.; Das, Dinabandhu; Boese, Roland Cocrystallization with Acetylene: Molecular Complex with Methanol Crystal Growth & Design, 2008, 8, 763 |
4501704 | CIF | C6 H6 | P 1 21/c 1 | 5.522; 5.4396; 7.6726 90; 110.55; 90 | 215.8 | Katrusiak, Andrzej; Podsiadło, Marcin; Budzianowski, Armand Association CH···π and No van der Waals Contacts at the Lowest Limits of Crystalline Benzene I and II Stability Regions† Crystal Growth & Design, 2010, 10, 3461 |
4501703 | CIF | C6 H6 | P 1 21/c 1 | 5.5146; 5.4951; 7.6536 90; 110.59; 90 | 217.11 | Katrusiak, Andrzej; Podsiadło, Marcin; Budzianowski, Armand Association CH···π and No van der Waals Contacts at the Lowest Limits of Crystalline Benzene I and II Stability Regions† Crystal Growth & Design, 2010, 10, 3461 |
4513294 | CIF | As2 O3 | P 1 21 1 | 8.223; 3.9071; 7.13 90; 106.53; 90 | 219.61 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4504972 | CIF | C2 H5 N O2 | P 31 | 6.8617; 6.8617; 5.4282 90; 90; 120 | 221.33 | Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine Crystal Growth & Design, 2005, 5, 1415 |
4505427 | CIF | C8 H14 N2 O2 | P -1 | 5.6526; 5.8755; 8.049 92.912; 106.965; 116.022 | 224.74 | Gordon-Wylie, Scott W.; Teplin, Eleanor; Morris, James C.; Trombley, Margaret I.; McCarthy, Sean M.; Cleaver, William M.; Clark, George R. Exploring Hydrogen-Bonded Structures: Synthesis and X-ray Crystallographic Screening of a Cisoid Cyclic Dipeptide Mini-Library Crystal Growth & Design, 2004, 4, 789 |
4504971 | CIF | C2 H5 N O2 | P 31 | 6.9332; 6.9332; 5.4552 90; 90; 120 | 227.1 | Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine Crystal Growth & Design, 2005, 5, 1415 |
4501698 | CIF | C6 H13 I N2 | P -6 m 2 | 7.0217; 7.0217; 5.3196 90; 90; 120 | 227.14 | Szafrański, Marek; Katrusiak, Andrzej; McIntyre, Garry J. Proton Disorder in NH···N Bonded [dabcoH]+I−Relaxor: New Insights into H-Disordering in a One-Dimensional H2O Ice Analogue Crystal Growth & Design, 2010, 10, 4334 |
4501697 | CIF | C6 H13 I N2 | P -6 m 2 | 7.0223; 7.0223; 5.3198 90; 90; 120 | 227.19 | Szafrański, Marek; Katrusiak, Andrzej; McIntyre, Garry J. Proton Disorder in NH···N Bonded [dabcoH]+I−Relaxor: New Insights into H-Disordering in a One-Dimensional H2O Ice Analogue Crystal Growth & Design, 2010, 10, 4334 |
4501699 | CIF | C6 H13 I N2 | P -6 m 2 | 7.022; 7.022; 5.32 90; 90; 120 | 227.2 | Szafrański, Marek; Katrusiak, Andrzej; McIntyre, Garry J. Proton Disorder in NH···N Bonded [dabcoH]+I−Relaxor: New Insights into H-Disordering in a One-Dimensional H2O Ice Analogue Crystal Growth & Design, 2010, 10, 4334 |
4506788 | CIF | C8 H4 O6 U | P -1 | 5.1044; 5.5593; 8.4574 89.989; 85.615; 71.995 | 227.5 | Mihalcea, Ionut; Henry, Natacha; Bousquet, Till; Volkringer, Christophe; Loiseau, Thierry Six-Fold Coordinated Uranyl Cations in Extended Coordination Polymers Crystal Growth & Design, 2012, 12, 4641 |
4511822 | CIF | C7 H17 N O5 | P 1 | 4.819; 5.131; 9.627 104.662; 93.985; 92.586 | 229.2 | Nauha, Elisa; Bernstein, Joel “Predicting” Crystal Forms of Pharmaceuticals Using Hydrogen Bond Propensities: Two Test Cases Crystal Growth & Design, 2014, 14, 4364 |
4511451 | CIF | O3 Rh Tb | P n m a | 5.7454; 7.6254; 5.2538 90; 90; 90 | 230.17 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4511457 | CIF | O3 Rh Tb | P b n m | 5.2538; 5.7454; 7.6254 90; 90; 90 | 230.17 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4512999 | CIF | C2 H5 N O2 | P 31 | 6.9824; 6.9824; 5.4749 90; 90; 120 | 231.16 | Jiang, Qi; Shtukenberg, Alexander G.; Ward, Michael D.; Hu, Chunhua Non-Topotactic Phase Transformations in Single Crystals of β-Glycine Crystal Growth & Design, 2015, 15, 2568 |
4501696 | CIF | C6 H13 I N2 | P -6 m 2 | 7.0925; 7.0925; 5.3437 90; 90; 120 | 232.79 | Szafrański, Marek; Katrusiak, Andrzej; McIntyre, Garry J. Proton Disorder in NH···N Bonded [dabcoH]+I−Relaxor: New Insights into H-Disordering in a One-Dimensional H2O Ice Analogue Crystal Growth & Design, 2010, 10, 4334 |
4513293 | CIF | As2 O3 | P 1 21 1 | 8.3192; 4.0286; 7.298 90; 106.84; 90 | 234.1 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4511450 | CIF | Eu O3 Rh | P n m a | 5.7574; 7.6786; 5.2978 90; 90; 90 | 234.21 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4511456 | CIF | Eu O3 Rh | P b n m | 5.2978; 5.7574; 7.6786 90; 90; 90 | 234.21 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4512893 | CIF | C2 H5 N O2 | P 31 | 7.037; 7.037; 5.483 90; 90; 120 | 235.1 | Jiang, Qi; Shtukenberg, Alexander G.; Ward, Michael D.; Hu, Chunhua Non-Topotactic Phase Transformations in Single Crystals of β-Glycine Crystal Growth & Design, 2015, 15, 2568 |
4511449 | CIF | O3 Rh Sm | P n m a | 5.7566; 7.7084; 5.3231 90; 90; 90 | 236.21 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4511455 | CIF | O3 Rh Sm | P b n m | 5.3231; 5.7566; 7.7084 90; 90; 90 | 236.21 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4504482 | CIF | C6 H10 Cl2 N2 O4 | P -1 | 4.5858; 6.5523; 8.5457 98.236; 104.958; 102.926 | 236.22 | Akutagawa, Tomoyuki; Nakamura, Takayoshi Crystal and Electronic Structures of Hydrogen-Bonded 2,5-Diamino-3,6-dihydroxy-p-benzoquinone Crystal Growth & Design, 2006, 6, 70 |
4505816 | CIF | C8 H10 N2 O6 | P -1 | 5.9359; 6.5936; 7.3042 109.262; 90.762; 116.527 | 237.06 | Luo, Tzy-Jiun M.; Palmore, G. Tayhas R. Engineering Crystalline Architecture with Supramolecular Tapes: Studies on Secondary Donor−Acceptor Interactions in Cocrystals of the Cyclic Dipeptide of Glycine Crystal Growth & Design, 2002, 2, 337 |
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 |
4518393 | CIF HKL | C12 H6 N4 | P -1 | 3.7577; 5.8815; 10.9271 94.985; 94.575; 94.803 | 238.82 | Peter, Aneeshma; Mohan, Midhun; Maris, Thierry; Wuest, James D.; Duong, Adam Comparing Crystallizations in Three Dimensions and Two Dimensions: Behavior of Isomers of [2,2?-Bipyridine]dicarbonitrile and [1,10-Phenanthroline]dicarbonitrile Crystal Growth and Design, 2017, 17, 5242-5248 |
4507998 | CIF | C4 H6 O4 | P 1 21/c 1 | 5.4662; 8.768; 5.0205 90; 93.043; 90 | 240.28 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4511448 | CIF | Nd O3 Rh | P n m a | 5.7524; 7.7703; 5.3758 90; 90; 90 | 240.29 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4511454 | CIF | Nd O3 Rh | P b n m | 5.3758; 5.7524; 7.7703 90; 90; 90 | 240.29 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4513291 | CIF | As2 O3 | P 1 21 1 | 8.3494; 4.0797; 7.388 90; 106.91; 90 | 240.78 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4513292 | CIF | As2 O3 | P 1 21 1 | 8.3557; 4.0829; 7.385 90; 107.04; 90 | 240.9 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4507999 | CIF | C4 H6 O4 | P 1 21/c 1 | 5.4768; 8.7831; 5.0287 90; 92.862; 90 | 241.6 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4513290 | CIF | As2 O3 | P 1 21 1 | 8.357; 4.0889; 7.4 90; 106.9; 90 | 241.94 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4511447 | CIF | O3 Pr Rh | P n m a | 5.7405; 7.8032; 5.4167 90; 90; 90 | 242.637 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4511453 | CIF | O3 Pr Rh | P b n m | 5.4167; 5.7405; 7.8032 90; 90; 90 | 242.637 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4508000 | CIF | C4 H6 O4 | P 1 21/c 1 | 5.4793; 8.794; 5.0442 90; 92.502; 90 | 242.82 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4508001 | CIF | C4 H6 O4 | P 1 21/c 1 | 5.4866; 8.8113; 5.0564 90; 92.25; 90 | 244.26 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4501251 | CIF | C4 F2 O2 Tl | P -1 | 3.7181; 6.76; 10.202 106.78; 92.74; 92.82 | 244.69 | Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand Crystal Growth & Design, 2011, 11, 5053 |
4508002 | CIF | C4 H6 O4 | P 1 21/c 1 | 5.5072; 8.8432; 5.075 90; 91.878; 90 | 247.03 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4513295 | CIF | As2 O3 | P 1 21 1 | 8.3873; 4.136; 7.49 90; 107.03; 90 | 248.43 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4511446 | CIF | La O3 Rh | P n m a | 5.7005; 7.8968; 5.5242 90; 90; 90 | 248.68 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4511452 | CIF | La O3 Rh | P b n m | 5.5242; 5.7005; 7.8968 90; 90; 90 | 248.68 | Macquart, René B.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth and Single-Crystal Structures ofRERhO3(RE= La, Pr, Nd, Sm, Eu, Tb) Orthorhodites from a K2CO3Flux Crystal Growth & Design, 2006, 6, 1361 |
4511738 | CIF | C10 H4 Li2 O8 | P -1 | 5.0422; 7.1471; 7.2031 83.237; 76.586; 81.731 | 248.91 | Aliev, 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 |
4508003 | CIF | C4 H6 O4 | P 1 21/c 1 | 5.5198; 8.8763; 5.0993 90; 91.508; 90 | 249.76 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4508593 | CIF | Cr Li O7 P2 | P 1 21 1 | 4.7867; 8.0049; 6.9093 90; 109.003; 90 | 250.32 | Pachoud, Elise; Zhang, Weiguo; Tapp, Joshua; Liang, Kao-Chen; Lorenz, Bernd; Chu, Paul C. W.; Halasyamani, P. Shiv Top-Seeded Single-Crystal Growth, Structure, and Physical Properties of Polar LiCrP2O7 Crystal Growth & Design, 2013, 13, 5473 |
4503127 | CIF | C6 D10 | P -1 | 6.39679; 7.49764; 6.33845 109.09; 118.363; 79.3203 | 252.629 | Ibberson, Richard M.; Telling, Mark T. F.; Parsons, Simon Crystal Structures and Glassy Phase Transition Behavior of Cyclohexene Crystal Growth & Design, 2008, 8, 512 |
4508831 | CIF | C8 H12 O6 U | P -1 | 4.4142; 5.548; 10.718 77.47; 81.865; 85.993 | 253.45 | Borkowski, Lauren A.; Cahill, Christopher L. Crystal Engineering with the Uranyl Cation I. Aliphatic Carboxylate Coordination Polymers: Synthesis, Crystal Structures, and Fluorescent Properties Crystal Growth & Design, 2006, 6, 2241 |
4513296 | CIF | As2 O3 | P 1 21 1 | 8.4114; 4.1895; 7.614 90; 107.025; 90 | 256.56 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4506047 | CIF | C4 H4 N2 O S | P -1 | 4.2484; 5.9704; 10.566 105.734; 94.894; 91.898 | 256.58 | Jarzembska, Katarzyna N.; Kubsik, Marcin; Kamiński, Radosław; Woźniak, Krzysztof; Dominiak, Paulina M. From a Single Molecule to Molecular Crystal Architectures: Structural and Energetic Studies of Selected Uracil Derivatives Crystal Growth & Design, 2012, 12, 2508 |
4512482 | CIF | Li0.19 N0.2 O2.8 Sr Ta0.81 | I 4/m c m | 5.67388; 5.67388; 8.0431 90; 90; 90 | 258.93 | Kim, Young-Il; Paik, Younkee; Avdeev, Maxim Intercalation Route to Complex Perovskites AM0.2Ta0.8O2.8N0.2(A = Sr, Ba; M = Li, Na): Neutron Diffraction and Nuclear Magnetic Resonance Study Crystal Growth & Design, 2015, 15, 53 |
4504970 | CIF | C2 H5 N O2 | P 1 21/n 1 | 4.869; 11.139; 5.3777 90; 116.888; 90 | 260.13 | Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine Crystal Growth & Design, 2005, 5, 1415 |
4513730 | CIF | C8 H16 Cl2 Cr O2 | P -1 | 3.9645; 7.2398; 9.2813 86.918; 79.841; 87.105 | 261.61 | Crochet, Aurélien; Brog, Jean-Pierre; Fromm, Katharina M. Mixed Metal Multinuclear Cr(III) Cage Compounds and Coordination Polymers Based on Unsubstituted Phenolate: Design, Synthesis, Mechanism, and Properties Crystal Growth & Design, 2016, 16, 189 |
4512483 | CIF | N0.2 Na0.19 O2.8 Sr Ta0.81 | I 4/m c m | 5.7216; 5.7216; 8.0923 90; 90; 90 | 264.92 | Kim, Young-Il; Paik, Younkee; Avdeev, Maxim Intercalation Route to Complex Perovskites AM0.2Ta0.8O2.8N0.2(A = Sr, Ba; M = Li, Na): Neutron Diffraction and Nuclear Magnetic Resonance Study Crystal Growth & Design, 2015, 15, 53 |
4509153 | CIF | C10 H14 N2 O4 | P -1 | 3.8081; 8.3558; 8.606 81.95; 80.337; 85.847 | 266.96 | Weyna, David R.; Shattock, Tanise; Vishweshwar, Peddy; Zaworotko, Michael J. Synthesis and Structural Characterization of Cocrystals and Pharmaceutical Cocrystals: Mechanochemistry vs Slow Evaporation from Solution Crystal Growth & Design, 2009, 9, 1106 |
4501764 | CIF | C5 H5 N3 O | P 1 c 1 | 7.17; 3.6477; 10.648 90; 106.35; 90 | 267.23 | Cherukuvada, Suryanarayan; Thakuria, Ranjit; Nangia, Ashwini Pyrazinamide Polymorphs: Relative Stability and Vibrational Spectroscopy Crystal Growth & Design, 2010, 10, 3931 |
4501763 | CIF | C5 H5 N3 O | P 1 c 1 | 7.1756; 3.6508; 10.663 90; 106.337; 90 | 268.06 | Cherukuvada, Suryanarayan; Thakuria, Ranjit; Nangia, Ashwini Pyrazinamide Polymorphs: Relative Stability and Vibrational Spectroscopy Crystal Growth & Design, 2010, 10, 3931 |
4505378 | CIF | As2 Cu2 O7 | C 1 2/m 1 | 7.0987; 8.2777; 4.8666 90; 110.206; 90 | 268.37 | Weil, Matthias; Lengauer, Christian; Füglein, Ekkehard; Baran, Enrique J. The Reversible α →β Phase Transition of Cu2As2O7 Crystal Growth & Design, 2004, 4, 1229 |
4502037 | CIF | Ag3 F4 O2 V | P 1 21/n 1 | 5.7568; 5.7811; 8.0883 90; 90.661; 90 | 269.166 | Chamberlain, Julia M.; Albrecht, Thomas A.; Lesage, Julien; Sauvage, Frédéric; Stern, Charlotte L.; Poeppelmeier, Kenneth R. Crystal Growth of Ag3MOxF6−x(M= V,x= 2;M= Mo,x= 3) Crystal Growth & Design, 2010, 10, 4868 |
4504593 | CIF | C2 H5 Cl N4 | P 1 21 1 | 5.0579; 7.0018; 7.647 90; 91.716; 90 | 270.69 | Laus, G.; Kahlenberg, V.; Többens, D. M.; Jetti, R. K. R.; Griesser, U. J.; Schütz, J.; Kristeva, E.; Wurst, K.; Schottenberger, H. Lattice Architecture and Hydrogen-Bonding Networks ofN-Aminoazolium andN,N‘-Diaminoazolium Chlorides Crystal Growth & Design, 2006, 6, 404 |
4508862 | CIF | C9 H9 N O10 | P -1 | 5.5311; 6.2566; 9.0041 70.187; 76.251; 72.714 | 276.64 | Babu, N. Jagadeesh; Nangia, Ashwini Water-Mediated Multicenter Synthon and Aromatic C−H →N Isostructurality Crystal Growth & Design, 2006, 6, 1753 |
4511617 | CIF | C4 H7 N O3 | P 1 c 1 | 5.6612; 5.1428; 9.5438 90; 93.246; 90 | 277.42 | Cherukuvada, 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 |
4505803 | CIF | C4 H7 O3 S | P -1 | 6.221; 6.566; 7.685 89.78; 79.36; 64.55 | 277.56 | Senthil Kumar, V. S.; Nangia, Ashwini; Katz, Amy K.; Carrell, H. L. Molecular Complexes of Some Mono- and Dicarboxylic Acids withtrans-1,4-Dithiane-1,4-dioxide Crystal Growth & Design, 2002, 2, 313 |
4505805 | CIF | C3 H7 O4 S | P -1 | 6.264; 6.657; 7.613 100.12; 97.09; 114.2 | 278.22 | Senthil Kumar, V. S.; Nangia, Ashwini; Katz, Amy K.; Carrell, H. L. Molecular Complexes of Some Mono- and Dicarboxylic Acids withtrans-1,4-Dithiane-1,4-dioxide Crystal Growth & Design, 2002, 2, 313 |
4504097 | CIF | C7 H5 N | P 1 c 1 | 3.8294; 6.0334; 12.139 90; 96.23; 90 | 278.81 | Thalladi, Venkat R.; Dabros, Marta; Gehrke, Annette; Weiss, Hans-Christoph; Boese, Roland Crystal Engineering with ⋮C−H···N and C−H···N Hydrogen Bonds Crystal Growth & Design, 2007, 7, 598 |
4513623 | CIF | K La Na Nb O5 | P 4/n m m :2 | 5.8135; 5.8135; 8.2804 90; 90; 90 | 279.851 | Liao, J.-H.; Tsai, M.-C. Synthesis and crystal growth of two novel layered structures, Na K La Nb O5 and Na2 K2 Gd4 Nb2 O18, in molten hydroxide salts Crystal Growth and Design, 2002, 2, 83-85 |
4504969 | CIF | C2 H5 N O2 | P 1 21/n 1 | 4.9669; 11.459; 5.4231 90; 114.916; 90 | 279.93 | Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine Crystal Growth & Design, 2005, 5, 1415 |
4504087 | CIF | C6 H10 N2 O2 | P -1 | 6.169; 6.1602; 8.287 80.41; 115.33; 91.15 | 280.21 | Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E. High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam Crystal Growth & Design, 2007, 7, 1115 |
4504615 | CIF | C4 H9 Ni0.5 O4 | P -1 | 4.9139; 6.2914; 9.589 79.652; 78.857; 77.044 | 280.56 | Chen, Jinxi; Ohba, Masaaki; Zhao, Dongyuan; Kaneko, Wakako; Kitagawa, Susumu Polynuclear Core-Based Nickel 1,4-Cyclohexanedicarboxylate Coordination Polymers as Temperature-Dependent Hydrothermal Reaction Products Crystal Growth & Design, 2006, 6, 664 |
4501809 | CIF | O4 Sc V | I 41/a m d :2 | 6.7885; 6.7885; 6.1392 90; 90; 90 | 282.92 | Cong, Hengjiang; Zhang, Huaijin; Yao, Bin; Yu, Wentao; Zhao, Xian; Wang, Jiyang; Zhang, Guangcai ScVO4: Explorations of Novel Crystalline Inorganic Optical Materials in Rare-Earth Orthovanadate Systems Crystal Growth & Design, 2010, 10, 4389 |
4504973 | CIF | C2 H5 N O2 | P 1 21/a 1 | 11.156; 5.8644; 5.3417 90; 125.83; 90 | 283.3 | Dawson, Alice; Allan, David R.; Belmonte, Scott A.; Clark, Stewart J.; David, William I. F.; McGregor, Pamela A.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay Effect of High Pressure on the Crystal Structures of Polymorphs of Glycine Crystal Growth & Design, 2005, 5, 1415 |
4508863 | CIF | C9 H9 N O10 | P -1 | 5.5412; 6.3763; 9.071 110.23; 91.99; 106.39 | 285.38 | Babu, N. Jagadeesh; Nangia, Ashwini Water-Mediated Multicenter Synthon and Aromatic C−H →N Isostructurality Crystal Growth & Design, 2006, 6, 1753 |
4502038 | CIF | Ag3 F3 Mo O3 | P 1 21/n 1 | 5.85; 5.886; 8.295 90; 90.446; 90 | 285.6 | Chamberlain, Julia M.; Albrecht, Thomas A.; Lesage, Julien; Sauvage, Frédéric; Stern, Charlotte L.; Poeppelmeier, Kenneth R. Crystal Growth of Ag3MOxF6−x(M= V,x= 2;M= Mo,x= 3) Crystal Growth & Design, 2010, 10, 4868 |
4501254 | CIF | C8 H8 Co F4 O8 | P -1 | 5.1691; 6.4094; 9.396 72.66; 88.67; 76.9 | 289.09 | Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand Crystal Growth & Design, 2011, 11, 5053 |
4508049 | CIF | C4 H4 Li2 O6 | P 1 21/c 1 | 6.4777; 5.0082; 8.9897 90; 95.679; 90 | 290.21 | H.-M. Yeung, Hamish; Kosa, Monica; Parrinello, Michele; Cheetham, Anthony K. Chiral, Racemic, andMeso-Lithium Tartrate Framework Polymorphs: A Detailed Structural Analysis Crystal Growth & Design, 2013, 13, 3705 |
4501253 | CIF | C8 H8 F4 O8 Zn | P -1 | 5.1941; 6.4197; 9.3841 73.02; 88.35; 76.35 | 290.54 | Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand Crystal Growth & Design, 2011, 11, 5053 |
4518919 | CIF | As4 Cl2 K2 O7 | P 6/m m m | 5.24015; 5.24015; 12.2944 90; 90; 120 | 292.365 | Domański, Mateusz A.; Kraszewski, Karol; Paluch, Piotr; Guńka, Piotr A. Arsenic(III)-oxide Intercalates with Potassium Chloride: Water-Induced Varieties and New Synthesis Methods Crystal Growth & Design, 2021 |
4504086 | CIF | C6 H10 N2 O2 | P -1 | 6.263; 6.2063; 8.412 80.77; 114.69; 91.12 | 292.83 | Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E. High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam Crystal Growth & Design, 2007, 7, 1115 |
4513830 | CIF | C6 H12 O | P 1 21/m 1 | 5.521; 8.3045; 6.716 90; 107.89; 90 | 293 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4511275 | CIF | C8 H5 F | P 1 21 1 | 3.9343; 5.9336; 12.962 90; 98.467; 90 | 299.29 | Ridout, Joe; Price, Louise S.; Howard, Judith A. K.; Probert, Michael R. Polymorphism Arising from Differing Rates of Compression of Liquids Crystal Growth & Design, 2014, 14, 3384 |
4500162 | CIF | C4 H5 Li O6 | P 1 21 1 | 5.0643; 8.3299; 7.4469 90; 107.585; 90 | 299.47 | Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K. Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues Crystal Growth & Design, 2011, 11, 221 |
4512666 | CIF | Co1.478 O9 V3 | P -1 | 7.1792; 8.8975; 4.8117 90.281; 93.692; 102.185 | 299.755 | Drees, Yvo; Agrestini, Stefano; Zaharko, Oksana; Komarek, Alexander Christoph Floating Zone Single Crystal Growth of γ-CoV2O6with Substantially Enhanced Crystal Size and Quality Crystal Growth & Design, 2015, 15, 1168 |
4506743 | CIF | C14 H8 Ag N3 O4 | P -1 | 3.7843; 7.7515; 10.297 92.957; 95.118; 92.835 | 300 | Tao, Tao; Lei, Yan-Hua; Peng, Yu-Xin; Wang, Ying; Huang, Wei; Chen, Zhao-Xu; You, Xiao-Zeng The First Observation of One-Dimensional Naphthalenediimidato-Based Transition-Metal Coordination Polymers: Syntheses, Crystal Structures and Properties Crystal Growth & Design, 2012, 12, 4580 |
4511276 | CIF | C8 H5 F | P 1 21 1 | 7.031; 5.924; 7.441 90; 103.563; 90 | 301.3 | Ridout, Joe; Price, Louise S.; Howard, Judith A. K.; Probert, Michael R. Polymorphism Arising from Differing Rates of Compression of Liquids Crystal Growth & Design, 2014, 14, 3384 |
4505817 | CIF | C12 H12 N2 O6 | P -1 | 6.5698; 6.6864; 6.9614 97.89; 93.11; 93.426 | 301.76 | Luo, Tzy-Jiun M.; Palmore, G. Tayhas R. Engineering Crystalline Architecture with Supramolecular Tapes: Studies on Secondary Donor−Acceptor Interactions in Cocrystals of the Cyclic Dipeptide of Glycine Crystal Growth & Design, 2002, 2, 337 |
4513002 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.0855; 11.8018; 5.46 90; 111.973; 90 | 303.89 | Jiang, Qi; Shtukenberg, Alexander G.; Ward, Michael D.; Hu, Chunhua Non-Topotactic Phase Transformations in Single Crystals of β-Glycine Crystal Growth & Design, 2015, 15, 2568 |
4510938 | CIF | C8 H5 F | P 1 21 1 | 7.0506; 5.932; 7.4848 90; 103.46; 90 | 304.45 | Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R. Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine Crystal Growth & Design, 2011, 11, 3954 |
4504657 | CIF | C4 H6 F N3 O2 | P -1 | 4.1026; 8.2731; 9.9191 110.036; 100.46; 96.71 | 305.14 | Hulme, Ashley T.; Tocher, Derek A. The Discovery of New Crystal Forms of 5-Fluorocytosine Consistent with the Results of Computational Crystal Structure Prediction Crystal Growth & Design, 2006, 6, 481-487 |
4513280 | CIF | As2 O3 | P 1 21/n 1 | 7.9216; 4.50673; 8.7646 90; 102.548; 90 | 305.43 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4513299 | CIF | As2 O3 | P 1 21/n 1 | 7.9307; 4.51054; 8.783 90; 102.53; 90 | 306.7 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4510939 | CIF | C8 H5 F | P 1 21 1 | 3.868; 5.941; 13.486 90; 98.089; 90 | 306.8 | Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R. Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine Crystal Growth & Design, 2011, 11, 3954 |
4516500 | CIF | C6 H4 Li2 O4 | P 1 21/c 1 | 7.763; 5.0161; 8.7526 90; 115.232; 90 | 308.31 | Kole, Goutam Kumar; Chanthapally, Anjana; Tan, Geok Kheng; Vittal, Jagadese J. Solid State Packing and Photoreactivity of Alkali Metal Salts oftrans,trans-Muconate Crystal Growth & Design, 2015, 15, 5555 |
4510649 | CIF | C6 H12 Cl2 N10 | P -1 | 6.18; 7.077; 7.501 71.746; 82.23; 84.99 | 308.34 | Centore, Roberto; Causà, Mauro; Fusco, Sandra; Carella, Antonio Short π-Stacking in N-Rich Ionic Aromatic Compounds Crystal Growth & Design, 2013, 13, 3255 |
4511618 | CIF | C14 H14 N2 O4 | P -1 | 5.4131; 6.0085; 9.9526 87.699; 84.94; 73.561 | 309.22 | Cherukuvada, 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 |
4510651 | CIF | C6 H12 Cl2 N10 | P -1 | 6.253; 7.102; 7.458 71.638; 82.203; 84.028 | 310.77 | Centore, Roberto; Causà, Mauro; Fusco, Sandra; Carella, Antonio Short π-Stacking in N-Rich Ionic Aromatic Compounds Crystal Growth & Design, 2013, 13, 3255 |
4504850 | CIF | C6 H12 Mn N8 O4 | P -1 | 5.6867; 7.7266; 7.7669 66.61; 85.83; 88.36 | 312.4 | Sun, Hao-Ling; Gao, Song; Ma, Bao-Qing; Su, Gang; Batten, Stuart R. Structures and Magnetism of a Series Mn(II) Coordination Polymers Containing Pyrazine-Dioxide Derivatives and Different Anions Crystal Growth & Design, 2005, 5, 269 |
4510494 | CIF | C8 H14 Na2 O12 | P -1 | 6.1351; 6.3115; 9.1906 95.537; 96.302; 116.231 | 313.07 | Chanthapally, 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 |
4500165 | CIF | C4 H4 Li2 O6 | P 1 21/c 1 | 6.0522; 5.3351; 9.8636 90; 100.474; 90 | 313.18 | Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K. Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues Crystal Growth & Design, 2011, 11, 221 |
4504085 | CIF | C6 H10 N2 O2 | P -1 | 6.3903; 6.2932; 8.645 81.106; 113.68; 91.295 | 314.26 | Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E. High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam Crystal Growth & Design, 2007, 7, 1115 |
4513279 | CIF | As2 O3 | P 1 21/n 1 | 7.9615; 4.53586; 8.911 90; 102.155; 90 | 314.58 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4513000 | CIF | C2 H5 N O2 | P 1 21/n 1 | 5.124; 12.042; 5.496 90; 111.647; 90 | 315.2 | Jiang, Qi; Shtukenberg, Alexander G.; Ward, Michael D.; Hu, Chunhua Non-Topotactic Phase Transformations in Single Crystals of β-Glycine Crystal Growth & Design, 2015, 15, 2568 |
4513031 | CIF | C4 H11 N2 O2 | P -1 | 5.1601; 7.4276; 8.5686 81.465; 86.299; 78.209 | 317.72 | Zhou, Yating; Guo, Fang; Hughes, Colan E.; Browne, Duncan L.; Peskett, Thomas R.; Harris, Kenneth D. M. Discovery of New Metastable Polymorphs in a Family of Urea Co-Crystals by Solid-State Mechanochemistry Crystal Growth & Design, 2015, 15, 2901 |
4513829 | CIF | C6 H12 O | P 1 21/m 1 | 5.684; 8.567; 6.8598 90; 107.97; 90 | 317.74 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4505818 | CIF | C12 H10 Cl2 N2 O6 | P -1 | 6.6393; 6.9913; 7.0627 100.371; 97.433; 92.838 | 318.87 | Luo, Tzy-Jiun M.; Palmore, G. Tayhas R. Engineering Crystalline Architecture with Supramolecular Tapes: Studies on Secondary Donor−Acceptor Interactions in Cocrystals of the Cyclic Dipeptide of Glycine Crystal Growth & Design, 2002, 2, 337 |
4510495 | CIF | C8 H14 Na2 O12 | P -1 | 6.1285; 7.7676; 8.0964 115.7; 101.316; 103.008 | 318.87 | Chanthapally, 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 |
4513278 | CIF | As2 O3 | P 1 21/n 1 | 7.9853; 4.55112; 9 90; 102.014; 90 | 319.91 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4500647 | CIF | C6 H2 Cl2 O2 | P 1 21/c 1 | 6.0187; 5.3451; 9.9651 90; 92.604; 90 | 320.25 | Hathwar, Venkatesha R.; Gonnade, Rajesh G.; Munshi, Parthapratim; Bhadbhade, Mohan M.; Guru Row, Tayur N. Halogen Bonding in 2,5-Dichloro-1,4-benzoquinone: Insights from Experimental and Theoretical Charge Density Analysis Crystal Growth & Design, 2011, 11, 1855 |
4506726 | CIF | C5 H6 N2 O2 S | P -1 | 4.9893; 7.0628; 9.7308 108.25; 94.716; 96.499 | 321.03 | Akiri, Kalyanachakravarthi; Cherukuvada, Suryanarayan; Rana, Soumendra; Nangia, Ashwini Crystal Structures of Pyridine Sulfonamides and Sulfonic Acids Crystal Growth & Design, 2012, 12, 4567 |
4505016 | CIF | C6 H11 N O2 | P -1 | 5.123; 6.374; 10.931 97.9; 99.08; 110.49 | 322.93 | Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs. Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers Crystal Growth & Design, 2005, 5, 773 |
4510650 | CIF | C8 H14 Cl2 N10 | P -1 | 6.496; 7.198; 8.464 99.4; 105.66; 116.19 | 323.16 | Centore, Roberto; Causà, Mauro; Fusco, Sandra; Carella, Antonio Short π-Stacking in N-Rich Ionic Aromatic Compounds Crystal Growth & Design, 2013, 13, 3255 |
4509073 | CIF | C4 H8 N2 Ni O4 | C 1 2/m 1 | 7.571; 8.345; 5.397 90; 108.185; 90 | 324 | Keene, Tony D.; Hursthouse, Michael B.; Price, Daniel J. Two-Dimensional Metal−Organic Frameworks: A System with Competing Chelating Ligands Crystal Growth & Design, 2009, 9, 2604 |
4513831 | CIF | C6 H12 O | P 1 21/m 1 | 5.678; 8.6234; 6.9697 90; 108.215; 90 | 324.16 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4512622 | CIF | C4 H12 I4 N2 | P -1 | 6.5186; 7.495; 8.1312 64.635; 68.06; 69.507 | 324.3 | Bujak, Maciej Efficient Diffusion-Controlled Ligand Exchange Crystal Growth of Isostructural Inorganic‒Organic Halogenidorhodates(III): The Missing Hexaiodidorhodate(III) Anion Crystal Growth & Design, 2015, 15, 1295 |
4506959 | CIF | As2 O3 | P 1 21/n 1 | 8.0013; 4.5675; 9.0794 90; 101.639; 90 | 324.99 | Guńka, Piotr A.; Dranka, Maciej; Piechota, Jacek; Żukowska, Grażyna Z.; Zalewska, Aldona; Zachara, Janusz As2O3Polymorphs: Theoretical Insight into Their Stability and Ammonia Templated Claudetite II Crystallization Crystal Growth & Design, 2012, 12, 5663 |
4504481 | CIF | C6 H6 N2 O4 | P 1 21/c 1 | 4.202; 8.122; 9.67 90; 99.91; 90 | 325.1 | Akutagawa, Tomoyuki; Nakamura, Takayoshi Crystal and Electronic Structures of Hydrogen-Bonded 2,5-Diamino-3,6-dihydroxy-p-benzoquinone Crystal Growth & Design, 2006, 6, 70 |
4504084 | CIF | C6 H10 N2 O2 | P -1 | 6.442; 6.353; 8.737 81.43; 112.88; 91.38 | 325.53 | Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E. High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam Crystal Growth & Design, 2007, 7, 1115 |
4513832 | CIF | C6 H12 O | P 1 21/m 1 | 5.694; 8.6422; 6.977 90; 108.275; 90 | 326.01 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4513833 | CIF | C6 H12 O | P 1 21/m 1 | 5.6991; 8.6352; 6.9739 90; 108.17; 90 | 326.09 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4506960 | CIF | As2 O3 | P 1 21/n 1 | 8.0131; 4.5717; 9.1154 90; 101.831; 90 | 326.84 | Guńka, Piotr A.; Dranka, Maciej; Piechota, Jacek; Żukowska, Grażyna Z.; Zalewska, Aldona; Zachara, Janusz As2O3Polymorphs: Theoretical Insight into Their Stability and Ammonia Templated Claudetite II Crystallization Crystal Growth & Design, 2012, 12, 5663 |
4510653 | CIF | C8 H14 Cl2 N10 | P -1 | 6.505; 7.299; 8.451 99.413; 105.548; 116.344 | 327.35 | Centore, Roberto; Causà, Mauro; Fusco, Sandra; Carella, Antonio Short π-Stacking in N-Rich Ionic Aromatic Compounds Crystal Growth & Design, 2013, 13, 3255 |
4504826 | CIF | C H N S | P -1 | 5.8571; 7.0475; 8.7999 102.99; 92.874; 110.47 | 328.28 | Guo, Fang; Cheung, Eugene Y.; Harris, Kenneth D. M.; Pedireddi, V. R. Contrasting Solid-State Structures of Trithiocyanuric Acid and Cyanuric Acid Crystal Growth & Design, 2006, 6, 846 |
4505109 | CIF | C10 H12 O4 S4 | P -1 | 5.2784; 6.7945; 10.313 70.89; 87.74; 70.57 | 328.58 | Perruchas, Sandrine; Boubekeur, Kamal; Batail, Patrick Hydrogen Bonds in Radical Cation Salts of TTF(CH2OH)4: First Complete Series with the Octahedral Rhenium Cluster Anions [Re6S8-nCl6+n]n-4(n= 0, 1, 2, 3) Crystal Growth & Design, 2005, 5, 1585 |
4513277 | CIF | As2 O3 | P 1 21/n 1 | 8.0256; 4.57553; 9.142 90; 101.666; 90 | 328.77 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4501007 | CIF | C2 H8 Cl N5 O | P -1 | 6.183; 6.205; 8.795 83.75; 78.82; 86.52 | 328.78 | Naik, Anil D.; Tinant, Bernard; Léonard, Alexandre; Marchand-Brynaert, Jacqueline; Su, Bao-Lian; Garcia, Yann (Di)-aminoguanidine Functionalization through Transamination: An Avenue to an Auspicious Class of Supramolecular Synthons Crystal Growth & Design, 2011, 11, 4034 |
4513300 | CIF | As2 O3 | P 1 21/n 1 | 8.029; 4.57732; 9.141 90; 101.65; 90 | 329.02 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4511285 | CIF | I2 | C m c e | 7.1589; 4.6915; 9.8014 90; 90; 90 | 329.19 | Bertolotti, Federica; Shishkina, Anastasia V.; Forni, Alessandra; Gervasio, Giuliana; Stash, Adam I.; Tsirelson, Vladimir G. Intermolecular Bonding Features in Solid Iodine Crystal Growth & Design, 2014, 14, 3587 |
4513834 | CIF | C6 H12 O | P 1 21/m 1 | 5.725; 8.6801; 6.9895 90; 108.21; 90 | 329.94 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4509074 | CIF | C4 H8 Co N2 O4 | C 1 2/m 1 | 7.6483; 8.299; 5.4943 90; 108.586; 90 | 330.55 | Keene, Tony D.; Hursthouse, Michael B.; Price, Daniel J. Two-Dimensional Metal−Organic Frameworks: A System with Competing Chelating Ligands Crystal Growth & Design, 2009, 9, 2604 |
4500479 | CIF | C7 H4 Cl F O2 | P -1 | 3.7321; 7.7308; 12.0995 77.092; 85.07; 76.459 | 330.607 | Hathwar, Venkatesha R.; Guru Row, Tayur N. Charge Density Analysis of Heterohalogen (Cl···F) and Homohalogen (F···F) Intermolecular Interactions in Molecular Crystals: Importance of the Extent of Polarizability Crystal Growth & Design, 2011, 11, 1338 |
4508289 | CIF | C4 H4 I2 | P -1 | 4.4077; 5.8495; 12.9648 90.061; 92.99; 97.233 | 331.15 | Lashua, Amanda F.; Smith, Tiffany M.; Hu, Hegui; Wei, Lihui; Allis, Damian G.; Sponsler, Michael B.; Hudson, Bruce S. Commensurate Urea Inclusion Crystals with the Guest (E,E)-1,4-Diiodo-1,3-Butadiene Crystal Growth & Design, 2013, 13, 3852 |
4508642 | CIF | C10 H8 Cl4 N2 Pd | P -1 | 3.9039; 7.6551; 11.74 106.368; 90.135; 98.92 | 332.16 | Zordan, Fiorenzo; Brammer, Lee M−X···X‘−C Halogen-Bonded Network Formation in MX2(4-halopyridine)2Complexes (M = Pd, Pt; X = Cl, I; X‘ = Cl, Br, I) Crystal Growth & Design, 2006, 6, 1374 |
4511671 | CIF | La Na O8 W2 | I 41/a :2 | 5.349; 5.349; 11.628 90; 90; 90 | 332.698 | Wang, Zijun; Zhong, Jiuping; Jiang, Haoxing; Wang, Jing; Liang, Hongbin Controllable Synthesis of NaLu(WO4)2:Eu3+Microcrystal and Luminescence Properties for LEDs Crystal Growth & Design, 2014, 14, 3767 |
4504851 | CIF | C10 H8 Mn N8 O2 | P -1 | 6.5035; 7.287; 7.5566 70.18; 80.994; 86.808 | 332.75 | Sun, Hao-Ling; Gao, Song; Ma, Bao-Qing; Su, Gang; Batten, Stuart R. Structures and Magnetism of a Series Mn(II) Coordination Polymers Containing Pyrazine-Dioxide Derivatives and Different Anions Crystal Growth & Design, 2005, 5, 269 |
4512926 | CIF | C3 H4 Cu2 N4 S | P 1 21 1 | 3.6697; 12.7871; 7.1036 90; 93.258; 90 | 332.8 | Grifasi, Francesca; Chierotti, Michele R.; Garino, Claudio; Gobetto, Roberto; Priola, Emanuele; Diana, Eliano; Turci, Francesco Solvent-Free Synthesis of Luminescent Copper(I) Coordination Polymers with Thiourea Derivatives Crystal Growth & Design, 2015, 15, 2929 |
4513835 | CIF | C6 H12 O | P 1 21/m 1 | 5.7409; 8.7209; 7.0062 90; 108.314; 90 | 333 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4507100 | CIF | C7 H7 N O2 | P 1 21 1 | 7.91; 5.274; 8.451 90; 108.78; 90 | 333.78 | Tothadi, Srinu; Desiraju, Gautam R. Synthon Modularity in 4-Hydroxybenzamide‒Dicarboxylic Acid Cocrystals Crystal Growth & Design, 2012, 12, 6188 |
4504083 | CIF | C6 H10 N2 O2 | P -1 | 6.321; 6.5597; 8.38 79.82; 102.34; 90.94 | 334 | Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E. High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam Crystal Growth & Design, 2007, 7, 1115 |
4500780 | CIF | C6 H10 N2 O2 | P -1 | 6.353; 6.5278; 8.3716 80.297; 78.226; 89.048 | 334.956 | Chambrier, Marie-Hélène; Bouhmaida, Nouzha; Bonhomme, François; Lebègue, Sébastien; Gillet, Jean-Michel; Jelsch, Christian; Ghermani, Nour Eddine Electron and Electrostatic Properties of Three Crystal Forms of Piracetam Crystal Growth & Design, 2011, 11, 2528 |
4513836 | CIF | C6 H12 O | P 1 21/m 1 | 5.7643; 8.7576; 7.0178 90; 108.25; 90 | 336.45 | Sobczak, Szymon; Katrusiak, Andrzej Singularities in Molecular Conformation Crystal Growth & Design, 2015, 15, 5530-5534 |
4506088 | CIF | C7 H3 Cl F2 O | P -1 | 6.8606; 7.1974; 8.0394 94.604; 104.285; 115.92 | 337.84 | Dikundwar, Amol G.; Row, Tayur N. Guru Evidence for the “Amphoteric” Nature of Fluorine in Halogen Bonds: An Instance of Cl···F Contact Crystal Growth & Design, 2012, 12, 1713 |
4500433 | CIF | C8 H8 O2 | P -1 | 7.2832; 7.4255; 7.81 96.067; 108.353; 117.701 | 338.6 | Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R. Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering Crystal Growth & Design, 2011, 11, 616 |
4508640 | CIF | C10 H8 Cl4 N2 Pt | P -1 | 5.3827; 6.9293; 9.4909 75.219; 83.95; 83.355 | 338.918 | Zordan, Fiorenzo; Brammer, Lee M−X···X‘−C Halogen-Bonded Network Formation in MX2(4-halopyridine)2Complexes (M = Pd, Pt; X = Cl, I; X‘ = Cl, Br, I) Crystal Growth & Design, 2006, 6, 1374 |
4512183 | CIF | C6 H4 B F3 O2 | P -1 | 4.3762; 5.0241; 15.6401 96.483; 94.143; 92.835 | 340.2 | Madura, Izabela D.; Czerwińska, Karolina; Sołdańska, Dominika Hydrogen-Bonded Dimeric Synthon of Fluoro-Substituted Phenylboronic Acids versus Supramolecular Organization in Crystals Crystal Growth & Design, 2014, 14, 5912 |
4512563 | CIF | O5 Ti3 | I 1 2/c 1 | 9.9695; 5.0739; 7.1817 90; 109.863; 90 | 341.67 | Tanaka, Kenji; Nasu, Tomomichi; Miyamoto, Yasuto; Ozaki, Noriaki; Tanaka, Shu; Nagata, Toshiaki; Hakoe, Fumiyoshi; Yoshikiyo, Marie; Nakagawa, Kosuke; Umeta, Yoshikazu; Imoto, Kenta; Tokoro, Hiroko; Namai, Asuka; Ohkoshi, Shin-ichi Structural Phase Transition between γ-Ti3O5and δ-Ti3O5by Breaking of a One-Dimensionally Conducting Pathway Crystal Growth & Design, 2015, 15, 653 |
4509504 | CIF | C6 H8 Cl6 Cu2 N4 | P -1 | 3.878; 9.271; 10.716 112.27; 95.9; 101.7 | 342.2 | Boldog, Ishtvan; Daran, Jean-Claude; Chernega, Alexander N.; Rusanov, Eduard B.; Krautscheid, Harald; Domasevitch, Konstantin V. Hydrogen Bonding Patterns and Supramolecular Structure of 4,4′-Bipyrazolium Salts Crystal Growth & Design, 2009, 9, 2895 |
4512562 | CIF | O10 Ti6 | P 1 2/a 1 | 9.9651; 5.0604; 7.2114 90; 109.332; 90 | 343.15 | Tanaka, Kenji; Nasu, Tomomichi; Miyamoto, Yasuto; Ozaki, Noriaki; Tanaka, Shu; Nagata, Toshiaki; Hakoe, Fumiyoshi; Yoshikiyo, Marie; Nakagawa, Kosuke; Umeta, Yoshikazu; Imoto, Kenta; Tokoro, Hiroko; Namai, Asuka; Ohkoshi, Shin-ichi Structural Phase Transition between γ-Ti3O5and δ-Ti3O5by Breaking of a One-Dimensionally Conducting Pathway Crystal Growth & Design, 2015, 15, 653 |
4511352 | CIF | C14 H10 Cl2 N2 O2 | P -1 | 4.8124; 6.1524; 11.728 88.794; 81.757; 88.045 | 343.41 | Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study Crystal Growth & Design, 2007, 7, 1490 |
4508010 | CIF | C6 H10 O4 | P 1 21/c 1 | 7.1786; 5.1373; 9.989 90; 110.829; 90 | 344.31 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4508806 | CIF | C8 H6 F N O | P 1 21 1 | 4.3901; 7.1531; 11.0189 90; 92.88; 90 | 345.59 | Day, Graeme M.; Motherwell, W. D. Sam An Experiment in Crystal Structure Prediction by Popular Vote Crystal Growth & Design, 2006, 6, 1985 |
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 |
4501923 | CIF | C18 H10 N2 | P -1 | 7.2929; 7.4845; 8.1946 114.232; 92.292; 117.493 | 346.96 | Bosch, Eric Role of sp-C−H—N Hydrogen Bonding in Crystal Engineering Crystal Growth & Design, 2010, 10, 3808 |
4512517 | CIF | C8 H11 N | P 1 21 1 | 5.1685; 5.5274; 12.422 90; 100.871; 90 | 348.51 | Bąk, Joanna M.; Gajda, Roman; Woźniak, Krzysztof New High Pressure Crystal Structures of 2,2-Dimethylbutane and 2,3-Dimethylaniline: Combined X-ray, Raman, and Theoretical Studies Crystal Growth & Design, 2015, 15, 45 |
4508011 | CIF | C6 H10 O4 | P 1 21/c 1 | 7.2316; 5.1523; 10.033 90; 111.12; 90 | 348.71 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4508012 | CIF | C6 H10 O4 | P 1 21/c 1 | 7.2613; 5.1409; 10.05 90; 111.554; 90 | 348.93 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4508643 | CIF | C10 H8 Br2 Cl2 N2 Pd | P -1 | 5.4648; 6.96; 9.5925 75.117; 84.477; 84.631 | 350.07 | Zordan, Fiorenzo; Brammer, Lee M−X···X‘−C Halogen-Bonded Network Formation in MX2(4-halopyridine)2Complexes (M = Pd, Pt; X = Cl, I; X‘ = Cl, Br, I) Crystal Growth & Design, 2006, 6, 1374 |
4503129 | CIF | C4 H10 N4 O2 | P -1 | 5.112; 7.944; 9.247 85.623; 74.924; 75.352 | 350.8 | Deutsch, Zvicka; Bernstein, Joel Cocrystal of Urea and Imidazolidone: Formation of an Unexpected 1-D Substructure in a Plausibly Predictable Cocrystal Crystal Growth & Design, 2008, 8, 3537 |
4503486 | CIF | C5 H4 Cl Cu2 N S | P 1 c 1 | 3.916; 7.8372; 11.4705 90; 93.215; 90 | 351.48 | Hao, Zheng-Ming; Zhang, Xian-Ming Phosphorescent Acentric Cuprous Halide Coordination Polymers for Nolinear Optical Materials Crystal Growth & Design, 2008, 8, 2359 |
4505869 | CIF | C16 H14 N2 O4 | P -1 | 3.829; 9.128; 10.841 107.16; 99.61; 95.86 | 352.32 | Tsaggeos, Kostas; Masiera, Natalia; Niwicka, Aleksandra; Dokorou, Vassiliki; Siskos, Michael G.; Skoulika, Stavroula; Michaelides, Adonis Crystal Structure, Thermal Behavior, and Photochemical Reactivity of a Series of Co-Crystals oftrans-1,2-Bis(4-pyridyl) Ethylene with Dicarboxylic Acids Crystal Growth & Design, 2012, 12, 2187 |
4508013 | CIF | C6 H10 O4 | P 1 21/c 1 | 7.3313; 5.1522; 10.104 90; 111.937; 90 | 354.02 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4506790 | CIF | C14 H8 N2 O6 U | P -1 | 5.1366; 5.6106; 12.944 95.95; 90.627; 107.037 | 354.41 | Mihalcea, Ionut; Henry, Natacha; Bousquet, Till; Volkringer, Christophe; Loiseau, Thierry Six-Fold Coordinated Uranyl Cations in Extended Coordination Polymers Crystal Growth & Design, 2012, 12, 4641 |
4516551 | CIF | C10 H12 Cl2 Cu N4 O4 | P -1 | 5.0783; 7.5176; 9.9479 73.15; 83.485; 77.841 | 354.76 | Carlotto, Silvia; Casarin, Maurizio; Lanza, Arianna; Nestola, Fabrizio; Pandolfo, Luciano; Pettinari, Claudio; Scatena, Rebecca Reaction of Copper(II) Chloroacetate with Pyrazole. Synthesis of a One-Dimensional Coordination Polymer and Unexpected Dehydrochlorination Reaction Crystal Growth & Design, 2015, 15, 5910 |
4508014 | CIF | C6 H10 O4 | P 1 21/c 1 | 7.3738; 5.152; 10.151 90; 112.42; 90 | 356.49 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4502585 | CIF | C6 H8 N3 O3 | P -1 | 3.8268; 6.535; 14.294 90.535; 91.6; 92.703 | 356.909 | Lee, Tu; Wang, Pu Yun Screening, Manufacturing, Photoluminescence, and Molecular Recognition of Co-Crystals: Cytosine with Dicarboxylic Acids Crystal Growth & Design, 2010, 10, 1419 |
4501604 | CIF | C6 H13 N O2 | P -1 | 13.9853; 5.3995; 5.154 111.471; 96.76; 86.579 | 359.6 | Iwama, Sekai; Horiguchi, Masahiro; Sato, Hiroyasu; Uchida, Yoshiaki; Takahashi, Hiroki; Tsue, Hirohito; Tamura, Rui Observation of the Preferential Enrichment Phenomenon for Essential α-Amino Acids with a Racemic Crystal Structure Crystal Growth & Design, 2010, 10, 2668 |
4503037 | CIF | C5 H4 Mn N2 O5 | P 1 21 1 | 7.0664; 7.532; 7.645 90; 117.363; 90 | 361.37 | Lu, Wen-Guan; Gu, Jin-Zhong; Jiang, Long; Tan, Min-Yu; Lu, Tong-Bu Achiral and Chiral Coordination Polymers Containing Helical Chains: The Chirality Transfer Between Helical Chains Crystal Growth & Design, 2008, 8, 192 |
4504483 | CIF | Fe2 H Na O8 P2 | P -1 | 5.12; 8.6232; 8.7958 96.93; 100.45; 105.75 | 361.59 | Zhao, Zhi-Feng; Zhou, Bai-Bin; Su, Zhan-Hua; Zhang, Xu; Li, Guang-Hua Synthesis and Characterization of New Open-Framework Iron(II) Phosphate with 1D Tube and Double Layer Structure, NaFe2(PO4)(HPO4) Crystal Growth & Design, 2006, 6, 632 |
4501716 | CIF | C5 H7 B Cl N O2 | P 1 c 1 | 6.1958; 5.3278; 11.3566 90; 105.132; 90 | 361.88 | Campos-Gaxiola, José J.; Vega-Paz, Araceli; Román-Bravo, Perla; Höpfl, Herbert; Sánchez-Vázquez, Mario Pyridineboronic Acids as Useful Building Blocks in Combination with Perchloroplatinate(II) and -(IV) Salts: 1D, 2D, and 3D Hydrogen-Bonded Networks Containing X-H···Cl2Pt−(X = C, N+), B(OH)2···Cl2Pt−, and B(OH)2···(HO)2B Synthons Crystal Growth & Design, 2010, 10, 3182 |
4504595 | CIF | C12 H12 Cl4 N2 Pt | P -1 | 6.811; 7.7102; 7.83 96.32; 110.098; 105.81 | 361.98 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4503058 | CIF | C6 H3 Cl2 N O2 | P -1 | 7.1403; 7.2638; 8.2418 72.781; 70.3; 66.349 | 362.18 | Barnett, Sarah A.; Johnston, Andrea; Florence, Alastair J.; Price, Sarah L.; Tocher, Derek A. A Systematic Experimental and Theoretical Study of the Crystalline State of Six Chloronitrobenzenes Crystal Growth & Design, 2008, 8, 24 |
4501918 | CIF | C7 H10 N2 O2 | P -1 | 6.028; 6.086; 11.003 91.834; 93.626; 115.228 | 363.6 | Chattopadhyay, Basab; Mukherjee, Alok K.; Narendra, N.; Hemantha, H. P.; Sureshbabu, Vommina V.; Helliwell, Madeliene; Mukherjee, Monika Supramolecular Architectures in 5,5′-Substituted Hydantoins: Crystal Structures and Hirshfeld Surface Analyses Crystal Growth & Design, 2010, 10, 4476 |
4504607 | CIF | C12 H12 Cl4 N2 Pd | P -1 | 6.9948; 7.0324; 8.2883 69.202; 74.361; 77.599 | 363.8 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4516363 | CIF | C4 H4 N2 | P 1 21/n 1 | 11.109; 9.2258; 3.555 90; 90.73; 90 | 364.3 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4502443 | CIF | C Ca O3 | R -3 c :H | 4.97577; 4.97577; 16.99207 90; 90; 120 | 364.332 | Zolotoyabko, E.; Caspi, E. N.; Fieramosca, J. S.; Von Dreele, R. B.; Marin, F.; Mor, G.; Addadi, L.; Weiner, S.; Politi, Y. Differences between Bond Lengths in Biogenic and Geological Calcite Crystal Growth & Design, 2010, 10, 1207 |
4503206 | CIF | Ba Mo2 O9 Te | P 1 21 1 | 5.5346; 7.4562; 8.8342 90; 90.897; 90 | 364.517 | Zhang, Weiguo; Tao, Xutang; Zhang, Chengqian; Gao, Zeliang; Zhang, Yongzhuan; Yu, Wentao; Cheng, Xiufeng; Liu, Xuesong; Jiang, Minhua Bulk Growth and Characterization of a Novel Nonlinear Optical Crystal BaTeMo2O9 Crystal Growth & Design, 2008, 8, 304 |
4503531 | CIF | Ga3 O7 P | R 3 m :H | 7.897; 7.897; 6.757 90; 90; 120 | 364.9 | Xu, Guogang; Li, Jing; Wang, Jiyang; Zhao, Hongyang; Liu, Hong Flux Growth and Characterizations of Ga3PO7Single Crystals Crystal Growth & Design, 2008, 8, 3577 |
4503556 | CIF | H3 I2 In O8 | P -1 | 6.7321; 7.5255; 7.6798 100.43; 91.96; 106.64 | 365.09 | Liu, Xiaomin; Li, Guanghua; Hu, Yawei; Yang, Ming; Kong, Xianggui; Shi, Zhan; Feng, Shouhua Hydrothermal Synthesis and Crystal Structure of Polar and Nonpolar Compounds in Indium Iodate Family Crystal Growth & Design, 2008, 8, 2453 |
4504545 | CIF | C18 H14 N4 O2 | P -1 | 5.194; 6.926; 11.034 94.82; 102; 107.64 | 365.37 | Sarkar, Madhushree; Biradha, Kumar Amide-to-Amide Hydrogen Bonds in the Presence of a Pyridine Functionality: Crystal Structures of Bis(pyridinecarboxamido)alkanes Crystal Growth & Design, 2006, 6, 202 |
4503524 | CIF | C8 H8 N2 Na2 O14 U | P -1 | 5.5743; 6.6476; 10.3039 76.091; 87.586; 80.911 | 365.97 | Masci, Bernardo; Thuéry, Pierre Pyrazinetetracarboxylic Acid as an Assembler Ligand in Uranyl−Organic Frameworks Crystal Growth & Design, 2008, 8, 1689 |
4504550 | CIF | C6 H5 Cl2 N Pd0.5 | P -1 | 7.023; 7.092; 8.304 74.409; 68.551; 76.846 | 366.9 | Kumar, D. Krishna; Das, Amitava; Dastidar, Parthasarathi N−H···Cl2−M Synthon as a Structure-Directing Tool: Crystal Structures of Some Perchlorometallates Crystal Growth & Design, 2006, 6, 216 |
4503487 | CIF | C5 H4 Br Cu2 N S | P 1 c 1 | 3.9759; 7.858; 11.773 90; 93.912; 90 | 366.96 | Hao, Zheng-Ming; Zhang, Xian-Ming Phosphorescent Acentric Cuprous Halide Coordination Polymers for Nolinear Optical Materials Crystal Growth & Design, 2008, 8, 2359 |
4502441 | CIF | C Ca O3 | R -3 c :H | 4.987429; 4.987429; 17.05058 90; 90; 120 | 367.302 | Zolotoyabko, E.; Caspi, E. N.; Fieramosca, J. S.; Von Dreele, R. B.; Marin, F.; Mor, G.; Addadi, L.; Weiner, S.; Politi, Y. Differences between Bond Lengths in Biogenic and Geological Calcite Crystal Growth & Design, 2010, 10, 1207 |
4504596 | CIF | C12 H14 Cl4 N2 Pt | P -1 | 7.0701; 7.5429; 8.0694 95.4; 112.432; 107.745 | 367.87 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4511824 | CIF | C6 H7 F N3 O3 | P -1 | 4.9209; 8.6115; 9.4689 72.466; 75.129; 89.747 | 368.64 | da 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 |
4516362 | CIF | C4 H4 N2 | P 1 21/n 1 | 11.171; 9.245; 3.5885 90; 90.39; 90 | 370.6 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4501924 | CIF | C18 H18 N2 | P -1 | 6.1713; 6.2673; 9.912 101.271; 99.198; 90.762 | 370.75 | Bosch, Eric Role of sp-C−H—N Hydrogen Bonding in Crystal Engineering Crystal Growth & Design, 2010, 10, 3808 |
4501315 | CIF | Bi Fe O3 | R 3 c :H | 5.5635; 5.5635; 13.835 90; 90; 120 | 370.86 | Ito, Toshimitsu; Ushiyama, Tomoharu; Yanagisawa, Yuji; Kumai, Reiji; Tomioka, Yasuhide Growth of Highly Insulating Bulk Single Crystals of Multiferroic BiFeO3and Their Inherent Internal Strains in the Domain-Switching Process Crystal Growth & Design, 2011, 11, 5139 |
4505017 | CIF | C7 H13 N O2 | P -1 | 5.16; 6.383; 12.281 95.11; 100.51; 108.97 | 371.29 | Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs. Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers Crystal Growth & Design, 2005, 5, 773 |
4509176 | CIF | C16 H11 O8 Rb | P -1 | 3.7761; 5.7924; 17.0879 95.283; 92.67; 92.126 | 371.44 | Clegg, William; Russo, Luca Synthesis and Structures of Alkali Metal Complexes of Isophthalic Acid: The Interplay of Organic Supramolecular Interactions and Flexible Metal Coordination As Structure-Directing Factors Crystal Growth & Design, 2009, 9, 1158 |
4505051 | CIF | C14 H16 N2 O8 Zn | P -1 | 5.4016; 7.3711; 9.823 86.412; 84.113; 72.99 | 371.81 | Ang, Siau Gek; Sun, Bai Wang Crystal Structure and Characterization of Organic−Inorganic Hybridized Molecules with Molecular Zipper Structures and Two-Dimensional Grid Networks Crystal Growth & Design, 2005, 5, 383 |
4503641 | CIF | C22 H10 O4 | P -1 | 4.6889; 7.3537; 11.0965 98.666; 93.323; 98.592 | 372.73 | Käfer, Daniel; El Helou, Mira; Gemel, Christian; Witte, Gregor Packing of Planar Organic Molecules: Interplay of van der Waals and Electrostatic Interaction Crystal Growth & Design, 2008, 8, 3053 |
4509798 | CIF | C17 H17 N3 O4 | P 1 | 6.6338; 7.6444; 8.6996 113.502; 102.074; 102.532 | 372.77 | Ugono, Onome; Rath, Nigam P.; Beatty, Alica M. Synthesis and Control of Single Layer and Polar 2-D Layered Architectures in a Series of Organic Layered Solids Crystal Growth & Design, 2009, 9, 4595 |
4517760 | CIF | F6 K2 Zr | P 4/n m m :2 | 6.33605; 6.33605; 9.29458 90; 90; 90 | 373.136 | Lubomir Smrcok; Armel Le Bail; Miroslav Boca; Aydar Rakhmatullin Polymorphism of K2ZrF6 Crystal Growth & Design, 2020, 20, 3867-3881 |
4505052 | CIF | C14 H16 Mn N2 O8 | P -1 | 5.4059; 7.2938; 9.9853 86.549; 84.745; 73.427 | 375.53 | Ang, Siau Gek; Sun, Bai Wang Crystal Structure and Characterization of Organic−Inorganic Hybridized Molecules with Molecular Zipper Structures and Two-Dimensional Grid Networks Crystal Growth & Design, 2005, 5, 383 |
4504168 | CIF | C6 H6 B Br O2 | P -1 | 5.01; 7.241; 10.989 103.3; 97.06; 100.52 | 375.7 | Shimpi, Manishkumar R.; SeethaLekshmi, Nanappan; Pedireddi, Venkateswara Rao Supramolecular Architecture in Some 4-Halophenylboronic Acids Crystal Growth & Design, 2007, 7, 1958 |
4511752 | CIF | As K O3 | P 21 21 21 | 13.22953; 4.69411; 6.06453 90; 90; 90 | 376.613 | Stöger, Berthold; Dušek, Michal Complex Polymorphism and Polytypism of Potassium Metaarsenate, KAsO3 Crystal Growth & Design, 2014, 14, 4640 |
4502245 | CIF | C12 H18 N8 O2 | P -1 | 7.4907; 7.5447; 7.9976 99.425; 107.115; 112.865 | 377.66 | Turner, David R.; Batten, Stuart R. Di- and Triammonium Salts of Carbamoyldicyanomethanide, C(CN)2(CONH2)−: Layered Organic Architectures Crystal Growth & Design, 2010, 10, 2501 |
4501920 | CIF | C20 H14 N2 | P -1 | 6.28; 7.4487; 8.7661 81.454; 73.973; 74.081 | 377.83 | Bosch, Eric Role of sp-C−H—N Hydrogen Bonding in Crystal Engineering Crystal Growth & Design, 2010, 10, 3808 |
4507418 | CIF | Cu Ga3 Yb | C 1 2/m 1 | 11.6891; 4.162; 8.3196 90; 110.834; 90 | 378.28 | Subbarao, Udumula; Peter, Sebastian C. Crystal Growth and Properties of YbCuGa3: First Monoclinic System in the RETX3Family Crystal Growth & Design, 2013, 13, 953 |
4508769 | CIF | C6 H12 O6 | P -1 | 6.7176; 6.7638; 8.6217 95.355; 99.686; 98.879 | 378.66 | Day, Graeme M.; van de Streek, Jacco; Bonnet, Arnaud; Burley, Jonathan C.; Jones, William; Motherwell, W. D. Sam Polymorphism of Scyllo-Inositol: Joining Crystal Structure Prediction with Experiment to Elucidate the Structures of Two Polymorphs Crystal Growth & Design, 2006, 6, 2301 |
4513223 | CIF | Cl H4 Na O2 | P 1 21/c 1 | 6.32184; 10.11135; 6.50351 90; 114.252; 90 | 379.031 | Bode, Arno A. C.; Pulles, Paul G. M.; Lutz, Martin; Poulisse, Ward J. M.; Jiang, Shanfeng; Meijer, Jan A. M.; van Enckevort, Willem J. P.; Vlieg, Elias Sodium Chloride Dihydrate Crystals: Morphology, Nucleation, Growth, and Inhibition Crystal Growth & Design, 2015, 15, 3166 |
4508105 | CIF | C18 H6 Mg3 O12 | P -1 | 7.7922; 7.7932; 7.7929 66.135; 66.148; 66.148 | 379.06 | Mazaj, Matjaž; Birsa Čelič, Tadeja; Mali, Gregor; Rangus, Mojca; Kaučič, Venčeslav; Zabukovec Logar, Nataša Control of the Crystallization Process and Structure Dimensionality of Mg‒Benzene‒1,3,5-Tricarboxylates by Tuning Solvent Composition Crystal Growth & Design, 2013, 13, 3825 |
4503642 | CIF | C22 H10 O4 | P -1 | 4.7068; 7.4771; 11.0772 97.875; 93.848; 99.371 | 379.41 | Käfer, Daniel; El Helou, Mira; Gemel, Christian; Witte, Gregor Packing of Planar Organic Molecules: Interplay of van der Waals and Electrostatic Interaction Crystal Growth & Design, 2008, 8, 3053 |
4508251 | CIF | C9 H7 F O2 | P -1 | 3.843; 6.2681; 15.9607 93.547; 96.858; 94.011 | 379.82 | Khoj, Manal A.; Hughes, Colan E.; Harris, Kenneth D. M.; Kariuki, Benson M. Polymorphism in atrans-Cinnamic Acid Derivative Exhibiting Two Distinct β-type Phases: Structural Properties, [2 + 2] Photodimerization Reactions, and Polymorphic Phase Transition Behavior Crystal Growth & Design, 2013, 13, 4110 |
4510577 | CIF | C7 H6 Cl N S | P -1 | 4.042; 5.6966; 16.617 91.143; 95.903; 92.81 | 380.01 | Eccles, Kevin S.; Morrison, Robin E.; Maguire, Anita R.; Lawrence, Simon E. Crystal Landscape of Primary Aromatic Thioamides Crystal Growth & Design, 2014, 14, 2753 |
4502491 | CIF | C2 H5 Cd N3 O5 S | P -1 | 5.5144; 8.0021; 9.2467 78.487; 72.869; 87.2 | 382.06 | Li, Dong-Ping; Zhou, Xin-Hui; Liang, Xiao-Qiang; Li, Cheng-Hui; Chen, Chao; Liu, Jian; You, Xiao-Zeng Novel Structural Diversity of Triazolate-Based Coordination Polymers Generated Solvothermally with Anions Crystal Growth & Design, 2010, 10, 2136 |
4504328 | CIF | C8 H5 O5 Zn | P -1 | 4.7735; 6.7584; 12.087 85.662; 88.264; 82.804 | 385.68 | Wang, Ji-Jiang; Gou, Lei; Hu, Huai-Ming; Han, Zhong-Xi; Li, Dong-Sheng; Xue, Gang-Lin; Yang, Meng-Lin; Shi, Qi-Zhen Ligand and pH-Controlled ZnIIBilayer Coordination Polymers Based on Biphenyl-3,3‘,4,4‘-tetracarboxylate Crystal Growth & Design, 2007, 7, 1514 |
4509177 | CIF | C16 H11 Cs O8 | P -1 | 3.8753; 5.9053; 17.105 96.312; 95.092; 93.743 | 386.42 | Clegg, William; Russo, Luca Synthesis and Structures of Alkali Metal Complexes of Isophthalic Acid: The Interplay of Organic Supramolecular Interactions and Flexible Metal Coordination As Structure-Directing Factors Crystal Growth & Design, 2009, 9, 1158 |
4501174 | CIF | C6 H16 N2 O10 Te2 V2 | P -1 | 6.7486; 7.1572; 8.687 69.818; 80.019; 85.524 | 387.79 | Smith, Matthew D.; Blau, Samuel M.; Chang, Kelvin B.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J. Beyond Charge Density Matching: The Role of C‒H···O Interactions in the Formation of Templated Vanadium Tellurites Crystal Growth & Design, 2011, 11, 4213 |
4506172 | CIF | C7 H4 N3 O Tl | P -1 | 3.7364; 9.365; 12.156 68.14; 86.965; 79.763 | 388.45 | Marcano, Daniela; Gerasimchuk, Nikolay; Nemykin, Victor; Silchenko, Svitlana Synthesis, Characterization, and Studies of Coordination-Polymeres With Isomeric Pyridylcyanoximes: Route to Metal Ribbons With Very Short Tl···Tl Separations Crystal Growth & Design, 2012, 12, 2877 |
4516309 | CIF | C19 H16 N2 O4 | P 1 | 3.811; 10.342; 10.844 65.84; 85.83; 89.45 | 388.8 | Varughese, Sunil; Hoser, Anna A.; Jarzembska, Katarzyna N.; Pedireddi, V. R.; Woźniak, Krzysztof Positional Isomerism and Conformational Flexibility Directed Structural Variations in the Molecular Complexes of Dihydroxybenzoic Acids Crystal Growth & Design, 2015, 15, 3832 |
4507702 | CIF | C7 H3 Bi N O5 | P -1 | 7.2623; 7.5389; 8.1125 97.699; 101.048; 113.21 | 389.69 | Sushrutha, S. R.; Natarajan, Srinivasan Bismuth Carboxylates with Brucite- and Fluorite-Related Structures: Synthesis Structure and Properties Crystal Growth & Design, 2013, 13, 1743 |
4507669 | CIF | C6 H13 N O3 | P -1 | 5.8197; 7.382; 9.6242 82.784; 75.451; 79.003 | 391.54 | Kelley, Steven P.; Narita, Asako; Holbrey, John D.; Green, Keith D.; Reichert, W. Matthew; Rogers, Robin D. Understanding the Effects of Ionicity in Salts, Solvates, Co-Crystals, Ionic Co-Crystals, and Ionic Liquids, Rather than Nomenclature, Is Critical to Understanding Their Behavior Crystal Growth & Design, 2013, 13, 965 |
4511699 | CIF | Cd O5 S | P 1 21/n 1 | 7.6262; 7.4531; 7.6295 90; 115.423; 90 | 391.66 | Mobin, 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 |
4509674 | CIF | C16 H14 I N3 O2 | P 1 | 4.1191; 7.3004; 13.126 95.669; 90.19; 92.231 | 392.47 | Zhu, Yuan-Yuan; Wang, Gui-Tao; Wang, Ren-Xiao; Li, Zhan-Ting Intramolecular Six-Membered and Three-Center C−H···O Hydrogen Bonding in 1,4-Diphenyl-1,2,3-Triazoles Crystal Growth & Design, 2009, 9, 4778 |
4500782 | CIF | C6 H12 N2 O3 | P -1 | 6.9234; 7.4453; 9.0909 97.948; 103.971; 115.797 | 393.225 | Chambrier, Marie-Hélène; Bouhmaida, Nouzha; Bonhomme, François; Lebègue, Sébastien; Gillet, Jean-Michel; Jelsch, Christian; Ghermani, Nour Eddine Electron and Electrostatic Properties of Three Crystal Forms of Piracetam Crystal Growth & Design, 2011, 11, 2528 |
4505867 | CIF | C18 H16 N2 O4 | P -1 | 5.741; 8.219; 8.838 83.59; 75.06; 80.87 | 396.73 | Tsaggeos, Kostas; Masiera, Natalia; Niwicka, Aleksandra; Dokorou, Vassiliki; Siskos, Michael G.; Skoulika, Stavroula; Michaelides, Adonis Crystal Structure, Thermal Behavior, and Photochemical Reactivity of a Series of Co-Crystals oftrans-1,2-Bis(4-pyridyl) Ethylene with Dicarboxylic Acids Crystal Growth & Design, 2012, 12, 2187 |
4510497 | CIF | C8 H16 Ba2 O14 | P -1 | 6.419; 7.9361; 8.911 103.757; 104.137; 106.945 | 397.04 | Chanthapally, 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 |
4510539 | CIF | C7 H9 N3 O2 | P -1 | 6.4717; 7.9214; 8.6745 72.412; 86.116; 69.625 | 397.04 | Mazur, 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 |
4516359 | CIF | C4 H4 N2 | P n a 21 | 11.443; 9.437; 3.682 90; 90; 90 | 397.6 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516358 | CIF | C4 H4 N2 | P n a 21 | 11.463; 9.445; 3.6821 90; 90; 90 | 398.65 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4508851 | CIF | C14 H16 Cl2 Pd S2 | P -1 | 6.8454; 7.9258; 8.5633 87.86; 71.44; 65.78 | 399.33 | Vigo, Ludmila; Risto, Maarit; Jahr, Esther M.; Bajorek, Tom; Oilunkaniemi, Raija; Laitinen, Risto S.; Lahtinen, Manu; Ahlgrén, Markku Isomerism in [MCl2(ERR‘)2] (M = Pd, Pt; E = S, Se; R, R‘ = Me, Ph) Crystal Growth & Design, 2006, 6, 2376 |
4514126 | CIF | C4 H9 Na O7 | P -1 | 5.939; 6.2687; 11.247 103.95; 91.49; 99.82 | 399.43 | Malaspina, Lorraine A.; Edwards, Alison J.; Woińska, Magdalena; Jayatilaka, Dylan; Turner, Michael J.; Price, Jason R.; Herbst-Irmer, Regine; Sugimoto, Kunihisa; Nishibori, Eiji; Grabowsky, Simon Predicting the Position of the Hydrogen Atom in the Short Intramolecular Hydrogen Bond of the Hydrogen Maleate Anion from Geometric Correlations Crystal Growth & Design, 2017, 17, 3812 |
4508852 | CIF | C14 H16 Cl2 Pt S2 | P -1 | 6.7442; 7.9469; 8.6745 88.079; 71.727; 65.806 | 400.264 | Vigo, Ludmila; Risto, Maarit; Jahr, Esther M.; Bajorek, Tom; Oilunkaniemi, Raija; Laitinen, Risto S.; Lahtinen, Manu; Ahlgrén, Markku Isomerism in [MCl2(ERR‘)2] (M = Pd, Pt; E = S, Se; R, R‘ = Me, Ph) Crystal Growth & Design, 2006, 6, 2376 |
4511325 | CIF | C9 H11 N O2 | P -1 | 6.605; 7.872; 8.47 87.15; 84.31; 67.09 | 403.6 | Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C. Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment Crystal Growth & Design, 2007, 7, 531 |
4503810 | CIF | C5 H9 Cu N2 O5 | P -1 | 7.2921; 7.5161; 7.6282 88.9; 78.627; 80.188 | 403.84 | Karabach, Yauhen Y.; Kirillov, Alexander M.; Haukka, Matti; Sanchiz, Joaquin; Kopylovich, Maximilian N.; Pombeiro, Armando J. L. Multicopper(II) Pyromellitate Compounds: Self-Assembly Synthesis, Structural Topologies, and Magnetic Features Crystal Growth & Design, 2008, 8, 4100 |
4505018 | CIF | C8 H15 N O2 | P -1 | 5.134; 6.317; 13.468 101.5; 96.17; 106.25 | 404.68 | Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs. Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers Crystal Growth & Design, 2005, 5, 773 |
4500429 | CIF | C9 H9 N O3 | P -1 | 5.0255; 6.8219; 12.196 89.254; 80.804; 79.282 | 405.49 | Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R. Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering Crystal Growth & Design, 2011, 11, 616 |
4504600 | CIF | C12 H10 Cl4 N2 O4 Pt | P -1 | 7.1544; 7.5492; 8.2906 90.43; 114.88; 92.75 | 405.56 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4512919 | CIF | C10 H14 B2 Cl4 Mn N2 O4 | P -1 | 3.7276; 7.8853; 14.104 84.92; 82.68; 81.8 | 405.93 | Yahsi, Yasemin; Gungor, Elif; Kara, Hulya Chlorometallate-Pyridinium Boronic Acid Salts for Crystal Engineering: Synthesis of One-, Two-, and Three-Dimensional Hydrogen Bond Networks Crystal Growth & Design, 2015, 15, 2652 |
4500431 | CIF | C9 H9 N O3 | P -1 | 5.0299; 6.831; 12.1945 89.227; 80.846; 79.318 | 406.43 | Hathwar, Venkatesha R.; Thakur, Tejender S.; Row, Tayur N. Guru; Desiraju, Gautam R. Transferability of Multipole Charge Density Parameters for Supramolecular Synthons: A New Tool for Quantitative Crystal Engineering Crystal Growth & Design, 2011, 11, 616 |
4503818 | CIF | C9 H8 N O3 | P -1 | 5.942; 6.818; 10.638 102.963; 97.383; 100.057 | 407.2 | Shattock, Tanise R.; Arora, Kapildev K.; Vishweshwar, Peddy; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Carboxylic Acid···Pyridine Hydrogen Bonds in Cocrystals That also Contain a Hydroxyl Moiety Crystal Growth & Design, 2008, 8, 4533 |
4501637 | CIF | C8 H11 O3.5 | P -1 | 5.7749; 7.2971; 10.2251 76.308; 84.513; 77.722 | 408.6 | Bernardes, Carlos E. S.; Piedade, M. Fátima M.; Minas da Piedade, Manuel E. Structure and Energetics of a New Hydrate of 4′-Hydroxyacetophenone Crystal Growth & Design, 2010, 10, 3070 |
4513102 | CIF | C10 H8 I4 N4 | P -1 | 6.589; 7.514; 9.181 66.435; 82.25; 79.808 | 409 | Ravat, Prince; SeethaLekshmi, Sunil; Biswas, Sharmita Nandy; Nandy, Purnendu; Varughese, Sunil Equivalence of Ethylene and Azo-Bridges in the Modular Design of Molecular Complexes: Role of Weak Interactions Crystal Growth & Design, 2015, 15, 2389 |
4505851 | CIF | C6 H4 Cl2 Cu N2 S | P 1 21/m 1 | 3.719; 12.62; 8.8 90; 97.63; 90 | 409.4 | Papaefstathiou, Giannis S.; Tsohos, Alexandros; Raptopoulou, Catherine P.; Terzis, Aris; Psycharis, Vassilis; Gatteschi, Dante; Perlepes, Spyros P. Crystal Engineering: Stacking Interactions Control the Crystal Structures of Benzothiadiazole (btd) and Its Complexes with Copper(II) and Copper(I) Chlorides Crystal Growth & Design, 2001, 1, 191 |
4506806 | CIF | C9 H7 N3 O2 | P 1 n 1 | 3.9626; 6.2888; 16.5205 90; 94.462; 90 | 410.44 | Wang, Yu-Ling; Fu, Jiang-Hong; Wei, Jia-Jia; Xu, Xiang; Li, Xin-Fa; Liu, Qing-Yan Noncentrosymmetric Organic Solid and Its Zinc Coordination Polymer with Diamonded Network Prepared from an Ionothermal Reaction: Syntheses, Crystal Structures, and Second-Order Nonlinear Optics Properties Crystal Growth & Design, 2012, 12, 4663 |
4507566 | CIF | Al9.51 Fe0.28 Mn2.21 Yb | I 4/m m m | 8.968; 8.968; 5.105 90; 90; 90 | 410.6 | Fulfer, Bradford W.; McAlpin, Jacob D.; Haldolaarachchige, Neel; Young, David P.; Chan, Julia Y. Synthesis, Structure, and Magnetic and Electrical Properties of Yb(Mn,M)xAl12‒x(M = Fe, Ru;x≤ 2.5) Phases Crystal Growth & Design, 2013, 13, 1543 |
4500893 | CIF | Cd H4 Na2 O10 S2 | P 1 21/c 1 | 5.9085; 13.0165; 5.5636 90; 106.215; 90 | 410.86 | Saha, Dipankar; Madras, Giridhar; Guru Row, Tayur N. Manipulation of the Hydration Levels in Minerals of Sodium Cadmium Bisulfate toward the Design of Functional Materials Crystal Growth & Design, 2011, 11, 3213 |
4516357 | CIF | C4 H4 N2 | P n a 21 | 11.574; 9.4736; 3.7485 90; 90; 90 | 411.01 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4511326 | CIF | C9 H11 N O2 | P -1 | 6.619; 7.963; 8.543 88.12; 84.75; 66.7 | 411.8 | Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C. Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment Crystal Growth & Design, 2007, 7, 531 |
4507188 | CIF | C H6 N2 O S | P 1 21/c 1 | 5.9685; 8.82; 7.9218 90; 98.93; 90 | 412 | Tomkowiak, Hanna; Olejniczak, Anna; Katrusiak, Andrzej Pressure-Dependent Formation and Decomposition of Thiourea Hydrates Crystal Growth & Design, 2013, 13, 121 |
4506381 | CIF | C6 H4 B2 F4 O4 | P 1 21/n 1 | 8.4258; 5.0244; 10.1656 90; 106.254; 90 | 413.16 | Durka, Krzysztof; Jarzembska, Katarzyna N.; Kamiński, Radosław; Luliński, Sergiusz; Serwatowski, Janusz; Woźniak, Krzysztof Structural and Energetic Landscape of Fluorinated 1,4-Phenylenediboronic Acids Crystal Growth & Design, 2012, 12, 3720 |
4516351 | CIF | C4 H4 N2 | P n a 21 | 11.6379; 9.4709; 3.7529 90; 90; 90 | 413.65 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4512920 | CIF | C10 H14 B2 Cd Cl4 N2 O4 | P -1 | 3.803; 7.8592; 14.179 84.77; 82.38; 81.11 | 413.92 | Yahsi, Yasemin; Gungor, Elif; Kara, Hulya Chlorometallate-Pyridinium Boronic Acid Salts for Crystal Engineering: Synthesis of One-, Two-, and Three-Dimensional Hydrogen Bond Networks Crystal Growth & Design, 2015, 15, 2652 |
4516513 | CIF | C5 H10 N2 O6 | P 1 21 1 | 6.6411; 6.9162; 9.0495 90; 94.697; 90 | 414.26 | Krawczuk, Anna; Gryl, Marlena; Pitak, Mateusz B.; Stadnicka, Katarzyna Electron Density Distribution of Urea in Co-crystals with Rigid and Flexible Dicarboxylic Acids Crystal Growth & Design, 2015, 15, 5578 |
4504088 | CIF | C6 H14 N2 O4 | P -1 | 6.217; 7.0356; 10.0593 84.711; 76.83; 75.77 | 414.97 | Fabbiani, Francesca P. A.; Allan, David R.; David, William I. F.; Davidson, Alistair J.; Lennie, Alistair R.; Parsons, Simon; Pulham, Colin R.; Warren, John E. High-Pressure Studies of Pharmaceuticals: An Exploration of the Behavior of Piracetam Crystal Growth & Design, 2007, 7, 1115 |
4516350 | CIF | C4 H4 N2 | P n a 21 | 11.651; 9.475; 3.7623 90; 90; 90 | 415.3 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4504601 | CIF | C12 H14 Cl4 N4 O2 Pt | P -1 | 6.8888; 7.7068; 8.2032 88.779; 72.911; 89.466 | 416.19 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4516349 | CIF | C4 H4 N2 | P n a 21 | 11.659; 9.479; 3.7704 90; 90; 90 | 416.7 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516348 | CIF | C4 H4 N2 | P n a 21 | 11.664; 9.479; 3.7749 90; 90; 90 | 417.4 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516347 | CIF | C4 H4 N2 | P n a 21 | 11.66; 9.48; 3.7771 90; 90; 90 | 417.5 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516352 | CIF | C4 H4 N2 | P n a 21 | 11.665; 9.483; 3.774 90; 90; 90 | 417.5 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516353 | CIF | C4 H4 N2 | P n a 21 | 11.665; 9.484; 3.7782 90; 90; 90 | 418 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516346 | CIF | C4 H4 N2 | P n a 21 | 11.66; 9.479; 3.7837 90; 90; 90 | 418.2 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516354 | CIF | C4 H4 N2 | P n a 21 | 11.673; 9.484; 3.7782 90; 90; 90 | 418.3 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4506645 | CIF | C18 H8 F4 I2 O | P -1 | 5.4259; 5.7691; 13.919 90.582; 101.061; 101.593 | 418.35 | Gao, Hai Yue; Zhao, Xiao Ran; Wang, Hui; Pang, Xue; Jin, Wei Jun Phosphorescent Cocrystals Assembled by 1,4-Diiodotetrafluorobenzene and Fluorene and Its Heterocyclic Analogues Based on C‒I···π Halogen Bonding Crystal Growth & Design, 2012, 12, 4377 |
4511249 | CIF | C8 H4 F4 N2 O | P -1 | 5.009; 8.499; 10.854 103.871; 101.076; 104.493 | 418.41 | Pérez-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 |
4516345 | CIF | C4 H4 N2 | P n a 21 | 11.666; 9.487; 3.785 90; 90; 90 | 418.9 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4516355 | CIF | C4 H4 N2 | P n a 21 | 11.667; 9.491; 3.7874 90; 90; 90 | 419.4 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4501922 | CIF | C22 H16 N2 | P -1 | 6.0763; 8.1851; 9.4838 94.27; 108.557; 107.201 | 419.69 | Bosch, Eric Role of sp-C−H—N Hydrogen Bonding in Crystal Engineering Crystal Growth & Design, 2010, 10, 3808 |
4516344 | CIF | C4 H4 N2 | P n a 21 | 11.682; 9.492; 3.7897 90; 90; 90 | 420.2 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4512821 | CIF | C18 H18 N2 O8 | P -1 | 5.5761; 6.9604; 11.7649 73.422; 81.543; 74.39 | 420.27 | Stevens, Joanna S.; Newton, Lauren K.; Jaye, Cherno; Muryn, Christopher A.; Fischer, Daniel A.; Schroeder, Sven L. M. Proton Transfer, Hydrogen Bonding, and Disorder: Nitrogen Near-Edge X-ray Absorption Fine Structure and X-ray Photoelectron Spectroscopy of Bipyridine‒Acid Salts and Co-crystals Crystal Growth & Design, 2015, 15, 1776 |
4504602 | CIF | C12 H14 Cl4 N4 O2 Pt | P -1 | 6.9952; 7.3278; 8.6578 71.87; 88.967; 87.604 | 421.4 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4511327 | CIF | C9 H11 N O2 | P -1 | 6.648; 8.056; 8.631 89.06; 85.29; 66.2 | 421.4 | Parkin, Andrew; Seaton, Colin C.; Blagden, Nicholas; Wilson, Chick C. Designing Hydrogen Bonds with Temperature-Dependent Proton Disorder: The Effect of Crystal Environment Crystal Growth & Design, 2007, 7, 531 |
4516343 | CIF | C4 H4 N2 | P n a 21 | 11.687; 9.497; 3.7988 90; 90; 90 | 421.6 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4508303 | CIF | C8 H16 N2 O12 Se2 V2 | P -1 | 6.324; 7.841; 9.197 90.438; 105.955; 105.059 | 421.9 | Koffer, Jacob H.; Olshansky, Jacob H.; Smith, Matthew D.; Hernandez, Kristen J.; Zeller, Matthias; Ferrence, Gregory M.; Schrier, Joshua; Norquist, Alexander J. Formation Principles for Templated Vanadium Selenite Oxalates Crystal Growth & Design, 2013, 13, 4504 |
4501605 | CIF | C3 H7 N O2 | P n a 21 | 12.0067; 6.029; 5.8318 90; 90; 90 | 422.15 | Iwama, Sekai; Horiguchi, Masahiro; Sato, Hiroyasu; Uchida, Yoshiaki; Takahashi, Hiroki; Tsue, Hirohito; Tamura, Rui Observation of the Preferential Enrichment Phenomenon for Essential α-Amino Acids with a Racemic Crystal Structure Crystal Growth & Design, 2010, 10, 2668 |
4512925 | CIF | C10 H14 B2 Cl4 N2 O4 Pd | P -1 | 6.926; 7.9568; 8.297 70.25; 79.53; 83.22 | 422.38 | Yahsi, Yasemin; Gungor, Elif; Kara, Hulya Chlorometallate-Pyridinium Boronic Acid Salts for Crystal Engineering: Synthesis of One-, Two-, and Three-Dimensional Hydrogen Bond Networks Crystal Growth & Design, 2015, 15, 2652 |
4501722 | CIF | C6 H15 N O2 | P -1 | 6.42596; 7.19411; 10.04415 66.6999; 84.6295; 83.1542 | 422.873 | Martí-Rujas, Javier; Morte-Ródenas, Anabel; Guo, Fang; Thomas, Nigel; Fujii, Kotaro; Kariuki, Benson M.; Harris, Kenneth D. M. A Solid-State Dehydration Process in an Organic Material Associated with Substantial Hydrogen-Bond Reorganization, Investigated by Powder X-ray Diffraction Crystal Growth & Design, 2010, 10, 3176 |
4516571 | CIF | C4 H4 N2 | P 1 21/c 1 | 11.239; 3.8173; 11.06 90; 116.79; 90 | 423.6 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4511825 | CIF | C7 H9 F N3 O3 | P -1 | 5.2742; 6.665; 12.8441 86.411; 80.757; 71.97 | 423.72 | da 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 |
4516342 | CIF | C4 H4 N2 | P n a 21 | 11.7036; 9.502; 3.8171 90; 90; 90 | 424.49 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4500369 | CIF | C9 H6 N6 | P -1 | 7.2138; 8.3667; 8.8361 99.826; 113.825; 110.721 | 424.55 | Schubert, David M.; Natan, Daniel T.; Wilson, Duane C.; Hardcastle, Kenneth I. Facile Synthesis and Structures of Cyclic Triimidazole and Its Boric Acid Adduct Crystal Growth & Design, 2011, 11, 843-850 |
4516570 | CIF | C4 H4 N2 | P 1 21/c 1 | 11.252; 3.8312; 11.074 90; 117.15; 90 | 424.8 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4501913 | CIF | Ca H8 O10 V2 | P -1 | 7.0157; 8.4568; 8.5527 66.469; 78.448; 66.251 | 425.37 | Parhi, Purnendu; Upreti, Shailesh; Ramanan, Arunachalam Crystallization of Calcium Vanadate Solids from Solution: A Metathetic Route Crystal Growth & Design, 2010, 10, 5078 |
4516501 | CIF | C6 H4 K2 O4 | P 1 21/n 1 | 10.765; 3.9739; 11.261 90; 117.978; 90 | 425.43 | Kole, Goutam Kumar; Chanthapally, Anjana; Tan, Geok Kheng; Vittal, Jagadese J. Solid State Packing and Photoreactivity of Alkali Metal Salts oftrans,trans-Muconate Crystal Growth & Design, 2015, 15, 5555 |
4516514 | CIF | C4 H10 N4 O6 | P 1 21/c 1 | 5.0451; 12.3754; 6.8563 90; 96.289; 90 | 425.498 | Krawczuk, Anna; Gryl, Marlena; Pitak, Mateusz B.; Stadnicka, Katarzyna Electron Density Distribution of Urea in Co-crystals with Rigid and Flexible Dicarboxylic Acids Crystal Growth & Design, 2015, 15, 5578 |
4504000 | CIF | C20 H14 F4 O4 | P -1 | 3.832; 9.876; 12.178 71.04; 81.01; 78.94 | 425.6 | Mori, Yutaka; Matsumoto, Akikazu Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals Crystal Growth & Design, 2007, 7, 377 |
4516356 | CIF | C4 H4 N2 | P n a 21 | 11.699; 9.5; 3.8295 90; 90; 90 | 425.61 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej CH···N Bonds and Dynamics in Isostructural Pyrimidine Polymorphs Crystal Growth & Design, 2015, 15, 4039 |
4507187 | CIF | C H6 N2 O S | P 1 21/c 1 | 5.995; 8.996; 7.986 90; 98.63; 90 | 425.8 | Tomkowiak, Hanna; Olejniczak, Anna; Katrusiak, Andrzej Pressure-Dependent Formation and Decomposition of Thiourea Hydrates Crystal Growth & Design, 2013, 13, 121 |
4516569 | CIF | C4 H4 N2 | P 1 21/c 1 | 11.263; 3.831; 11.086 90; 116.93; 90 | 426.5 | Patyk, Ewa; Podsiadło, Marcin; Katrusiak, Andrzej Discrete CH···N Bonded Patterns Modified by Temperature and Pressure in Four Pyrazine Polymorphs Crystal Growth & Design, 2015, 15, 5670 |
4503648 | CIF | C2 H Cd N3 O0 S | P 1 21/c 1 | 6.1204; 11.225; 6.811 90; 114.25; 90 | 426.64 | Zhang, Rui-Bo; Li, Zhao-Ji; Cheng, Jian-Kai; Qin, Ye-Yan; Zhang, Jian; Yao, Yuan-Gen Anion-Induced Coordination Versatility of 1H-1,2,4-Triazole-3-thiol (HtrzSH) Affording a New Hybrid System of Cadmium(II) Polymers: Synthesis, Structure, and Luminescent Properties Crystal Growth & Design, 2008, 8, 2562 |
4504976 | CIF | C4 Cl2 N6 O3 | P 1 21/m 1 | 6.977; 6.154; 10.515 90; 108.49; 90 | 428.17 | Averkiev, Boris B.; Antipin, Mikhail Yu.; Sheremetev, Aleksey B.; Timofeeva, Tatiana V. Computer Simulation of Crystal Structure for Three Furazan Derivatives Crystal Growth & Design, 2005, 5, 631 |
4511575 | CIF | C14 H10 Cu N2 O12 U | P -1 | 5.3553; 7.685; 10.951 104.448; 90.485; 100.058 | 429.09 | Kerr, 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 |
4501921 | CIF | C22 H14 N2 | P -1 | 6.342; 7.27; 9.864 105.467; 100.354; 91.668 | 429.8 | Bosch, Eric Role of sp-C−H—N Hydrogen Bonding in Crystal Engineering Crystal Growth & Design, 2010, 10, 3808 |
4513315 | CIF | C12.3 H8.3 N1.7 | P 1 21/n 1 | 7.0829; 4.9885; 12.565 90; 103.028; 90 | 432.53 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4513309 | CIF | C6.13 H4.13 N0.87 | P 1 21/n 1 | 7.0733; 4.9761; 12.6164 90; 103.035; 90 | 432.62 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4513118 | CIF | C8 H8 N18 O8 | P -1 | 7.5387; 7.8716; 7.9743 75.469; 76.759; 73.514 | 432.84 | Bennion, Jonathan C.; McBain, Andrew; Son, Steven F.; Matzger, Adam J. Design and Synthesis of a Series of Nitrogen-Rich Energetic Cocrystals of 5,5′-Dinitro-2H,2H′-3,3′-bi-1,2,4-triazole (DNBT) Crystal Growth & Design, 2015, 15, 2545 |
4519366 | CIF | C12 H9 N O | P 1 21/c 1 | 9.335; 5.768; 8.261 90; 103.17; 90 | 433.11 | Kaltenegger, Martin; Delaive, Louis; Gali, Sai Manoj; Brocorens, Patrick; Werzer, Oliver; Riegler, Hans; Geerts, Yves Henri; Lazzaroni, Roberto; Resel, Roland; Liu, Jie Molecular Packing of Phenoxazine: A Combined Single-Crystal/Crystal Structure Prediction Study Crystal Growth & Design, 2022, 22, 1548-1553 |
4501718 | CIF | C10 H14 B2 Cl4 N2 O4 Pt | P -1 | 6.9763; 8.1459; 8.236 70.567; 79.375; 83.735 | 433.23 | Campos-Gaxiola, José J.; Vega-Paz, Araceli; Román-Bravo, Perla; Höpfl, Herbert; Sánchez-Vázquez, Mario Pyridineboronic Acids as Useful Building Blocks in Combination with Perchloroplatinate(II) and -(IV) Salts: 1D, 2D, and 3D Hydrogen-Bonded Networks Containing X-H···Cl2Pt−(X = C, N+), B(OH)2···Cl2Pt−, and B(OH)2···(HO)2B Synthons Crystal Growth & Design, 2010, 10, 3182 |
4513317 | CIF | C12.1 H8.1 N1.9 | P 1 21/n 1 | 7.0768; 4.9901; 12.6004 90; 103.047; 90 | 433.48 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4513306 | CIF | C6.13 H4.13 N0.87 | P 1 21/n 1 | 7.0842; 4.982; 12.617 90; 103.036; 90 | 433.82 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4502898 | CIF | C16 H12 Ag2 N2 O7 | P -1 | 3.6084; 9.9374; 12.728 73.315; 87.944; 84.004 | 434.79 | Kole, Goutam Kumar; Tan, Geok Kheng; Vittal, Jagadese J. Photoreactivity of Ag(I) Complexes and Coordination Polymers of Pyridyl Acrylic Acids Crystal Growth & Design, 2012, 12, 326 |
4504268 | CIF | C8 H5 Cd N2 O2 | P -1 | 7.5532; 7.642; 8.4674 71.386; 73.065; 74.956 | 435.56 | Wang, Chih-Chieh; Kuo, Chen-Tsung; Yang, Jing-Chun; Lee, Gene-Hsiang; Shih, Wei-Ju; Sheu, Hwo-Shuenn Assemblies of Two New Metal−Organic Frameworks Constructed from Cd(II) with 2,2‘-Bipyrimidine and Cyclic Oxocarbon Dianions CnOn2-(n= 4, 5) Crystal Growth & Design, 2007, 7, 1476 |
4513310 | CIF | C6.2 H4.2 N0.8 | P 1 21/n 1 | 7.1057; 4.9933; 12.597 90; 102.771; 90 | 435.9 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4513321 | CIF | C6.2 H4.2 N0.8 | P 1 21/n 1 | 7.1148; 4.9875; 12.6219 90; 102.96; 90 | 436.48 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4508021 | CIF | C8 H14 O4 | P 1 21/c 1 | 8.7719; 5.0668; 9.8849 90; 95.924; 90 | 436.99 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4504333 | CIF | C H3 N5 O Zn | P b c m | 6.3449; 10.4301; 6.6211 90; 90; 90 | 438.17 | Wang, Xian−Wen; Chen, Jing-Zhong; Liu, Jian-Hong Photoluminescent Zn(II) Metal−Organic Frameworks Built from Tetrazole Ligand: 2D Four-Connected Regular Honeycomb (4363)-net Crystal Growth & Design, 2007, 7, 1227 |
4500452 | CIF | C14 H16 Mg N2 O12 | P -1 | 5.2497; 7.6168; 11.7111 81.763; 78.428; 73.836 | 438.72 | Arlin, Jean-Baptiste; Florence, Alastair J.; Johnston, Andrea; Kennedy, Alan R.; Miller, Gary J.; Patterson, Kirsty Systematic Data Set for Structure−Property Investigations: Solubility and Solid-State Structure of Alkaline Earth Metal Salts of Benzoates Crystal Growth & Design, 2011, 11, 1318 |
4508022 | CIF | C8 H14 O4 | P 1 21/c 1 | 8.7982; 5.0696; 9.912 90; 96.201; 90 | 439.52 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4511812 | CIF | C6 H10 N2 O6 Zn | P 1 21 1 | 4.8075; 9.4727; 9.7014 90; 95.763; 90 | 439.57 | Emami, Seyedali; Paz, Filipe A. Almeida; Mendes, Adélio; Gales, Luís Toward the Construction of 3D Dipeptide‒Metal Frameworks Crystal Growth & Design, 2014, 14, 4777 |
4503068 | CIF | C3 H6 O | P 21 21 21 | 4.565; 7.314; 13.165 90; 90; 90 | 439.6 | Kirchner, Michael T.; Das, Dinabandhu; Boese, Roland Cocrystallization with Acetylene: Molecular Complex with Methanol Crystal Growth & Design, 2008, 8, 763 |
4513635 | CIF | C22 H10 Br2 F4 | P -1 | 7.046; 8.334; 8.623 116.29; 90.15; 102.722 | 439.9 | Pang, Xue; Wang, Hui; Wang, Weizhou; Jin, Wei Jun Phosphorescent π-Hole···π Bonding Cocrystals of Pyrene with Halo-perfluorobenzenes (F, Cl, Br, I) Crystal Growth & Design, 2015, 15, 4938 |
4513311 | CIF | C6.24 H4.24 N0.75 | P 1 21/n 1 | 7.1465; 4.9932; 12.6435 90; 102.737; 90 | 440.07 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4504001 | CIF | C20 H12 F6 O4 | P -1 | 3.9341; 9.978; 12.089 106.49; 98.19; 98.82 | 440.9 | Mori, Yutaka; Matsumoto, Akikazu Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals Crystal Growth & Design, 2007, 7, 377 |
4508023 | CIF | C8 H14 O4 | P 1 21/c 1 | 8.8296; 5.0617; 9.9496 90; 96.65; 90 | 441.68 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4504640 | CIF | C18 H20 N4 O6 | P -1 | 4.8875; 8.4817; 11.4723 110.375; 91; 96.451 | 442.18 | Aakeröy, Christer B.; Hussain, Izhar; Desper, John 2-Acetaminopyridine: A Highly Effective Cocrystallizing Agent Crystal Growth & Design, 2006, 6, 474 |
4501717 | CIF | C10 H14 B2 Cl4 N2 O4 Pt | P -1 | 7.3658; 8.0487; 8.1862 68.767; 77.992; 85.515 | 442.47 | Campos-Gaxiola, José J.; Vega-Paz, Araceli; Román-Bravo, Perla; Höpfl, Herbert; Sánchez-Vázquez, Mario Pyridineboronic Acids as Useful Building Blocks in Combination with Perchloroplatinate(II) and -(IV) Salts: 1D, 2D, and 3D Hydrogen-Bonded Networks Containing X-H···Cl2Pt−(X = C, N+), B(OH)2···Cl2Pt−, and B(OH)2···(HO)2B Synthons Crystal Growth & Design, 2010, 10, 3182 |
4505019 | CIF | C9 H17 N O2 | P -1 | 5.397; 6.338; 13.743 94.49; 98.66; 105.94 | 443.31 | Fábián, László; Kálmán, Alajos; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Cs. Crystal Engineering with Alicyclic β-Amino Acids: Construction of Hydrogen-Bonded Bilayers Crystal Growth & Design, 2005, 5, 773 |
4503994 | CIF | C20 H14 F4 O4 | P -1 | 3.9694; 10.829; 10.846 74.13; 81.53; 87.59 | 443.5 | Mori, Yutaka; Matsumoto, Akikazu Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals Crystal Growth & Design, 2007, 7, 377 |
4504359 | CIF | C10 H10 N4 | P -1 | 6.9426; 7.2048; 9.3201 92.459; 91.38; 107.319 | 444.31 | B. Aakeröy, Christer; Schultheiss, Nate; Desper, John; Moore, Curtis Balancing Hydrogen-Bond Donors and Acceptors in a Family of Bifunctional Aromatic N-Heterocycles Crystal Growth & Design, 2007, 7, 2324 |
4512904 | CIF | Cu Dy2 O12 S2 | P 1 21/c 1 | 6.304; 6.663; 10.724 90; 98.527; 90 | 445.5 | Tang, Yingying; Cui, Meiyan; Guo, Wenbin; Zhang, Suyun; Yang, Ming; He, Zhangzhen Syntheses, Structure, and Magnetic Properties of New 3d‒4f Heterometallic Hydroxysulfates Ln2Cu(SO4)2(OH)4(Ln = Sm, Eu, Tb, or Dy) with a Two-Dimensional Triangle Network Crystal Growth & Design, 2015, 15, 2742 |
4508024 | CIF | C8 H14 O4 | P 1 21/c 1 | 8.8774; 5.0626; 9.9952 90; 97.064; 90 | 445.8 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4506730 | CIF | C12 H10 N2 | P 1 21/c 1 | 7.072; 5.1; 13.13 90; 109.18; 90 | 447.3 | Lee, Tu; Chen, Hsin Rong; Lin, Hong Yu; Lee, Hung Lin Continuous Co-Crystallization As a Separation Technology: The Study of 1:2 Co-Crystals of Phenazine‒Vanillin Crystal Growth & Design, 2012, 12, 5897 |
4512027 | CIF | C6 H8 N2 O4 S | P 1 21 1 | 6.3856; 6.6445; 10.5589 90; 91.304; 90 | 447.89 | Yadav, Priyanka; Dutta, Pradip Kr.; Ballabh, Amar Combinatorial Library Approach to Realize 2-Aminothiazole-Based Two-Component Hydrogelator: A Structure‒Property Correlation Crystal Growth & Design, 2014, 14, 5966 |
4501018 | CIF | C11 H10 O2 | P -1 | 7.0118; 7.3848; 9.9023 95.805; 106.502; 110.677 | 448.21 | Seth, Saikat Kumar; Sarkar, Debayan; Jana, Atish Dipankar; Kar, Tanusree On the Possibility of Tuning Molecular Edges To Direct Supramolecular Self-Assembly in Coumarin Derivatives through Cooperative Weak Forces: Crystallographic and Hirshfeld Surface Analyses Crystal Growth & Design, 2011, 11, 4837 |
4511826 | CIF | C8 H7 F N3 O3 | P -1 | 3.6265; 9.5274; 13.7902 107.812; 92.036; 96.844 | 449.09 | da 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 |
4508025 | CIF | C8 H14 O4 | P 1 21/c 1 | 8.9252; 5.0606; 10.045 90; 97.61; 90 | 449.71 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4512967 | CIF | Cu H4 O12 S2 Tb2 | P 1 21/c 1 | 6.321; 6.693; 10.757 90; 98.533; 90 | 450.1 | Tang, Yingying; Cui, Meiyan; Guo, Wenbin; Zhang, Suyun; Yang, Ming; He, Zhangzhen Syntheses, Structure, and Magnetic Properties of New 3d‒4f Heterometallic Hydroxysulfates Ln2Cu(SO4)2(OH)4(Ln = Sm, Eu, Tb, or Dy) with a Two-Dimensional Triangle Network Crystal Growth & Design, 2015, 15, 2742 |
4501124 | CIF | C6 H16 Br2 N2 O | P m m n :2 | 7.2844; 10.918; 5.663 90; 90; 90 | 450.4 | Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate Crystal Growth & Design, 2011, 11, 4892 |
4513593 | CIF | C4 H9 N | P 1 21/c 1 | 8.6611; 5.208; 10.672 90; 110.561; 90 | 450.72 | Dobrzycki, Lukasz; Taraszewska, Paulina; Boese, Roland; Cyrański, Michał K. Pyrrolidine and Its Hydrates in the Solid State Crystal Growth & Design, 2015, 15, 4804 |
4504975 | CIF | C6 H6 N6 O3 | P 1 21/m 1 | 6.947; 6.246; 10.76 90; 104.23; 90 | 452.6 | Averkiev, Boris B.; Antipin, Mikhail Yu.; Sheremetev, Aleksey B.; Timofeeva, Tatiana V. Computer Simulation of Crystal Structure for Three Furazan Derivatives Crystal Growth & Design, 2005, 5, 631 |
4505309 | CIF | C9 H14 N2 O2 | P -1 | 5.7692; 7.9733; 10.1316 79.224; 89.598; 81.603 | 452.82 | Brewer, Jason T.; Parkin, Sean; Grossman, Robert B. A Systematic Study of the Relationship between Molecular and Crystal Structure among 3,5-Diazabicyclo[2.2.2]octane-2,6-diones Crystal Growth & Design, 2004, 4, 591 |
4508026 | CIF | C8 H14 O4 | P 1 21/c 1 | 8.957; 5.067; 10.086 90; 98.15; 90 | 453.1 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4510705 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.771; 9.673; 5.3402 90; 90; 90 | 453.1 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4503157 | CIF | C3 H5 Cu2 I2 N3 | P -1 | 7.9605; 8.2819; 8.3378 116.322; 99.543; 104.153 | 453.34 | Wu, Tao; Li, Mian; Li, Dan; Huang, Xiao-Chun Anionic CunInCluster-Based Architectures Induced by In Situ GeneratedN-Alkylated Cationic Triazolium Salts Crystal Growth & Design, 2008, 8, 568 |
4508307 | CIF | C8 H20 N2 O13 Se2 V2 | P -1 | 6.322; 8.5056; 9.397 95.3642; 108.267; 105.122 | 454.68 | Koffer, Jacob H.; Olshansky, Jacob H.; Smith, Matthew D.; Hernandez, Kristen J.; Zeller, Matthias; Ferrence, Gregory M.; Schrier, Joshua; Norquist, Alexander J. Formation Principles for Templated Vanadium Selenite Oxalates Crystal Growth & Design, 2013, 13, 4504 |
4504947 | CIF | C6 H10 N4 O4 | P -1 | 6.297; 7.674; 10.557 74.94; 87.597; 67.677 | 454.8 | Lewis, Thomas C.; Tocher, Derek A.; Price, Sarah L. Investigating Unused Hydrogen Bond Acceptors Using Known and Hypothetical Crystal Polymorphism Crystal Growth & Design, 2005, 5, 983 |
4505771 | CIF | C4 H12 O6 P2 | P -1 | 5.8745; 8.9512; 9.6833 63.469; 88.364; 88.702 | 455.35 | Mahmoudkhani, Amir H.; Langer, Vratislav Supramolecular Isomerism and Isomorphism in the Structures of 1,4-Butanebisphosphonic Acid and Its Organic Ammonium Salts Crystal Growth & Design, 2002, 2, 21 |
4513313 | CIF | C7 H5 | P 1 21/c 1 | 9.2627; 5.9923; 8.4088 90; 102.608; 90 | 455.47 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4513308 | CIF | C6.99 H4.99 N0.01 | P 1 21/c 1 | 9.2763; 5.9882; 8.403 90; 102.54; 90 | 455.64 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4508306 | CIF | C8 H18 N2 O12 Se2 V2 | P -1 | 6.378; 8.444; 9.405 92.26; 107.27; 107.84 | 455.7 | Koffer, Jacob H.; Olshansky, Jacob H.; Smith, Matthew D.; Hernandez, Kristen J.; Zeller, Matthias; Ferrence, Gregory M.; Schrier, Joshua; Norquist, Alexander J. Formation Principles for Templated Vanadium Selenite Oxalates Crystal Growth & Design, 2013, 13, 4504 |
4511392 | CIF | C10 H13 N O | P 1 | 5.1941; 9.4531; 10.0232 96.343; 102.945; 104.938 | 455.971 | Khrustalev, Victor N.; Sandhu, Bhupinder; Bentum, Samuel; Fonari, Alexandr; Krivoshein, Arcadius V.; Timofeeva, Tatiana V. Absolute Configuration and Polymorphism of 2-Phenylbutyramide and α-Methyl-α-phenylsuccinimide Crystal Growth & Design, 2014, 14, 3360 |
4511391 | CIF | C10 H13 N O | P 1 | 5.1916; 9.4525; 10.0367 96.326; 102.938; 104.998 | 456.226 | Khrustalev, Victor N.; Sandhu, Bhupinder; Bentum, Samuel; Fonari, Alexandr; Krivoshein, Arcadius V.; Timofeeva, Tatiana V. Absolute Configuration and Polymorphism of 2-Phenylbutyramide and α-Methyl-α-phenylsuccinimide Crystal Growth & Design, 2014, 14, 3360 |
4513320 | CIF | C7 H5 | P 1 21/c 1 | 9.2689; 5.9954; 8.4104 90; 102.478; 90 | 456.33 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4513108 | CIF | C16 H8 F4 I2 N4 | P -1 | 6.414; 8.358; 9.202 82.982; 70.979; 78.678 | 456.4 | Ravat, Prince; SeethaLekshmi, Sunil; Biswas, Sharmita Nandy; Nandy, Purnendu; Varughese, Sunil Equivalence of Ethylene and Azo-Bridges in the Modular Design of Molecular Complexes: Role of Weak Interactions Crystal Growth & Design, 2015, 15, 2389 |
4508305 | CIF | C6 H18 N2 O14 Se2 V2 | P -1 | 6.3369; 8.509; 9.413 95.363; 108.245; 105.236 | 456.46 | Koffer, Jacob H.; Olshansky, Jacob H.; Smith, Matthew D.; Hernandez, Kristen J.; Zeller, Matthias; Ferrence, Gregory M.; Schrier, Joshua; Norquist, Alexander J. Formation Principles for Templated Vanadium Selenite Oxalates Crystal Growth & Design, 2013, 13, 4504 |
4503017 | CIF | C10 H8 O18 U3 | P -1 | 5.5266; 7.6559; 11.3208 100.846; 100.44; 96.94 | 456.66 | Mihalcea, Ionut; Henry, Natacha; Volkringer, Christophe; Loiseau, Thierry Uranyl‒Pyromellitate Coordination Polymers: Toward Three-Dimensional Open Frameworks with Large Channel Systems Crystal Growth & Design, 2012, 12, 526 |
4513322 | CIF | C6.97 H4.97 N0.03 | P 1 21/c 1 | 9.2837; 5.9932; 8.4219 90; 102.529; 90 | 457.43 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4513319 | CIF | C13.98 H9.98 N0.02 | P 1 21/c 1 | 9.2981; 5.9945; 8.408 90; 102.5; 90 | 457.5 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4510699 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.783; 9.7595; 5.3416 90; 90; 90 | 457.87 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4513302 | CIF | C14 H10 | P 1 21/c 1 | 9.2838; 5.9992; 8.421 90; 102.487; 90 | 457.92 | Lusi, Matteo; Vitorica-Yrezabal, Inigo J.; Zaworotko, Michael J. Expanding the Scope of Molecular Mixed Crystals Enabled by Three Component Solid Solutions Crystal Growth & Design, 2015, 15, 4098 |
4510700 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.7856; 9.7596; 5.3418 90; 90; 90 | 458.03 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4501263 | CIF | C2 H10 Ce Cl3 O3 | P -1 | 6.7897; 8.5362; 9.1909 106.227; 110.362; 99.697 | 458.15 | Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials Crystal Growth & Design, 2011, 11, 5072 |
4510701 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.7889; 9.7596; 5.3418 90; 90; 90 | 458.2 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4505055 | CIF | C12 H16 Ag B F4 N4 O2 | P -4 | 9.006; 9.006; 5.6627 90; 90; 90 | 459.3 | Zhang, Jian; Li, Zhao-Ji; Kang, Yao; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen Syntheses and Characterizations of Two Novel Silver(I) Complexes Constructed by Oxydipropionitrile Ligand Crystal Growth & Design, 2005, 5, 73 |
4511395 | CIF | C11 H11 N O2 | P 1 21 1 | 6.7076; 7.0112; 10.021 90; 102.635; 90 | 459.86 | Khrustalev, Victor N.; Sandhu, Bhupinder; Bentum, Samuel; Fonari, Alexandr; Krivoshein, Arcadius V.; Timofeeva, Tatiana V. Absolute Configuration and Polymorphism of 2-Phenylbutyramide and α-Methyl-α-phenylsuccinimide Crystal Growth & Design, 2014, 14, 3360 |
4511394 | CIF | C11 H11 N O2 | P 1 21 1 | 6.70721; 7.01427; 10.01819 90; 102.64; 90 | 459.895 | Khrustalev, Victor N.; Sandhu, Bhupinder; Bentum, Samuel; Fonari, Alexandr; Krivoshein, Arcadius V.; Timofeeva, Tatiana V. Absolute Configuration and Polymorphism of 2-Phenylbutyramide and α-Methyl-α-phenylsuccinimide Crystal Growth & Design, 2014, 14, 3360 |
4510702 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.8206; 9.7598; 5.344 90; 90; 90 | 460.05 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4510361 | CIF | C7 H12 N4 O | P 1 21/m 1 | 8.663; 6.5838; 9.0253 90; 116.56; 90 | 460.4 | Chesman, Anthony S. R.; Hodgson, Jennifer L.; Izgorodina, Ekaterina I.; Urbatsch, Aron; Turner, David R.; Deacon, Glen B.; Batten, Stuart R. Anion‒Anion Interactions in the Crystal Packing of Functionalized Methanide Anions: An Experimental and Computational Study Crystal Growth & Design, 2014, 14, 1922 |
4512968 | CIF | Cu Eu2 H4 O12 S2 | P 1 21/c 1 | 6.369; 6.76; 10.82 90; 98.6; 90 | 460.6 | Tang, Yingying; Cui, Meiyan; Guo, Wenbin; Zhang, Suyun; Yang, Ming; He, Zhangzhen Syntheses, Structure, and Magnetic Properties of New 3d‒4f Heterometallic Hydroxysulfates Ln2Cu(SO4)2(OH)4(Ln = Sm, Eu, Tb, or Dy) with a Two-Dimensional Triangle Network Crystal Growth & Design, 2015, 15, 2742 |
4513594 | CIF | C4 H9 N | P 1 21/c 1 | 8.74; 5.2169; 10.816 90; 110.284; 90 | 462.6 | Dobrzycki, Lukasz; Taraszewska, Paulina; Boese, Roland; Cyrański, Michał K. Pyrrolidine and Its Hydrates in the Solid State Crystal Growth & Design, 2015, 15, 4804 |
4510697 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.8708; 9.754; 5.3493 90; 90; 90 | 462.85 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4510698 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.8779; 9.7606; 5.3422 90; 90; 90 | 462.92 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4510703 | CIF | C6 H13 Cl N2 O4 | P m 21 n | 8.874; 9.757; 5.3488 90; 90; 90 | 463.12 | Olejniczak, Anna; Anioła, Michalina; Szafrański, Marek; Budzianowski, Armand; Katrusiak, Andrzej New Polar Phases of 1,4-Diazabicyclo[2.2.2]octane Perchlorate, An NH+···N Hydrogen-Bonded Ferroelectric Crystal Growth & Design, 2013, 13, 2872 |
4504612 | CIF | C12 H16 Cl4 N2 O6 Pd | P -1 | 6.9942; 8.5052; 8.9252 85.754; 73.059; 66.135 | 463.89 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4500334 | CIF | C3 H4 Ag N3 | P n a 21 | 11.1121; 10.9483; 3.8187 90; 90; 90 | 464.58 | Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies Crystal Growth & Design, 2011, 11, 796 |
4512969 | CIF | Cu H4 O12 S2 Sm2 | P 1 21/c 1 | 6.393; 6.792; 10.845 90; 98.616; 90 | 465.6 | Tang, Yingying; Cui, Meiyan; Guo, Wenbin; Zhang, Suyun; Yang, Ming; He, Zhangzhen Syntheses, Structure, and Magnetic Properties of New 3d‒4f Heterometallic Hydroxysulfates Ln2Cu(SO4)2(OH)4(Ln = Sm, Eu, Tb, or Dy) with a Two-Dimensional Triangle Network Crystal Growth & Design, 2015, 15, 2742 |
4504599 | CIF | C12 H16 Cl4 N2 O6 Pt | P -1 | 6.9551; 8.5188; 8.9795 86.462; 73.017; 66.472 | 465.61 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4501262 | CIF | C2 H10 Ce Cl3 O3 | P -1 | 6.9877; 8.7234; 8.7851 66.055; 74.133; 89.17 | 467.93 | Vaughn, Shae Anne; Severance, Rachel C.; Smith, Mark D.; zur Loye, Hans-Conrad Crystal Growth, Structural Motifs, and Optical Properties of Molecular and Polymeric Cerium Halide Materials Crystal Growth & Design, 2011, 11, 5072 |
4503555 | CIF | I6 In K3 O18 | P -1 | 6.9441; 7.0685; 10.639 98.14; 108.77; 102.72 | 469.4 | Liu, Xiaomin; Li, Guanghua; Hu, Yawei; Yang, Ming; Kong, Xianggui; Shi, Zhan; Feng, Shouhua Hydrothermal Synthesis and Crystal Structure of Polar and Nonpolar Compounds in Indium Iodate Family Crystal Growth & Design, 2008, 8, 2453 |
4508779 | CIF | C22 H4 F10 N4 O2 | P -1 | 7.3223; 7.5889; 8.714 83.383; 77.723; 89.083 | 469.98 | Tang, Hongding; Gao, Jian Ping; Xiong, Ying; Wang, Zhi Yuan Self-Assembled, Discrete Organic Tubular Crystals with Controllable Sizes by Simple Sublimation Crystal Growth & Design, 2006, 6, 1559 |
4509412 | CIF | C6 H3 Li O2 | P 1 21/c 1 | 10.302; 5.345; 8.662 90; 98.659; 90 | 471.5 | Banerjee, Debasis; Kim, Sun Jin; Parise, John B. Lithium Based Metal−Organic Framework with Exceptional Stability Crystal Growth & Design, 2009, 9, 2500 |
4503996 | CIF | C20 H10 F8 O4 | P -1 | 5.128; 5.4881; 17.557 93.484; 97.572; 104.33 | 472.3 | Mori, Yutaka; Matsumoto, Akikazu Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals Crystal Growth & Design, 2007, 7, 377 |
4514132 | CIF | C9 H10 N2 O4 | P 1 21 1 | 7.8515; 5.5447; 10.921 90; 96.39; 90 | 472.48 | Malaspina, Lorraine A.; Edwards, Alison J.; Woińska, Magdalena; Jayatilaka, Dylan; Turner, Michael J.; Price, Jason R.; Herbst-Irmer, Regine; Sugimoto, Kunihisa; Nishibori, Eiji; Grabowsky, Simon Predicting the Position of the Hydrogen Atom in the Short Intramolecular Hydrogen Bond of the Hydrogen Maleate Anion from Geometric Correlations Crystal Growth & Design, 2017, 17, 3812 |
4510586 | CIF | C13 H11 N | P 1 21 1 | 7.897; 5.861; 10.737 90; 108.062; 90 | 472.5 | Kupka, A.; Schauerte, C.; Merz, K. Isostructural Crystallization Behavior of Dihydroanthracene and Dihydroacridine Crystal Growth & Design, 2014, 14, 2985 |
4509506 | CIF | C6 H8 F6 N4 Si | C m m m | 6.54; 10.739; 6.74 90; 90; 90 | 473.4 | Boldog, Ishtvan; Daran, Jean-Claude; Chernega, Alexander N.; Rusanov, Eduard B.; Krautscheid, Harald; Domasevitch, Konstantin V. Hydrogen Bonding Patterns and Supramolecular Structure of 4,4′-Bipyrazolium Salts Crystal Growth & Design, 2009, 9, 2895 |
4512498 | CIF | C10 H8 O5 | P -1 | 3.6787; 9.529; 13.7468 91.611; 92.252; 100.278 | 473.48 | Knichal, Jane V.; Gee, William J.; Burrows, Andrew D.; Raithby, Paul R.; Wilson, Chick C. Role of Ethynyl-Derived Weak Hydrogen-Bond Interactions in the Supramolecular Structures of 1D, 2D, and 3D Coordination Polymers Containing 5-Ethynyl-1,3-benzenedicarboxylate Crystal Growth & Design, 2015, 15, 465 |
4508921 | CIF | C6 H10 N6 O4 | P -1 | 5.2073; 7.511; 13.112 100.32; 98.075; 106.344 | 474.2 | Eppel, Sagi; Bernstein, Joel Statistics-Based Design of Multicomponent Molecular Crystals with the Three-Center Hydrogen Bond Crystal Growth & Design, 2009, 9, 1683 |
4503761 | CIF | C16 H22 Cu N4 O10 | P -1 | 6.9946; 7.8872; 9.5558 96.301; 108.469; 104.092 | 474.86 | Choudhury, Somnath Ray; Gamez, Patrick; Robertazzi, Arturo; Chen, Chih-Yuan; Lee, Hon Man; Mukhopadhyay, Subrata Experimental Observation of Supramolecular Carbonyl-π/π-π/π-carbonyl and Carbonyl-π/π-π/π-anion Assemblies Supported by Theoretical Studies Crystal Growth & Design, 2008, 8, 3773 |
4512651 | CIF | C5 H9 Lu N2 O8 | C 1 2 1 | 11.081; 7.0226; 6.485 90; 109.129; 90 | 476.8 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4511329 | CIF | C10 H9 N3 O2 | P 1 21 1 | 4.315; 19.046; 5.83 90; 94.72; 90 | 477.5 | Zhao, Xia-Xia; Ma, Jian-Ping; Dong, Yu-Bin; Huang, Ru-Qi; Lai, Tianshu Construction of Metal−Organic Frameworks (M = Cd(II), Co(II), Zn(II), and Cu(II)) Based on Semirigid Oxadiazole Bridging Ligands by Solution and Hydrothermal Reactions Crystal Growth & Design, 2007, 7, 1058 |
4503049 | CIF | C20 H18 N4 O8 | P -1 | 11.39876; 11.8643; 3.80225 96.3647; 95.9064; 108.898 | 478.197 | Neels, Antonia; Mantero, Déborah González; Stoeckli-Evans, Helen Solid-State Synthesis of New Diimide Compounds: A Two-Step Reaction Followed by X-ray Powder Diffraction Crystal Growth & Design, 2008, 8, 1147 |
4509087 | CIF | C14 H20 Cu2 N4 O12 | P -1 | 7.5537; 8.0458; 9.1444 112.811; 103.164; 99.505 | 478.53 | Wang, Chih-Chieh; Ke, Meu-Ju; Tsai, Cheng-Hsiao; Chen, I-Hsuan; Lin, Shin-I; Lin, Tzuen-Yeuan; Wu, Li-Mei; Lee, Gene-Hsiang; Sheu, Hwo-Shuenn; Fedorov, Vladimir E. [M(C5O5)2(H2O)n]2−as a Building Block for Hetero- and Homo-bimetallic Coordination Polymers: From 1D Chains to 3D Supramolecular Architectures Crystal Growth & Design, 2009, 9, 1013 |
4510584 | CIF | C27.4 H23 N0.6 | P 1 21 1 | 7.749; 6.056; 10.71 90; 107.694; 90 | 478.8 | Kupka, A.; Schauerte, C.; Merz, K. Isostructural Crystallization Behavior of Dihydroanthracene and Dihydroacridine Crystal Growth & Design, 2014, 14, 2985 |
4510585 | CIF | C27 H23 N | P 1 21 1 | 7.749; 6.056; 10.71 90; 107.694; 90 | 478.8 | Kupka, A.; Schauerte, C.; Merz, K. Isostructural Crystallization Behavior of Dihydroanthracene and Dihydroacridine Crystal Growth & Design, 2014, 14, 2985 |
4503461 | CIF | C26 H16 N2 S2 | P -1 | 6.1928; 8.2608; 9.9612 85.299; 75.535; 76.1 | 478.86 | Yue, Wei; Tian, HongKun; Hu, Ninghai; Geng, Yanhou; Wang, Fosong Crystal Packing Motifs of Oligothiophenes End-Capped withN-Containing Aryls Crystal Growth & Design, 2008, 8, 2352 |
4508435 | CIF | C12 H8 F2 N2 | P 1 21/c 1 | 9.779; 3.735; 13.188 90; 95.492; 90 | 479.47 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4500141 | CIF | C2 H7 Li O4 | C m m m | 6.734; 10.885; 6.565 90; 90; 90 | 481.21 | Martínez Casado, F. J.; Ramos Riesco, M.; Redondo, M. I.; Choquesillo-Lazarte, D.; López-Andrés, S.; Cheda, J. A. Rodríguez Anhydrous Lithium Acetate Polymorphs and Its Hydrates: Three-Dimensional Coordination Polymers Crystal Growth & Design, 2011, 11, 1021 |
4513008 | CIF | C6 H16 Br6 N4 O4 Re | P -1 | 8.2613; 8.3131; 8.3431 108.544; 111.239; 99.162 | 481.3 | Martínez-Lillo, José; Pedersen, Anders H.; Faus, Juan; Julve, Miguel; Brechin, Euan K. Effect of Protonated Organic Cations and Anion−π Interactions on the Magnetic Behavior of Hexabromorhenate(IV) Salts Crystal Growth & Design, 2015, 15, 2598 |
4506149 | CIF | C8 H17 Br N2 | P 1 21 1 | 6.7367; 11.1967; 6.7849 90; 109.688; 90 | 481.86 | Lauw, Yansen; Rüther, Thomas; Horne, Michael D.; Wallwork, Kia S.; Skelton, Brian W.; Madsen, Ian C.; Rodopoulos, Theo Structural Studies on the Basic Ionic Liquid 1-Ethyl-1,4-diazabicyclo[2.2.2]octanium Bis(trifluoromethylsulfonyl)imide and Its Bromide Precursor Crystal Growth & Design, 2012, 12, 2803 |
4509088 | CIF | C14 H20 Co Cu N4 O12 | P -1 | 7.1591; 8.4702; 9.353 101.792; 106.691; 109.665 | 482.25 | Wang, Chih-Chieh; Ke, Meu-Ju; Tsai, Cheng-Hsiao; Chen, I-Hsuan; Lin, Shin-I; Lin, Tzuen-Yeuan; Wu, Li-Mei; Lee, Gene-Hsiang; Sheu, Hwo-Shuenn; Fedorov, Vladimir E. [M(C5O5)2(H2O)n]2−as a Building Block for Hetero- and Homo-bimetallic Coordination Polymers: From 1D Chains to 3D Supramolecular Architectures Crystal Growth & Design, 2009, 9, 1013 |
4500476 | CIF | C14 H20 Co N10 O8 | P -1 | 7.01; 7.988; 9.281 86.344; 83.185; 69.55 | 483.4 | Mishra, Ashutosh Kumar; Kumar, Jitendra; Khanna, Shruti; Verma, Sandeep Crystallographic Signatures of Cobalt Coordination with Modified Adenine Nucleobase Containing Carboxyl Group Pendants Crystal Growth & Design, 2011, 11, 1623 |
4501702 | CIF | C6 H6 | P b c a | 7.3801; 9.5154; 6.9029 90; 90; 90 | 484.75 | Katrusiak, Andrzej; Podsiadło, Marcin; Budzianowski, Armand Association CH···π and No van der Waals Contacts at the Lowest Limits of Crystalline Benzene I and II Stability Regions† Crystal Growth & Design, 2010, 10, 3461 |
4503997 | CIF | C20 H8 F10 O4 | P -1 | 5.2; 5.486; 17.773 93.41; 95.44; 105.3 | 485 | Mori, Yutaka; Matsumoto, Akikazu Molecular Stacking and Photoreactions of Fluorine-Substituted Benzyl Muconates in the Crystals Crystal Growth & Design, 2007, 7, 377 |
4512650 | CIF | C5 H9 N2 O8 Yb | C 1 2 1 | 11.127; 7.087; 6.5183 90; 109.334; 90 | 485.03 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4516390 | CIF | C8 H4 O8 Pb2 | P -1 | 7.952; 8.1662; 8.7137 72.38; 66.27; 73.574 | 485.23 | Gabriel, Catherine; Vangelis, Angelos A.; Raptopoulou, Catherine P.; Terzis, Aris; Psycharis, Vassilis; Zervou, Maria; Bertmer, Marko; Salifoglou, Athanasios Structural‒Spectrochemical Correlations of Variable Dimensionality Crystalline Metal‒Organic Framework Materials in Hydrothermal Reactivity Patterns of Binary‒Ternary Systems of Pb(II) with (a)Cyclic (Poly)carboxylate and Aromatic Chelator Ligands Crystal Growth & Design, 2015, 15, 5310 |
4505312 | CIF | C10 H16 N2 O2 | P 1 21/m 1 | 5.6414; 10.0737; 8.6069 90; 96.624; 90 | 485.86 | Brewer, Jason T.; Parkin, Sean; Grossman, Robert B. A Systematic Study of the Relationship between Molecular and Crystal Structure among 3,5-Diazabicyclo[2.2.2]octane-2,6-diones Crystal Growth & Design, 2004, 4, 591 |
4509086 | CIF | C14 H20 Cu N4 O12 Zn | P -1 | 7.2193; 8.464; 9.3642 101.239; 106.892; 110.011 | 486.1 | Wang, Chih-Chieh; Ke, Meu-Ju; Tsai, Cheng-Hsiao; Chen, I-Hsuan; Lin, Shin-I; Lin, Tzuen-Yeuan; Wu, Li-Mei; Lee, Gene-Hsiang; Sheu, Hwo-Shuenn; Fedorov, Vladimir E. [M(C5O5)2(H2O)n]2−as a Building Block for Hetero- and Homo-bimetallic Coordination Polymers: From 1D Chains to 3D Supramolecular Architectures Crystal Growth & Design, 2009, 9, 1013 |
4508434 | CIF | C12 H8 F2 N2 | P 1 21/c 1 | 7.1516; 5.858; 12.2714 90; 108.672; 90 | 487.04 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4508211 | CIF | C14 H22 O8 P2 S2 | P -1 | 6.9607; 8.5205; 9.134 75.578; 71.587; 74.493 | 487.19 | Białek, Michał J.; Zaręba, Jan K.; Janczak, Jan; Zoń, Jerzy Chains, Layers, Channels, and More: Supramolecular Chemistry of Potent Diphosphonic Tectons with Tuned Flexibility. The Generation of Pseudopolymorphs, Polymorphs, and Adducts Crystal Growth & Design, 2013, 13, 4039 |
4506958 | CIF | C18 H6 F18 N2 | P -1 | 5.0202; 5.2709; 18.535 85.068; 85.602; 88.84 | 487.2 | Sun, Haoran; Tottempudi, Usha K.; Mottishaw, Jeffery D.; Basa, Prem N.; Putta, Anjaneyulu; Sykes, Andrew G. Strengthening π‒π Interactions While Suppressing Csp2‒H···π (T-Shaped) Interactions via Perfluoroalkylation: A Crystallographic and Computational Study That Supports the Beneficial Formation of 1-D π‒π Stacked Aromatic Materials Crystal Growth & Design, 2012, 12, 5655 |
4503783 | CIF | C9 H9 Br O3 | P 1 21 1 | 6.62; 4.911; 15.332 90; 101.158; 90 | 489 | Breen, Meghan E.; Tameze, Shella L.; Dougherty, William G.; Kassel, W. Scott; Wheeler, Kraig A. Structural Studies of Enantiomers, Racemates, and Quasiracemates. 2-(3-Bromophenoxy)propionic Acid and 2-(3-Methoxyphenoxy)propionic Acid Crystal Growth & Design, 2008, 8, 3863 |
4512649 | CIF | C5 H9 N2 O8 Tm | C 1 2 1 | 11.172; 7.102; 6.539 90; 109.472; 90 | 489.15 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4505481 | CIF | C9 H8 Mn O6 | P 1 21 1 | 5.204; 9.634; 9.777 90; 91.737; 90 | 489.95 | Chen, Zhi; Gao, Dong-Liang; Diao, Chun-Hua; Liu, Yue; Ren, Jia; Chen, Ji; Zhao, Bin; Shi, Wei; Cheng, Peng Syntheses, Structures Tuned by 4,4′-Bipyridine and Magnetic Properties of a Series of Transition Metal Compounds Containingo-Carboxylphenoxyacetate Acid Crystal Growth & Design, 2012, 12, 1201 |
4501123 | CIF | C6 H16 Br2 N2 O | P 1 21 1 | 6.516; 12.037; 6.792 90; 113.06; 90 | 490.2 | Andrzejewski, Michał; Olejniczak, Anna; Katrusiak, Andrzej Humidity Control of Isostructural Dehydration and Pressure-Induced Polymorphism in 1,4-Diazabicyclo[2.2.2]octane Dihydrobromide Monohydrate Crystal Growth & Design, 2011, 11, 4892 |
4512918 | CIF | O9 Rb2 Si3 Th | P 63/m | 7.3064; 7.3064; 10.604 90; 90; 120 | 490.24 | Mann, J. Matthew; McMillen, Colin D.; Kolis, Joseph W. Crystal Chemistry of Alkali Thorium Silicates Under Hydrothermal Conditions Crystal Growth & Design, 2015, 15, 2643 |
4500151 | CIF | C8 H8 Ca O8 | P -1 | 6.0146; 7.6214; 11.0855 104.367; 93.316; 91.769 | 490.9 | Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations Crystal Growth & Design, 2011, 11, 699 |
4508623 | CIF | Ba2 Cu2 O10 Y4 | P n m a | 12.175; 5.6591; 7.1287 90; 90; 90 | 491.16 | Mele, P.; Ubaldini, A.; Carnasciali, M. M.; Costa, G. A.; Scavini, M. Growth and Structural Characterization of Needlelike Crystals in the Y−Ba−Cu−O System Crystal Growth & Design, 2006, 6, 1761 |
4505868 | CIF | C24 H20 N2 O4 | P -1 | 6.405; 9.197; 9.482 67.88; 74.09; 75.85 | 491.33 | Tsaggeos, Kostas; Masiera, Natalia; Niwicka, Aleksandra; Dokorou, Vassiliki; Siskos, Michael G.; Skoulika, Stavroula; Michaelides, Adonis Crystal Structure, Thermal Behavior, and Photochemical Reactivity of a Series of Co-Crystals oftrans-1,2-Bis(4-pyridyl) Ethylene with Dicarboxylic Acids Crystal Growth & Design, 2012, 12, 2187 |
4505184 | CIF | C6 H10 Cl2 N4 O4 | P 1 21/c 1 | 7.707; 4.869; 13.3 90; 99.946; 90 | 491.59 | Kühl, Olaf; Goutal, Sigrid Acid/Base versus Redox Reaction−The Case of Chloranilic Acid and Hydrazine: A Supramolecular Decision? Crystal Growth & Design, 2005, 5, 1875 |
4507097 | CIF | C9 H11 N O5 | P -1 | 7.038; 7.257; 10.452 97.4; 108.96; 97.8 | 491.6 | Tothadi, Srinu; Desiraju, Gautam R. Synthon Modularity in 4-Hydroxybenzamide‒Dicarboxylic Acid Cocrystals Crystal Growth & Design, 2012, 12, 6188 |
4509389 | CIF | C11 H9 N3 O2 | P 1 21 1 | 6.3349; 3.9263; 19.79 90; 92.424; 90 | 491.8 | Dureisseix, Valérie; Sanselme, Morgane; Robin, Yves; Coquerel, Gérard Two Concomitant Polymorphs of 1,2-Naphthoquinone-2-semicarbazone Crystal Growth & Design, 2009, 9, 3438 |
4504658 | CIF | C4 H4 F N3 O | P 1 21/n 1 | 4.0629; 9.5211; 12.7386 90; 92.986; 90 | 492.1 | Hulme, Ashley T.; Tocher, Derek A. The Discovery of New Crystal Forms of 5-Fluorocytosine Consistent with the Results of Computational Crystal Structure Prediction Crystal Growth & Design, 2006, 6, 481-487 |
4502405 | CIF | C6 H10 N24 O2 Zn3 | P -3 | 9.4502; 9.4502; 6.3642 90; 90; 120 | 492.22 | Zhong, Di-Chang; Lu, Wen-Guan; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu Three Coordination Polymers Based on 1H-Tetrazole (HTz) Generated via in Situ Decarboxylation: Synthesis, Structures, and Selective Gas Adsorption Properties Crystal Growth & Design, 2010, 10, 739 |
4508433 | CIF | C12 H8 F2 N2 | P 1 21/c 1 | 3.8035; 5.8716; 22.123 90; 91.26; 90 | 493.95 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4504534 | CIF | C26 H22 N4 | P -1 | 6.864; 7.2851; 11.239 92.26; 106.75; 111.31 | 494.8 | Cho, Bo-Yeun; Min, Dongwon; Lee, Soon W. A Long 3,3‘-Bipyridine-Type Linking Ligand and Its Coordination Polymers: [ZnL(NO3)2], [CoL1.5(NO3)2], and [CoL2(NO3)2]·X (L = py-CHN−(CH3)C6H3−C6H3(CH3)−NCH-py); X = Benzene, Toluene) Crystal Growth & Design, 2006, 6, 342 |
4509136 | CIF | C2 H6 Cd Cl2 N10 | P 1 21/n 1 | 3.7527; 16.473; 8.0342 90; 94.71; 90 | 494.98 | Yao, Ya-Li; Xue, Lin; Che, Yun-Xia; Zheng, Ji-Min Syntheses, Structures, and Characterizations of Two Pairs of Cd(II)-5-Aminotetrazolate Coordination Polymers Crystal Growth & Design, 2009, 9, 606 |
4505820 | CIF | C10 H10 N2 O6 | P -1 | 5.3223; 7.831; 12.08 99.815; 91.105; 91.279 | 495.9 | Luo, Tzy-Jiun M.; Palmore, G. Tayhas R. Engineering Crystalline Architecture with Supramolecular Tapes: Studies on Secondary Donor−Acceptor Interactions in Cocrystals of the Cyclic Dipeptide of Glycine Crystal Growth & Design, 2002, 2, 337 |
4518392 | CIF HKL | C12 H6 N4 | P 1 21/c 1 | 3.8118; 10.0388; 12.9838 90; 91.328; 90 | 496.7 | Peter, Aneeshma; Mohan, Midhun; Maris, Thierry; Wuest, James D.; Duong, Adam Comparing Crystallizations in Three Dimensions and Two Dimensions: Behavior of Isomers of [2,2?-Bipyridine]dicarbonitrile and [1,10-Phenanthroline]dicarbonitrile Crystal Growth and Design, 2017, 17, 5242-5248 |
4512648 | CIF | C5 H9 Ho N2 O8 | C 1 2 1 | 11.2487; 7.1296; 6.5731 90; 109.51; 90 | 496.89 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4504191 | CIF | C8 H5 Mn2 N O8 | P -1 | 6.7169; 9.0656; 9.1565 74.93; 74.262; 70.52 | 497.03 | Wang, Xian-Wen; Dong, You-Ren; Zheng, Yue-Qing; Chen, Jing-Zhong A Novel Five-Connected BN Topological Network Metal−Organic Framework Mn(II) Cluster Complex Crystal Growth & Design, 2007, 7, 613 |
4500142 | CIF | C3 H4 Cu N3 S | P 1 21/n 1 | 8.8195; 5.0838; 11.78 90; 109.4; 90 | 498.19 | Wang, Yu-Ling; Zhang, Na; Liu, Qing-Yan; Shan, Zeng-Mei; Cao, Rong; Wang, Ming-Sheng; Luo, Jun-Jian; Yang, Er-Lei Diversity of Architecture of Copper(I) Coordination Polymers Constructed of Copper(I) Halides and 4-Methyl-1,2,4-Triazole-3-Thiol (Hmptrz) Ligand: Syntheses, Structures, and Luminescent Properties Crystal Growth & Design, 2011, 11, 130 |
4511997 | CIF | C12 H12 Br6 N6 Re | P -1 | 7.3551; 8.0853; 8.6347 86.985; 77.629; 84.01 | 498.59 | Martínez-Lillo, José; Kong, John; Julve, Miguel; Brechin, Euan K. Self-Assembly of the Hexabromorhenate(IV) Anion with Protonated Benzotriazoles: X-ray Structure and Magnetic Properties Crystal Growth & Design, 2014, 14, 5985 |
4505076 | CIF | C12 H8 Cl Cu N O | P -1 | 3.7498; 11.5531; 11.6843 89.189; 80.976; 86.25 | 498.85 | Chen, Shu-Mei; Lu, Can-Zhong; Xia, Chang-Kun; Xu, Xin-Jiang; Zhai, Quan-Guo Reactivity of 1,4-Bis[2-(5-phenyloxazoly)]benzene toward Cu Salts under Different Reaction Conditions Crystal Growth & Design, 2005, 5, 1485 |
4512643 | CIF | C5 H9 N2 O8 Y | C 1 2 1 | 11.2621; 7.1374; 6.5867 90; 109.523; 90 | 499.01 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4505428 | CIF | C11 H12 N2 O2 | P -1 | 5.921; 8.057; 11.136 70.92; 87.63; 83.82 | 499.1 | Gordon-Wylie, Scott W.; Teplin, Eleanor; Morris, James C.; Trombley, Margaret I.; McCarthy, Sean M.; Cleaver, William M.; Clark, George R. Exploring Hydrogen-Bonded Structures: Synthesis and X-ray Crystallographic Screening of a Cisoid Cyclic Dipeptide Mini-Library Crystal Growth & Design, 2004, 4, 789 |
4501574 | CIF | C10 H8 Cl N O2 Zn | P -1 | 7.165; 7.332; 10.218 74.64; 75.171; 85.179 | 500.3 | Hulvey, Zeric; Furman, Joshua D.; Turner, Sara A.; Tang, Min; Cheetham, Anthony K. Dimensionality Trends in Metal−Organic Frameworks Containing Perfluorinated or Nonfluorinated Benzenedicarboxylates Crystal Growth & Design, 2010, 10, 2041 |
4503497 | CIF | C6 H6 N2 O7 Pb | P -1 | 7.1828; 8.369; 9.7794 110.925; 90.643; 112.354 | 500.42 | Zhao, Ya-Hui; Xu, Hong-Bin; Fu, Yao-Mei; Shao, Kui-Zhan; Yang, Shuang-Yang; Su, Zhong-Min; Hao, Xiang-Rong; Zhu, Dong-Xia; Wang, En-Bo A Series of Lead(II)-Organic Frameworks Based on Pyridyl Carboxylate Acid N-Oxide Derivatives: Syntheses, Structures, and Luminescent Properties Crystal Growth & Design, 2008, 8, 3566 |
4504177 | CIF | C5 H13 Cl N3 Ni0.5 O4 | P -1 | 7.502; 7.584; 10.383 104.85; 94.05; 116.11 | 501.16 | Mastropietro, Teresa F.; Armentano, Donatella; Marino, Nadia; De Munno, Giovanni; Anastassopoulou, Jane; Theophanides, Theophilos Supramolecular Assemblies of Nucleobase Derivative 1-Mecyt with Mg(II) and Ni(II) and Solid-State Transformation of Ni(II) Phase: A Comprehensive Evidence of Their Different Reactivity toward 1-Mecyt [1-Mecyt = 1-Methylcytosine] Crystal Growth & Design, 2007, 7, 609 |
4501373 | CIF | C6 Ca Cl2 N2 O2 | P -1 | 9.68836; 9.27808; 6.19667 103.035; 98.5641; 107.858 | 502.027 | Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients Crystal Growth & Design, 2011, 11, 5621 |
4501684 | CIF | C12 H9 F N2 O2 | P -1 | 3.7408; 10.3642; 14.0516 109.449; 97.4322; 96.3926 | 502.39 | Long, Sihui; Li, Tonglei Enforcing Molecule’s π-Conjugation and Consequent Formation of the Acid−Acid Homosynthon over the Acid−Pyridine Heterosynthon in 2-Anilinonicotinic Acids Crystal Growth & Design, 2010, 10, 2465 |
4504128 | CIF | C4 H13 N O6 P2 Zn | P -1 | 4.8852; 9.986; 10.432 92.918; 98.418; 90.801 | 502.7 | Fu, Ruibiao; Hu, Shengmin; Wu, Xintao Mix-Solvothermal Syntheses, Characterization, and Properties of New Zinc Diphosphonates with Zn−O−P Chains, Layers, and 3D Frameworks Crystal Growth & Design, 2007, 7, 1134 |
4517037 | CIF | C20 H22 N2 O10 | P -1 | 6.0716; 9.41; 10.012 64.52; 78.8; 80.197 | 504.12 | Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia Co-Crystals and Salts Obtained from Dinitrogen Bases and 1,2,3,4-Cyclobutane Tetracarboxylic Acid and the Use of the Latter As a Template for Solid-State Photocyclization Reactions Crystal Growth & Design, 2012, 12, 4880 |
4505800 | CIF | C9 H9 Br3 | P -1 | 7.692; 9.0616; 9.0813 119.833; 106.877; 95.091 | 504.3 | Bosch, Eric; Barnes, Charles L. Triangular Halogen−Halogen−Halogen Interactions as a Cohesive Force in the Structures of Trihalomesitylenes Crystal Growth & Design, 2002, 2, 299 |
4513789 | CIF | C8 H11 N5 O3 | P -1 | 6.6058; 8.7163; 8.8843 81.34; 87.63; 87.47 | 504.9 | Eddleston, Mark D.; Arhangelskis, Mihails; Fábián, Laszlo; Tizzard, Graham J.; Coles, Simon J.; Jones, William Investigation of an Amide-Pseudo Amide Hydrogen Bonding Motif within a Series of Theophylline:Amide Cocrystals Crystal Growth & Design, 2015 |
4512647 | CIF | C5 H9 N2 O8 Tb | C 1 2 1 | 11.3379; 7.1677; 6.608 90; 109.69; 90 | 505.61 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4500036 | CIF | C30 H22 | P -1 | 5.853; 7.4229; 11.8341 83.8; 89.608; 81.588 | 505.62 | Gagnon, Eric; Maris, Thierry; Arseneault, Pierre-Marc; Maly, Kenneth E.; Wuest,James D Structural Features in Crystals of Derivatives of Benzene with Multiple Contiguous Phenyl Substituents Cryst. Growth & Design, 2010, 10, 648-657 |
4500956 | CIF | C4 H8 O2 | P -1 | 7.094; 7.6307; 10.9005 70.738; 83.647; 65.339 | 505.98 | Yakovenko, Andrey A.; Gallegos, Jose H.; Antipin, Mikhail Yu.; Masunov, Artem; Timofeeva, Tatiana V. Crystal Morphology as an Evidence of Supramolecular Organization in Adducts of 1,2-Bis(chloromercurio)tetrafluorobenzene with Organic Esters Crystal Growth & Design, 2011, 11, 3964 |
4511704 | CIF | C20 H22 Cu N4 O8 | P -1 | 6.3708; 6.8768; 12.2249 95.797; 97.358; 105.452 | 506.83 | Chen, 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 |
4502927 | CIF | C10 H14 N2 O3 | P -1 | 5.391; 9.6335; 10.2582 73.516; 87.835; 82.886 | 506.92 | Kołodziejczak, Jerzy; Adamczyk-Woźniak, Agnieszka; Hachuła, Barbara; Barys, Maciej; Flakus, Henryk T.; Sporzyński, Andrzej; Koll, Aleksander Intermolecular Interactions in the Solid State of Ionic Secondary Mannich Bases Crystal Growth & Design, 2012, 12, 589 |
4503811 | CIF | C7 H13 Cu N2 O5 | P -1 | 7.5307; 8.7478; 8.7673 100.595; 93.595; 115.24 | 507.01 | Karabach, Yauhen Y.; Kirillov, Alexander M.; Haukka, Matti; Sanchiz, Joaquin; Kopylovich, Maximilian N.; Pombeiro, Armando J. L. Multicopper(II) Pyromellitate Compounds: Self-Assembly Synthesis, Structural Topologies, and Magnetic Features Crystal Growth & Design, 2008, 8, 4100 |
4503090 | CIF | C16 H12 Cd3 N2 O16 | P -1 | 6.5548; 8.5026; 10.02 109.39; 96.87; 100.86 | 507.2 | Zou, Ru-Qiang; Zhong, Rui-Qin; Du, Miao; Pandey, Daya S.; Xu, Qiang Controllable Congregating of Homochiral and Achiral Coordination Polymers: Cadmium(II) Pyridine-2,4,6-Tricarboxylate Species with Double-Helical Strand and Molecular Building Block Structures Crystal Growth & Design, 2008, 8, 452 |
4502012 | CIF | C2 H5 Cd2 N5 O8 S2 | P -1 | 6.6588; 9.2325; 9.7163 65.843; 73.302; 71.083 | 507.242 | Paul, Avijit Kumar; Sanyal, Udishnu; Natarajan, Srinivasan Use of Polyazaheterocycles in the Assembly of New Cadmium Sulfate Frameworks: Synthesis, Structure, and Properties Crystal Growth & Design, 2010, 10, 4161 |
4502127 | CIF | C14 H26 Cl N5 O7 | P 1 | 7.2403; 8.5435; 8.9865 68.722; 79.451; 81.852 | 507.51 | Ge, Ying-Ying; Li, Guo-Bi; Fang, Hua-Cai; Zhan, Xu-Lin; Gu, Zhi-Gang; Chen, Jin-Hao; Sun, Feng; Cai, Yue-Peng; Thallapally, Praveen K. Auxiliary Ligand-Dependent Assembly of Several Ni/Ni−Cd Compounds with N2O2Donor Tetradentate Symmetrical Schiff Base Ligand Crystal Growth & Design, 2010, 10, 4987 |
4501372 | CIF | C3 H10 Ca Cl2 N2 O4 | P -1 | 5.9055; 8.0258; 11.5035 71.208; 80.134; 85.297 | 508.32 | Braga, Dario; Grepioni, Fabrizia; Lampronti, Giulio I.; Maini, Lucia; Turrina, Alessandro Ionic Co-crystals of Organic Molecules with Metal Halides: A New Prospect in the Solid Formulation of Active Pharmaceutical Ingredients Crystal Growth & Design, 2011, 11, 5621 |
4508936 | CIF | C8 H6 Cl2 Hg N4 | P -1 | 3.7705; 10.4396; 12.9752 90.8017; 91.5785; 93.7126 | 509.41 | Wu, Jing-Yun; Hsu, Hung-Yu; Chan, Chun-Chieh; Wen, Yuh-Sheng; Tsai, Chiitang; Lu, Kuang-Lieh Formation of Infinite Linear Mercury Metal Chains Assisted by Face-to-Face π−π (Aryl−Aryl) Stacking Interactions Crystal Growth & Design, 2009, 9, 258 |
4512646 | CIF | C5 H9 Gd N2 O8 | C 1 2 1 | 11.38; 7.182; 6.628 90; 109.754; 90 | 509.8 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4501650 | CIF | C10 H8 N8 | P -1 | 6.2512; 6.7897; 12.781 85.939; 80.652; 72.413 | 510.1 | Li, Cheng-Peng; Zhao, Xiao-Hu; Chen, Xu-Dong; Yu, Qian; Du, Miao Metal-Involved Solvothermal Interconversions of Pyrazinyl Substituted Azole Derivatives: Controllability and Mechanism Crystal Growth & Design, 2010, 10, 5034 |
4501393 | CIF | C18 H22 Cu N4 O6 | P -1 | 7.6683; 8.5377; 8.605 73.392; 71.199; 83.191 | 510.84 | Mukherjee, Gargi; Biradha, Kumar Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes Crystal Growth & Design, 2011, 11, 5649 |
4503600 | CIF | C12 H10 N2 O2 | P 1 | 5.2868; 9.0544; 11.0476 80.7188; 82.7611; 79.9327 | 511.27 | Long, Sihui; Parkin, Sean; Siegler, Maxime A.; Cammers, Arthur; Li, Tonglei Polymorphism and Phase Behaviors of 2-(Phenylamino)nicotinic Acid Crystal Growth & Design, 2008, 8, 4006 |
4511859 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8111; 19.933; 5.483 90; 103.41; 90 | 511.48 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4517038 | CIF | C20 H22 N2 O10 | P -1 | 7.1154; 7.6589; 10.6261 73.925; 82.258; 66.876 | 511.51 | Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia Co-Crystals and Salts Obtained from Dinitrogen Bases and 1,2,3,4-Cyclobutane Tetracarboxylic Acid and the Use of the Latter As a Template for Solid-State Photocyclization Reactions Crystal Growth & Design, 2012, 12, 4880 |
4513788 | CIF | C8 H11 N5 O3 | P 1 21/m 1 | 8.7314; 6.6582; 8.8996 90; 98.546; 90 | 511.64 | Eddleston, Mark D.; Arhangelskis, Mihails; Fábián, Laszlo; Tizzard, Graham J.; Coles, Simon J.; Jones, William Investigation of an Amide-Pseudo Amide Hydrogen Bonding Motif within a Series of Theophylline:Amide Cocrystals Crystal Growth & Design, 2015 |
4511870 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8078; 19.908; 5.4958 90; 103.298; 90 | 511.92 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4511871 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.809; 19.923; 5.4926 90; 103.349; 90 | 512.03 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4508391 | CIF | C6 H7 N7 O5 | P -1 | 6.8634; 8.126; 10.584 82.58; 71.724; 66.004 | 512.1 | Ivanova, Bojidarka; Spiteller, Michael On the application of the organic barbiturates as NLO materials Crystal Growth and Design, 2010, 10, 2470-2474 |
4500215 | CIF | C4 H7 Li O2 | P 1 21/c 1 | 11.8; 4.911; 8.846 90; 91.41; 90 | 512.47 | Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers Crystal Growth & Design, 2011, 11, 759 |
4517035 | CIF | C20 H24 N2 O10 | P -1 | 7.1418; 7.6788; 10.5822 73.72; 81.906; 67.038 | 512.6 | Braga, Dario; d’Agostino, Simone; Grepioni, Fabrizia Co-Crystals and Salts Obtained from Dinitrogen Bases and 1,2,3,4-Cyclobutane Tetracarboxylic Acid and the Use of the Latter As a Template for Solid-State Photocyclization Reactions Crystal Growth & Design, 2012, 12, 4880 |
4505819 | CIF | C10 H10 N2 O6 | P 1 21/c 1 | 12.08; 6.278; 6.788 90; 95.017; 90 | 512.8 | Luo, Tzy-Jiun M.; Palmore, G. Tayhas R. Engineering Crystalline Architecture with Supramolecular Tapes: Studies on Secondary Donor−Acceptor Interactions in Cocrystals of the Cyclic Dipeptide of Glycine Crystal Growth & Design, 2002, 2, 337 |
4509652 | CIF | C16 H24 N6 O6 S2 | P -1 | 6.6862; 7.7976; 10.6689 100.038; 98.454; 106.649 | 513.2 | Soegiarto, Airon C.; Ward, Michael D. Directed Organization of Dye Aggregates in Hydrogen-Bonded Host Frameworks Crystal Growth & Design, 2009, 9, 3803 |
4504699 | CIF | C16 H20 N8 O8 Zn | P -1 | 7.6749; 7.9808; 9.888 95.491; 105.737; 114.892 | 513.3 | Ghosh, A. K.; Jana, A. D.; Ghoshal, D.; Mostafa, G.; Chaudhuri, N. Ray Toward the Recognition of Enolates/Dicarboxylates: Syntheses and X-ray Crystal Structures of Supramolecular Architectures of Zn(II)/Cd(II) Using 2,2‘-Biimidazole Crystal Growth & Design, 2006, 6, 701 |
4512645 | CIF | C5 H9 Eu N2 O8 | C 1 2 1 | 11.4164; 7.1985; 6.6405 90; 109.829; 90 | 513.37 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4511861 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.814; 19.924; 5.5056 90; 103.356; 90 | 513.8 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4511869 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8117; 19.917; 5.5101 90; 103.221; 90 | 514.06 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4503828 | CIF | C12 H11 N O3 | P 1 c 1 | 5.038; 10.012; 10.362 90; 100.33; 90 | 514.2 | Shattock, Tanise R.; Arora, Kapildev K.; Vishweshwar, Peddy; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Carboxylic Acid···Pyridine Hydrogen Bonds in Cocrystals That also Contain a Hydroxyl Moiety Crystal Growth & Design, 2008, 8, 4533 |
4509501 | CIF | C6 H8 I2 N4 | C 1 2/m 1 | 13.82; 7.521; 5.232 90; 108.97; 90 | 514.3 | Boldog, Ishtvan; Daran, Jean-Claude; Chernega, Alexander N.; Rusanov, Eduard B.; Krautscheid, Harald; Domasevitch, Konstantin V. Hydrogen Bonding Patterns and Supramolecular Structure of 4,4′-Bipyrazolium Salts Crystal Growth & Design, 2009, 9, 2895 |
4509940 | CIF | C18 H14 Br4 N2 O6 | P -1 | 6.4938; 9.2279; 9.9675 64.0531; 85.7704; 73.6886 | 514.63 | Dey, Sanjoy Kumar; Saha, Rajat; Biswas, Susobhan; Layek, Animesh; Middya, Somnath; Steele, Ian M.; Fleck, Michel; Ray, Partha Pratim; Kumar, Sanjay Tetrabromoterepthalic Acid in Designing Co-crystals and Salts: Modification of Optical Properties and Schottky Barrier Effect Crystal Growth & Design, 2014, 14, 207 |
4511860 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8207; 19.966; 5.5008 90; 103.363; 90 | 515.12 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4512917 | CIF | Cs2 O9 Si3 Th | P 63/m | 7.4738; 7.4738; 10.674 90; 90; 120 | 516.35 | Mann, J. Matthew; McMillen, Colin D.; Kolis, Joseph W. Crystal Chemistry of Alkali Thorium Silicates Under Hydrothermal Conditions Crystal Growth & Design, 2015, 15, 2643 |
4512644 | CIF | C5 H9 N2 O8 Sm | C 1 2 1 | 11.43; 7.22; 6.655 90; 109.912; 90 | 516.4 | Samarasekere, Pradeep; Wang, Xiqu; Kaveevivitchai, Watchareeya; Jacobson, Allan J. Reactions of Rare Earth Hydrated Nitrates and Oxides with Formamide: Relevant to Recycling Rare Earth Metals Crystal Growth & Design, 2015, 15, 1119 |
4502066 | CIF | C6 H26 Ga2 N2 O20 S4 | P -1 | 5.6262; 8.9854; 10.3386 87.2207; 82.1832; 87.5904 | 516.86 | Kaufman, Elizabeth A.; Zeller, Matthias; Norquist, Alexander J. A Slow Leak Synthetic Route to Organically Templated Gallium Sulfates Crystal Growth & Design, 2010, 10, 4656 |
4505386 | CIF | C5 H5 N S | P 1 21/c 1 | 7.2281; 6.1499; 11.6316 90; 90.449; 90 | 517.03 | Muthu, Sebastian; Vittal, Jagadese J. A New Polymorph of 4-Pyridinethione Containing a Helical Assembly Based on N−H···S Hydrogen Bonds Crystal Growth & Design, 2004, 4, 1181 |
4512768 | CIF | C13 H5 F4 N | P -1 | 5.9023; 9.8718; 10.399 63.113; 74.909; 77.066 | 517.8 | Bosch, Eric; Bowling, Nathan P.; Darko, Jeffery The Power of Nonconventional Phenyl C‒H···N Hydrogen Bonds: Supportive Crystal-Packing Force and Dominant Supramolecular Engineering Force Crystal Growth & Design, 2015, 15, 1634 |
4511862 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8259; 19.954; 5.5272 90; 103.186; 90 | 518.21 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4501919 | CIF | C24 H26 N4 | P -1 | 7.6999; 7.7805; 9.6743 101.768; 110.567; 97.192 | 518.84 | Bosch, Eric Role of sp-C−H—N Hydrogen Bonding in Crystal Engineering Crystal Growth & Design, 2010, 10, 3808 |
4511868 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8255; 19.958; 5.5336 90; 103.141; 90 | 518.97 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
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 |
4509404 | CIF | C26 H20 N6 | P -1 | 6.7931; 7.8895; 10.5699 105.933; 98.07; 102.282 | 520.21 | Hudson, Timothy A.; Robson, Richard A New Class of TCNQ Derivatives Easily Generated from TCNQH2Containing Discrete TCNQ2−Anions and Noncoordinating Cations Crystal Growth & Design, 2009, 9, 1658 |
4510365 | CIF | C3 H2 Ag N3 O3 | P 1 21/c 1 | 3.5082; 15.467; 9.685 90; 98.03; 90 | 520.37 | Chesman, Anthony S. R.; Hodgson, Jennifer L.; Izgorodina, Ekaterina I.; Urbatsch, Aron; Turner, David R.; Deacon, Glen B.; Batten, Stuart R. Anion‒Anion Interactions in the Crystal Packing of Functionalized Methanide Anions: An Experimental and Computational Study Crystal Growth & Design, 2014, 14, 1922 |
4506048 | CIF | C4 H4 N2 O S | P 1 21/c 1 | 4.2588; 12.419; 9.844 90; 91.289; 90 | 520.5 | Jarzembska, Katarzyna N.; Kubsik, Marcin; Kamiński, Radosław; Woźniak, Krzysztof; Dominiak, Paulina M. From a Single Molecule to Molecular Crystal Architectures: Structural and Energetic Studies of Selected Uracil Derivatives Crystal Growth & Design, 2012, 12, 2508 |
4511867 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8298; 19.955; 5.5441 90; 103.05; 90 | 520.53 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4510985 | CIF | C10 H8 N2 O4 Zn | P -1 | 6.343; 8.856; 9.599 81.49; 79.87; 81.3 | 520.6 | Ma, Zhenbo; Hopson, Russell; Cai, Chen; Han, Shuangbing; Moulton, Brian Modifying Lipophilicities of Zn(II) Coordination Species by Introduction of Ancillary Ligands: A Supramolecular Chemistry Approach Crystal Growth & Design, 2010, 10, 2376 |
4511866 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8314; 19.955; 5.547 90; 103.005; 90 | 521.07 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4503104 | CIF | C13 H6 F2 N O | P 1 21 1 | 5.0669; 5.3543; 19.302 90; 95.512; 90 | 521.24 | Chopra, Deepak; Row, T. N. Guru Disorder Induced Concomitant Polymorphism in 3-Fluoro-N-(3-fluorophenyl)benzamide Crystal Growth & Design, 2008, 8, 848 |
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 |
4513464 | CIF | C10 H12 N2 O4 | P -1 | 5.5336; 8.9229; 10.9447 87.095; 89.016; 75.137 | 521.65 | Kamali, Naghmeh; Aljohani, Marwah; McArdle, Patrick; Erxleben, Andrea Hydrogen Bonding Networks and Solid-State Conversions in Benzamidinium Salts Crystal Growth & Design, 2015, 15, 3905 |
4517758 | CIF | F6 K2 Zr | C 1 2/c 1 | 6.56646; 11.4444; 6.94202 90; 90.5668; 90 | 521.662 | Lubomir Smrcok; Armel Le Bail; Miroslav Boca; Aydar Rakhmatullin Polymorphism of K2ZrF6 Crystal Growth & Design, 2020, 20, 3867-3881 |
4503044 | CIF | C6 H6 Cu N8 O4 | P 1 21/c 1 | 4.7999; 11.7936; 9.4857 90; 103.665; 90 | 521.77 | Yu, Qing; Zhang, Xiuqing; Bian, Hedong; Liang, Hong; Zhao, Bin; Yan, Shiping; Liao, Daizheng pH-Dependent Cu(II) Coordination Polymers with Tetrazole-1-acetic Acid: Synthesis, Crystal Structures, EPR and Magnetic Properties Crystal Growth & Design, 2008, 8, 1140 |
4500892 | CIF | Cd H8 Na2 O12 S2 | P 1 21/c 1 | 5.5314; 8.4624; 11.3048 90; 99.411; 90 | 522.04 | Saha, Dipankar; Madras, Giridhar; Guru Row, Tayur N. Manipulation of the Hydration Levels in Minerals of Sodium Cadmium Bisulfate toward the Design of Functional Materials Crystal Growth & Design, 2011, 11, 3213 |
4508436 | CIF | C12 H8 Cl2 N2 | P 1 21/c 1 | 9.7663; 4.672; 11.4452 90; 91.138; 90 | 522.12 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4505311 | CIF | C12 H12 N2 O2 | P -1 | 6.925; 7.7; 10.473 104.648; 103.713; 91.751 | 522.456 | Brewer, Jason T.; Parkin, Sean; Grossman, Robert B. A Systematic Study of the Relationship between Molecular and Crystal Structure among 3,5-Diazabicyclo[2.2.2]octane-2,6-diones Crystal Growth & Design, 2004, 4, 591 |
4511864 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.833; 19.978; 5.5547 90; 103.038; 90 | 522.5 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4511863 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8387; 19.991; 5.5464 90; 103.104; 90 | 522.54 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4511865 | CIF | C7 H11 Ag2 N3 O5 | P 1 21 1 | 4.8367; 19.97; 5.5587 90; 102.953; 90 | 523.25 | Miyake, Ryosuke; Nakagawa, Yuki; Hase, Mariko Selective Thermal Elongation of Metal‒Metal Distances in the Two-Dimensional Assembly of Ag(I) Ions Templated by Assembled Peptide Ligands Crystal Growth & Design, 2014, 14, 4882 |
4500484 | CIF | C5 H5 La N O9 S2 | P -1 | 5.6238; 7.3489; 12.9709 90.821; 96.912; 100.159 | 523.48 | Yotnoi, Bunlawee; Rujiwatra, Apinpus; Reddy, M. L. P.; Sarma, Debajit; Natarajan, Srinivasan Lanthanide Sulfate Frameworks: Synthesis, Structure, and Optical Properties Crystal Growth & Design, 2011, 11, 1347 |
4501687 | CIF | C12 H8 F2 N2 O2 | P -1 | 4.2521; 9.4407; 13.6969 106.367; 90.331; 96.516 | 523.73 | Long, Sihui; Li, Tonglei Enforcing Molecule’s π-Conjugation and Consequent Formation of the Acid−Acid Homosynthon over the Acid−Pyridine Heterosynthon in 2-Anilinonicotinic Acids Crystal Growth & Design, 2010, 10, 2465 |
4504700 | CIF | C16 H20 Cd N8 O8 W0 | P -1 | 7.7751; 7.9949; 9.853 95.115; 104.819; 114.478 | 525.5 | Ghosh, A. K.; Jana, A. D.; Ghoshal, D.; Mostafa, G.; Chaudhuri, N. Ray Toward the Recognition of Enolates/Dicarboxylates: Syntheses and X-ray Crystal Structures of Supramolecular Architectures of Zn(II)/Cd(II) Using 2,2‘-Biimidazole Crystal Growth & Design, 2006, 6, 701 |
4508856 | CIF | C2 H3 Cd Cl N4 | P 21 21 21 | 6.4126; 7.8307; 10.4658 90; 90; 90 | 525.54 | Li, Wei; Jia, Hong-Peng; Ju, Zhan-Feng; Zhang, Jie A Novel Chiral Cd(II) Coordination Polymer Based on Achiral Unsymmetrical 3-Amino-1,2,4-triazole with an Unprecedented μ4-Bridging Mode Crystal Growth & Design, 2006, 6, 2136 |
4501688 | CIF | C12 H8 F2 N2 O2 | P -1 | 6.8233; 7.642; 10.9371 104.638; 105.292; 94.5914 | 525.64 | Long, Sihui; Li, Tonglei Enforcing Molecule’s π-Conjugation and Consequent Formation of the Acid−Acid Homosynthon over the Acid−Pyridine Heterosynthon in 2-Anilinonicotinic Acids Crystal Growth & Design, 2010, 10, 2465 |
4504866 | CIF | C12 H7 Br2 N | P 1 21 1 | 11.902; 11.061; 3.9951 90; 90.849; 90 | 525.9 | Belloni, Maura; Kariuki, Benson M.; Manickam, M.; Wilkie, John; Preece, Jon A. Design of Potentially Photorefractive Liquid Crystalline Materials: Derivatives of 3,6-Disubstituted Carbazole Crystal Growth & Design, 2005, 5, 1443 |
4504986 | CIF | C12 H12 Ce2 O18 | P -1 | 8.279; 8.731; 9.098 94.83; 115.54; 111.93 | 526.3 | Michaelides, Adonis; Skoulika, Stavroula Reactive Microporous Rare-Earth Coordination Polymers that Exhibit Single-Crystal-to-Single-Crystal Dehydration and Rehydration Crystal Growth & Design, 2005, 5, 529 |
4505226 | CIF | C22 H20 N4 O6 | P -1 | 5.0624; 10.196; 10.958 105.163; 100.651; 97.373 | 527.1 | Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W. A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design Crystal Growth & Design, 2005, 5, 2313 |
4505326 | CIF | C4 H4 N2 O3 | P 1 21/c 1 | 6.7305; 14.029; 6.2309 90; 116.368; 90 | 527.1 | Lewis, Thomas C.; Tocher, Derek A.; Price, Sarah L. An Experimental and Theoretical Search for Polymorphs of Barbituric Acid: The Challenges of Even Limited Conformational Flexibility Crystal Growth & Design, 2004, 4, 979 |
4504820 | CIF | C6 H6 F N | P c a 21 | 10.755; 5.419; 9.046 90; 90; 90 | 527.2 | Chopra, Deepak; Thiruvenkatam, Vijay; Row, Tayur. N. Guru In Situ Cryo-Crystallization of Fluorinated Amines: A Comparative Study of Cooperative Intermolecular Interactions Involving Ordered and Disordered Fluorine Crystal Growth & Design, 2006, 6, 843 |
4511885 | CIF | C4 H11 Ca N O9 P2 | P -1 | 7.12; 7.2986; 10.5043 78.615; 80.272; 88.585 | 527.41 | Demadis, Konstantinos D.; Armakola, Eirini; Papathanasiou, Konstantinos E.; Mezei, Gellert; Kirillov, Alexander M. Structural Systematics and Topological Analysis of Coordination Polymers with Divalent Metals and a Glycine-Derived Tripodal Phosphonocarboxylate Crystal Growth & Design, 2014, 14, 5234 |
4500038 | CIF | C30 H22 | P -1 | 6.0881; 8.4119; 10.6561 104.517; 91.259; 92.359 | 527.56 | Gagnon, Eric; Maris, Thierry; Arseneault, Pierre-Marc; Maly, Kenneth E.; Wuest,James D Structural Features in Crystals of Derivatives of Benzene with Multiple Contiguous Phenyl Substituents Cryst. Growth & Design, 2010, 10, 648-657 |
4500531 | CIF | C2 Ca Li O6 P | P 1 21/a 1 | 10.11879; 8.5936; 6.07574 90; 92.4396; 90 | 527.85 | Colodrero, Rosario M. P.; Cabeza, Aurelio; Olivera-Pastor, Pascual; Papadaki, Maria; Rius, Jordi; Choquesillo-Lazarte, Duane; García-Ruiz, Juan M.; Demadis, Konstantinos D.; Aranda, Miguel A. G. Common Structural Features in Calcium Hydroxyphosphonoacetates. A High-Throughput Screening Crystal Growth & Design, 2011, 11, 1713 |
4501204 | CIF | C15 H10 O2 | P -1 | 3.8896; 9.384; 14.852 101.784; 95.457; 90.22 | 528.1 | Zhu, Lingyan; Al-Kaysi, Rabih O.; Dillon, Robert J.; Tham, Fook S.; Bardeen, Christopher J. Crystal Structures and Photophysical Properties of 9-Anthracene Carboxylic Acid Derivatives for Photomechanical Applications Crystal Growth & Design, 2011, 11, 4975 |
4509149 | CIF | C26 H24 N2 O4 | P -1 | 6.4357; 6.896; 12.412 79.037; 80.952; 80.144 | 528.4 | Weyna, David R.; Shattock, Tanise; Vishweshwar, Peddy; Zaworotko, Michael J. Synthesis and Structural Characterization of Cocrystals and Pharmaceutical Cocrystals: Mechanochemistry vs Slow Evaporation from Solution Crystal Growth & Design, 2009, 9, 1106 |
4513598 | CIF | C4 H21 N O6 | P 1 21/m 1 | 7.7347; 8.094; 8.6976 90; 103.683; 90 | 529.06 | Dobrzycki, Lukasz; Taraszewska, Paulina; Boese, Roland; Cyrański, Michał K. Pyrrolidine and Its Hydrates in the Solid State Crystal Growth & Design, 2015, 15, 4804 |
4506455 | CIF | C11 H11 N3 O4 | P -1 | 6.687; 7.074; 11.721 80.61; 87.92; 76.02 | 530.8 | Thakuria, Ranjit; Cherukuvada, Suryanarayan; Nangia, Ashwini Crystal Structures of Pyrogallol, Its Hydrate, and Stable MultipleZ′ Cocrystals with N-Heterocycles Containing Metastable Conformers of Pyrogallol Crystal Growth & Design, 2012, 12, 3944 |
4505748 | CIF | C14 H20 N6 Ni S4 | P -1 | 7.4343; 8.6973; 9.772 64.74; 70.307; 89.487 | 531.2 | Fourmigué, Marc; Mézière, Cécile; Dolou, Sébastien Bifurcated Hydrogen Bonds as a Key Feature in the Solid State Organization of Paramagnetic Dithiolene Complexes Crystal Growth & Design, 2003, 3, 805 |
4512767 | CIF | C13 H5 F4 N | P -1 | 5.9634; 8.768; 11.076 99.846; 105.527; 101.235 | 531.8 | Bosch, Eric; Bowling, Nathan P.; Darko, Jeffery The Power of Nonconventional Phenyl C‒H···N Hydrogen Bonds: Supportive Crystal-Packing Force and Dominant Supramolecular Engineering Force Crystal Growth & Design, 2015, 15, 1634 |
4510626 | CIF | C11 H11 N O5 | P -1 | 7.9457; 8.0305; 9.6719 110.801; 99.754; 105.371 | 531.97 | Kendrick, John; Montis, Riccardo; Hursthouse, Michael B.; Leusen, Frank J. J. “In-SilicoSeeding”: Isostructurality and Pseudoisostructurality in a Family of Aspirin Derivatives Crystal Growth & Design, 2013, 13, 2906 |
4512013 | CIF | C10 H9 N O6 Zn | P -1 | 7.791; 8.989; 9.16 116.446; 104.488; 98.089 | 532.1 | Ordonez, Carlos; Fonari, Marina; Lindline, Jennifer; Wei, Qiang; Timofeeva, Tatiana How Structure-Directing Cations Tune the Fluorescence of Metal‒Organic Frameworks Crystal Growth & Design, 2014, 14, 5452 |
4513599 | CIF | C4 H21 N O6 | P 1 21/m 1 | 7.7773; 8.1088; 8.6962 90; 103.605; 90 | 533.03 | Dobrzycki, Lukasz; Taraszewska, Paulina; Boese, Roland; Cyrański, Michał K. Pyrrolidine and Its Hydrates in the Solid State Crystal Growth & Design, 2015, 15, 4804 |
4508897 | CIF | C10 H12 F2 O2 S | P 1 21 1 | 4.6869; 10.458; 10.937 90; 96.07; 90 | 533.08 | Asensio, Gregorio; Medio-Simon, Mercedes; Alemán, Pedro; de Arellano, Carmen Ramírez The Role of Organic Fluorine in the Supramolecular Assembly of Halogenated β-Hydroxysulphoxides Diastereomers Crystal Growth & Design, 2006, 6, 2769 |
4500216 | CIF | C4 H7 Li O2 | P 1 21/c 1 | 12.153; 4.928; 8.905 90; 91.58; 90 | 533.12 | Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers Crystal Growth & Design, 2011, 11, 759 |
4516261 | CIF | C3 H6 N6 | P 1 21/n 1 | 7.2789; 7.4799; 10.3316 90; 108.495; 90 | 533.46 | Li, Peng; Arman, Hadi D.; Wang, Hailong; Weng, Linhong; Alfooty, Khalid; Angawi, Rehab F.; Chen, Banglin Solvent Dependent Structures of Melamine: Porous or Nonporous? Crystal Growth & Design, 2015, 15, 1871 |
4505834 | CIF | C18 H15 Cl6 N O5 | P 1 | 7.246; 7.277; 10.92 98.547; 104.75; 101.442 | 533.6 | Fomulu, Shella L.; Hendi, Mukta S.; Davis, Raymond E.; Wheeler, Kraig A. Structural Studies of Enantiomers, Racemates, and Quasiracemates. 2-(2,4,5-Trichloroanilino)propanoic Acid and 2-(2,4,5-Trichlorophenoxy)propanoic Acid Crystal Growth & Design, 2002, 2, 637 |
4516516 | CIF | C13 H6 F5 N | P -1 | 5.766; 9.081; 10.927 70.74; 85.15; 81.57 | 533.9 | Shirman, Tanya; Boterashvili, Meital; Orbach, Meital; Freeman, Dalia; Shimon, Linda J. W.; Lahav, Michal; van der Boom, Milko E. Finding the Perfect Match: Halogen vs Hydrogen Bonding Crystal Growth & Design, 2015, 15, 4756 |
4508033 | CIF | C10 H18 O4 | P 1 21/c 1 | 15.085; 5.0126; 9.7915 90; 133.79; 90 | 534.5 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4504587 | CIF | C2 H5 Cl N4 | P 1 21/c 1 | 7.1584; 8.164; 9.3954 90; 102.97; 90 | 535.07 | Laus, G.; Kahlenberg, V.; Többens, D. M.; Jetti, R. K. R.; Griesser, U. J.; Schütz, J.; Kristeva, E.; Wurst, K.; Schottenberger, H. Lattice Architecture and Hydrogen-Bonding Networks ofN-Aminoazolium andN,N‘-Diaminoazolium Chlorides Crystal Growth & Design, 2006, 6, 404 |
4504176 | CIF | C5 H13 Cl Mg0.5 N3 O4 | P -1 | 7.608; 7.987; 10.443 104.5; 94.35; 116.79 | 535.2 | Mastropietro, Teresa F.; Armentano, Donatella; Marino, Nadia; De Munno, Giovanni; Anastassopoulou, Jane; Theophanides, Theophilos Supramolecular Assemblies of Nucleobase Derivative 1-Mecyt with Mg(II) and Ni(II) and Solid-State Transformation of Ni(II) Phase: A Comprehensive Evidence of Their Different Reactivity toward 1-Mecyt [1-Mecyt = 1-Methylcytosine] Crystal Growth & Design, 2007, 7, 609 |
4505227 | CIF | C22 H20 N4 O6 | P -1 | 5.2321; 7.773; 14.009 88.809; 79.727; 72.899 | 535.51 | Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W. A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design Crystal Growth & Design, 2005, 5, 2313 |
4513786 | CIF | C9 H13 N5 O3 | P -1 | 7.6545; 8.3489; 8.954 90.552; 91.339; 110.177 | 536.86 | Eddleston, Mark D.; Arhangelskis, Mihails; Fábián, Laszlo; Tizzard, Graham J.; Coles, Simon J.; Jones, William Investigation of an Amide-Pseudo Amide Hydrogen Bonding Motif within a Series of Theophylline:Amide Cocrystals Crystal Growth & Design, 2015 |
4507555 | CIF | C7 H7 F | P 1 21/n 1 | 8.74; 5.781; 10.63 90; 92.01; 90 | 537 | Ridout, Joe; Probert, Michael R. High-Pressure and Low-Temperature Polymorphism in C‒H···F‒C Hydrogen Bonded Monofluorotoluenes Crystal Growth & Design, 2013, 13, 1943 |
4508034 | CIF | C10 H18 O4 | P 1 21/c 1 | 15.087; 5.0117; 9.8394 90; 133.75; 90 | 537.4 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4504985 | CIF | C12 H16 Ce2 O20 | P -1 | 8.304; 8.728; 9.177 95.59; 115.7; 110.26 | 537.59 | Michaelides, Adonis; Skoulika, Stavroula Reactive Microporous Rare-Earth Coordination Polymers that Exhibit Single-Crystal-to-Single-Crystal Dehydration and Rehydration Crystal Growth & Design, 2005, 5, 529 |
4508832 | CIF | C9 H14 O6 U | P 1 2/c 1 | 11.3233; 4.4018; 10.8499 90; 95.454; 90 | 538.34 | Borkowski, Lauren A.; Cahill, Christopher L. Crystal Engineering with the Uranyl Cation I. Aliphatic Carboxylate Coordination Polymers: Synthesis, Crystal Structures, and Fluorescent Properties Crystal Growth & Design, 2006, 6, 2241 |
4507475 | CIF | C9 H15 N O6 | P -1 | 6.286; 8.879; 9.839 93.625; 98.813; 95.604 | 538.4 | Mora, Asiloé J.; Belandria, Lusbely M.; Ávila, Edward E.; Seijas, Luis E.; Delgado, Gerzon E.; Miró, Aira; Almeida, Rafael; Brunelli, Michela; Fitch, Andrew N. Investigating the Stability of Double Head to Tail Dimers and Ribbons in Multicomponent Crystals ofcis-4-Aminocyclohexanecarboxilic Acid with Water and Oxalic Acid Crystal Growth & Design, 2013, 13, 1849 |
4501412 | CIF | C3 O7 | P -1 | 8.89282; 9.74543; 6.8513 107.106; 108.351; 85.6751 | 538.54 | Lim, Gin Keat; Fujii, Kotaro; Harris, Kenneth D. M.; Apperley, David C. Structure Determination from Powder X-ray Diffraction Data of a New Polymorph of a High-Density Organic Hydrate Material, with an Assessment of Hydrogen-Bond Disorder by Rietveld Refinement Crystal Growth & Design, 2011, 11, 5192 |
4500217 | CIF | C8 H14 O4 Pb | P 1 21/m 1 | 15.56795; 7.26249; 4.80093 90; 96.9765; 90 | 538.784 | Casado, F. J. Martínez; Riesco, M. Ramos; Silva, I. da; Yélamos, M. I. Redondo; Labrador, A.; Cheda, J. A. Rodríguez Lithium and Lead(II) Butyrates Binary System. Pure Compounds and an Intermediate Salt: From 2D to 3D Coordination Polymers Crystal Growth & Design, 2011, 11, 759 |
4505811 | CIF | C10 H10 Cl2 N2 O4 | P 1 21/n 1 | 8.895; 5.1184; 12.39 90; 107.169; 90 | 539 | Luo, Tzy-Jiun M.; Palmore, G. Tayhas R. Engineering Crystalline Architecture with Supramolecular Tapes: Studies on Secondary Donor−Acceptor Interactions in Cocrystals of the Cyclic Dipeptide of Glycine Crystal Growth & Design, 2002, 2, 337 |
4503643 | CIF | C4 H6 Cd Cl2 N6 O0 S2 | P -1 | 7.7; 8.298; 10.059 106.701; 96.24; 114.743 | 539.4 | Zhang, Rui-Bo; Li, Zhao-Ji; Cheng, Jian-Kai; Qin, Ye-Yan; Zhang, Jian; Yao, Yuan-Gen Anion-Induced Coordination Versatility of 1H-1,2,4-Triazole-3-thiol (HtrzSH) Affording a New Hybrid System of Cadmium(II) Polymers: Synthesis, Structure, and Luminescent Properties Crystal Growth & Design, 2008, 8, 2562 |
4506304 | CIF | C16 H22 N10 O10 | P -1 | 6.0611; 7.818; 12.154 71.604; 80.885; 86.334 | 539.5 | Landenberger, Kira B.; Matzger, Adam J. Cocrystals of 1,3,5,7-Tetranitro-1,3,5,7-tetrazacyclooctane (HMX) Crystal Growth & Design, 2012, 12, 3603 |
4501762 | CIF | C5 H5 N3 O | P 1 21/c 1 | 14.315; 3.6238; 10.6158 90; 101.119; 90 | 540.35 | Cherukuvada, Suryanarayan; Thakuria, Ranjit; Nangia, Ashwini Pyrazinamide Polymorphs: Relative Stability and Vibrational Spectroscopy Crystal Growth & Design, 2010, 10, 3931 |
4513600 | CIF | C4 H21 N O6 | P 1 21/m 1 | 7.8605; 8.1447; 8.6837 90; 103.559; 90 | 540.45 | Dobrzycki, Lukasz; Taraszewska, Paulina; Boese, Roland; Cyrański, Michał K. Pyrrolidine and Its Hydrates in the Solid State Crystal Growth & Design, 2015, 15, 4804 |
4511295 | CIF | C5 H5 N3 O | P 1 21/c 1 | 14.3396; 3.6211; 10.6131 90; 101.044; 90 | 540.88 | Jarzembska, Katarzyna N.; Hoser, Anna A.; Kamiński, Radosław; Madsen, Anders Ø.; Durka, Krzysztof; Woźniak, Krzysztof Combined Experimental and Computational Studies of Pyrazinamide and Nicotinamide in the Context of Crystal Engineering and Thermodynamics Crystal Growth & Design, 2014, 14, 3453 |
4511982 | CIF | O4 P Sm | C 1 2 1 | 12.14431; 7.01776; 6.34756 90; 90.028; 90 | 540.976 | Mesbah, Adel; Clavier, Nicolas; Elkaim, Erik; Gausse, Clémence; Kacem, Ilyes Ben; Szenknect, Stephanie; Dacheux, Nicolas Monoclinic Form of the Rhabdophane Compounds: REEPO4·0.667H2O Crystal Growth & Design, 2014, 14, 5090 |
4508035 | CIF | C10 H18 O4 | P 1 21/c 1 | 15.071; 4.9903; 9.9427 90; 133.64; 90 | 541.2 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4503849 | CIF | C8 H12 O6 P2 | P 1 21/n 1 | 8.5172; 7.7403; 9.143 90; 115.98; 90 | 541.85 | Shi, Fa-Nian; Trindade, Tito; Rocha, João; Paz, Filipe A. Almeida Hydro-Ionothermal Synthesis of Lanthanide-Organic Frameworks with 1,4-Phenylenebis(methylene)diphosphonate Crystal Growth & Design, 2008, 8, 3917 |
4508438 | CIF | C12 H8 Cl2 N2 | P 1 21/c 1 | 11.4948; 3.8134; 13.521 90; 113.889; 90 | 541.91 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4511723 | CIF | C7 H14 Cl2 O3 | P m n 21 | 11.703; 10.49; 4.4154 90; 90; 90 | 542.05 | Yufit, D. S.; Shishkin, O. V.; Zubatyuk, R. I.; Howard, J. A. K. Trimethyltrioxane (Paraldehyde) and Its Halomethanes Complexes: Crystallization, Structures, and Analysis of Packing Motifs Crystal Growth & Design, 2014, 14, 4303 |
4503572 | CIF | C5 H13 Co O10 | P -1 | 5.4287; 9.8286; 10.23 96.453; 91.23; 91.339 | 542.1 | Fabelo, Oscar; Pasán, Jorge; Cañadillas-Delgado, Laura; Delgado, Fernando S.; Labrador, Ana; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina (4,4) Rectangular Lattices of Cobalt(II) with 1,2,4,5-Benzenetetracarboxylic Acid: Influence of the Packing in the Crystal Structure† Crystal Growth & Design, 2008, 8, 3984 |
4504984 | CIF | C12 H16 La2 O20 | P -1 | 8.307; 8.769; 9.204 95.63; 115.61; 110.26 | 542.31 | Michaelides, Adonis; Skoulika, Stavroula Reactive Microporous Rare-Earth Coordination Polymers that Exhibit Single-Crystal-to-Single-Crystal Dehydration and Rehydration Crystal Growth & Design, 2005, 5, 529 |
4503915 | CIF | C13 H11 N O | P 1 | 5.9183; 7.1869; 14.295 85.13; 78.03; 65.8 | 542.5 | Arod, Frédéric; Pattison, Philip; Schenk, Kurt J.; Chapuis, Gervais Polymorphism inN-Salicylideneaniline Reconsidered Crystal Growth & Design, 2007, 7, 1679 |
4506453 | CIF | C6 H6 O3 | P 1 21/n 1 | 12.1144; 3.7765; 13.1365 90; 115.484; 90 | 542.52 | Thakuria, Ranjit; Cherukuvada, Suryanarayan; Nangia, Ashwini Crystal Structures of Pyrogallol, Its Hydrate, and Stable MultipleZ′ Cocrystals with N-Heterocycles Containing Metastable Conformers of Pyrogallol Crystal Growth & Design, 2012, 12, 3944 |
4508437 | CIF | C12 H8 Cl2 N2 | P 1 21/c 1 | 12.7716; 3.8032; 11.6316 90; 105.903; 90 | 543.36 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4501219 | CIF | C14 H6 Br4 F4 I2 N6 | P -1 | 5.6428; 9.7705; 10.4014 100.821; 103.743; 93.752 | 543.49 | Aakeröy, Christer B.; Chopade, Prashant D.; Desper, John Avoiding “Synthon Crossover” in Crystal Engineering with Halogen Bonds and Hydrogen Bonds Crystal Growth & Design, 2011, 11, 5333 |
4507094 | CIF | C10 H14 N O5 | P -1 | 5.169; 10.102; 11.747 115.05; 90.332; 100.638 | 543.7 | Tothadi, Srinu; Desiraju, Gautam R. Synthon Modularity in 4-Hydroxybenzamide‒Dicarboxylic Acid Cocrystals Crystal Growth & Design, 2012, 12, 6188 |
4505843 | CIF | C7 H13 Co N6 | P 1 21/m 1 | 6.499; 12.666; 7.348 90; 115.94; 90 | 543.9 | Chun, Hyungphil; Bernal, Ivan Crystal Structures of Neutral Cobalt(III) Complexes: Common Hydrogen-Bonding Patterns Observed in Compounds of Different Molecular Structures Crystal Growth & Design, 2001, 1, 143 |
4507085 | CIF | C23 H27 N3 O3 S | P 1 | 7.2651; 8.983; 10.109 97.82; 110.42; 112.3 | 543.9 | Sun, Zhihua; Liu, Xitao; Wang, Xinqiang; Li, Lina; Shi, Xiaojun; Li, Shigeng; Ji, Chengmin; Luo, Junhua; Hong, Maochun Engineering of Acentric Stilbazolium Salts with Large Second-Order Optical Nonlinearity and Enhanced Environmental Stability Crystal Growth & Design, 2012, 12, 6181 |
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 |
4504925 | CIF | C2 H2 Cd2 O6 | P 1 21/n 1 | 7.3915; 5.9789; 12.3309 90; 92.885; 90 | 544.25 | Lu, Jing; Zhao, Kui; Fang, Qian-Rong; Xu, Ji-Qing; Yu, Jie-Hui; Zhang, Xiao; Bie, Hai-Ying; Wang, Tie-Gang Synthesis and Characterization of Four Novel Supramolecular Compounds Based on Metal Zinc and Cadmium Crystal Growth & Design, 2005, 5, 1091 |
4508036 | CIF | C10 H18 O4 | P 1 21/c 1 | 15.048; 4.9778; 10.014 90; 133.45; 90 | 544.6 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4509224 | CIF | Ba Ga4 S7 | P m n 21 | 14.755; 6.228; 5.929 90; 90; 90 | 544.8 | Lin, Xinsong; Zhang, Ge; Ye, Ning Growth and Characterization of BaGa4S7: A New Crystal for Mid-IR Nonlinear Optics Crystal Growth & Design, 2009, 9, 1186 |
4504704 | CIF | C16 H24 Cd N8 O8 | P -1 | 7.645; 7.9146; 9.9039 95.08; 95.424; 112.68 | 545.32 | Ghosh, A. K.; Jana, A. D.; Ghoshal, D.; Mostafa, G.; Chaudhuri, N. Ray Toward the Recognition of Enolates/Dicarboxylates: Syntheses and X-ray Crystal Structures of Supramolecular Architectures of Zn(II)/Cd(II) Using 2,2‘-Biimidazole Crystal Growth & Design, 2006, 6, 701 |
4505377 | CIF | As2 Cu2 O7 | C 1 2/c 1 | 7.237; 8.2557; 9.78 90; 111.03; 90 | 545.4 | Weil, Matthias; Lengauer, Christian; Füglein, Ekkehard; Baran, Enrique J. The Reversible α →β Phase Transition of Cu2As2O7 Crystal Growth & Design, 2004, 4, 1229 |
4506405 | CIF | C9 H13 N3 O4 | P -1 | 4.1106; 9.8487; 13.7524 85.906; 85.005; 80.131 | 545.53 | Ebenezer, Samuel; Muthiah, P. Thomas Design of Co-crystals/Salts of Aminopyrimidines and Carboxylic Acids through Recurrently Occurring Synthons Crystal Growth & Design, 2012, 12, 3766 |
4512558 | CIF | C11 H10 N4 O3 | P -1 | 7.7932; 8.0164; 10.2555 76.952; 77.24; 61.961 | 545.97 | Prasad, Karothu Durga; Cherukuvada, Suryanarayan; Ganduri, Ramesh; Stephen, L. Devaraj; Perumalla, Sravankumar; Guru Row, Tayur N. Differential Cocrystallization Behavior of Isomeric Pyridine Carboxamides toward Antitubercular Drug Pyrazinoic Acid Crystal Growth & Design, 2015, 15, 858 |
4506701 | CIF | C11 H16 N2 O2 | P -1 | 5.0174; 8.8907; 12.7562 106.205; 91.404; 90.153 | 546.23 | Srirambhatla, Vijay K.; Kraft, Arno; Watt, Stephen; Powell, Anthony V. Crystal Design Approaches for the Synthesis of Paracetamol Co-Crystals Crystal Growth & Design, 2012, 12, 4870 |
4516314 | CIF | C26 H22 N2 O8 | P -1 | 6.827; 8.734; 9.852 77.06; 72.84; 87.22 | 546.9 | Varughese, Sunil; Hoser, Anna A.; Jarzembska, Katarzyna N.; Pedireddi, V. R.; Woźniak, Krzysztof Positional Isomerism and Conformational Flexibility Directed Structural Variations in the Molecular Complexes of Dihydroxybenzoic Acids Crystal Growth & Design, 2015, 15, 3832 |
4504099 | CIF | C6 H4 N2 | P 1 21/c 1 | 3.871; 13.89; 10.2043 90; 94.547; 90 | 546.94 | Thalladi, Venkat R.; Dabros, Marta; Gehrke, Annette; Weiss, Hans-Christoph; Boese, Roland Crystal Engineering with ⋮C−H···N and C−H···N Hydrogen Bonds Crystal Growth & Design, 2007, 7, 598 |
4505832 | CIF | C9 H8 Cl3 N O2 | P -1 | 7.3401; 7.3444; 10.9613 98.251; 104.866; 101.768 | 547.02 | Fomulu, Shella L.; Hendi, Mukta S.; Davis, Raymond E.; Wheeler, Kraig A. Structural Studies of Enantiomers, Racemates, and Quasiracemates. 2-(2,4,5-Trichloroanilino)propanoic Acid and 2-(2,4,5-Trichlorophenoxy)propanoic Acid Crystal Growth & Design, 2002, 2, 637 |
4509710 | CIF | C7 H4 Li O2 | P 1 21/c 1 | 12.753; 5.138; 8.42 90; 97.218; 90 | 547.3 | Banerjee, Debasis; Borkowski, Lauren A.; Kim, Sun Jin; Parise, John B. Synthesis and Structural Characterization of Lithium-Based Metal−Organic Frameworks Crystal Growth & Design, 2009, 9, 4922 |
4509112 | CIF | C4 H12.3 Cu1.5 O8.15 P S | P -1 | 5.1197; 10.5328; 10.8003 108.388; 95.656; 93.521 | 547.33 | Sonnauer, Andreas; Feyand, Mark; Stock, Norbert Synthesis of 4-Phosphonobutanesulfonic Acid and Systematic Investigation of Copper Phosphonatobutanesulfonates by High-Throughput Methods Crystal Growth & Design, 2009, 9, 586 |
4511431 | CIF | C9 H17 N O6 | P 1 21 1 | 4.9095; 17.009; 6.6979 90; 101.833; 90 | 547.43 | Sakurai, Rumiko; Yuzawa, Atsushi; Sakai, Kenichi; Hirayama, Noriaki Dielectrically Controlled Enantiomeric Resolution (DCR) of (R)- and (S)-2-Methylpyrrolidine by (R,R)-Tartaric Acid Crystal Growth & Design, 2006, 6, 1606 |
4508037 | CIF | C10 H18 O4 | P 1 21/c 1 | 15.035; 4.9739; 10.066 90; 133.29; 90 | 547.9 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4513297 | CIF | As4 O6 | P 1 21/a 1 | 12.588; 4.3812; 16.593 90; 143.199; 90 | 548.2 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4508226 | CIF | C6 H6 O3 | P 1 21/n 1 | 12.1207; 3.80651; 13.1647 90; 115.478; 90 | 548.32 | Braun, Doris E.; Bhardwaj, Rajni M.; Arlin, Jean-Baptiste; Florence, Alastair J.; Kahlenberg, Volker; Griesser, Ulrich J.; Tocher, Derek A.; Price, Sarah L. Absorbing a Little Water: The Structural, Thermodynamic, and Kinetic Relationship between Pyrogallol and Its Tetarto-Hydrate. Crystal growth & design, 2013, 13, 4071-4083 |
4513285 | CIF | As4 O6 | P 1 21/a 1 | 12.5859; 4.3845; 16.5934 90; 143.183; 90 | 548.73 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4505310 | CIF | C11 H18 N2 O2 | P -1 | 6.018; 9.788; 9.934 108.985; 90.136; 96.233 | 549.61 | Brewer, Jason T.; Parkin, Sean; Grossman, Robert B. A Systematic Study of the Relationship between Molecular and Crystal Structure among 3,5-Diazabicyclo[2.2.2]octane-2,6-diones Crystal Growth & Design, 2004, 4, 591 |
4513340 | CIF | C13 H10 Cl N O2 | P -1 | 4.0009; 8.6998; 16.337 101.9; 92.486; 97.827 | 549.74 | López-Mejías, Vilmalí; Matzger, Adam J. Structure‒Polymorphism Study of Fenamates: Toward Developing an Understanding of the Polymorphophore Crystal Growth & Design, 2015, 15, 3955 |
4503756 | CIF | C16 H12 Cl4 Mn O10 | P -1 | 7.5474; 7.7557; 10.2307 77.722; 77.731; 72.166 | 550.01 | Chen, Sheng-Chun; Zhang, Zhi-Hui; Huang, Kun-Lin; Chen, Qun; He, Ming-Yang; Cui, Ai-Jun; Li, Chao; Liu, Qi; Du, Miao Solvent-Controlled Assembly of Manganese(II) Tetrachloroterephthalates with 1D Chain, 2D Layer, and 3D Coordination Architectures Crystal Growth & Design, 2008, 8, 3437 |
4513493 | CIF | C6 H8 F5 N21 Zn4 | P 1 2/m 1 | 6.5576; 9.715; 8.6358 90; 90.579; 90 | 550.13 | Pimenta, Vanessa; Lhoste, Jérôme; Hémon-Ribaud, Annie; Leblanc, Marc; Grenèche, Jean-Marc; Jouffret, Laurent; Martel, Arnaud; Dujardin, Gilles; Maisonneuve, Vincent Evidence of New Fluorinated Coordination Compounds in the Composition Space Diagram of FeF3/ZnF2‒Hamtetraz-HFaqSystem Crystal Growth & Design, 2015, 15, 4248 |
4504589 | CIF | C2 H5 Cl N4 | P 1 21/c 1 | 5.099; 7.2298; 15.042 90; 96.52; 90 | 550.93 | Laus, G.; Kahlenberg, V.; Többens, D. M.; Jetti, R. K. R.; Griesser, U. J.; Schütz, J.; Kristeva, E.; Wurst, K.; Schottenberger, H. Lattice Architecture and Hydrogen-Bonding Networks ofN-Aminoazolium andN,N‘-Diaminoazolium Chlorides Crystal Growth & Design, 2006, 6, 404 |
4514128 | CIF | C4 H3 K O4 | P b c m | 4.5071; 7.7017; 15.921 90; 90; 90 | 552.66 | Malaspina, Lorraine A.; Edwards, Alison J.; Woińska, Magdalena; Jayatilaka, Dylan; Turner, Michael J.; Price, Jason R.; Herbst-Irmer, Regine; Sugimoto, Kunihisa; Nishibori, Eiji; Grabowsky, Simon Predicting the Position of the Hydrogen Atom in the Short Intramolecular Hydrogen Bond of the Hydrogen Maleate Anion from Geometric Correlations Crystal Growth & Design, 2017, 17, 3812 |
4509505 | CIF | C6 H8 Cl4 N4 Pd | P 1 21/n 1 | 4.6833; 10.6295; 11.1391 90; 91.255; 90 | 554.38 | Boldog, Ishtvan; Daran, Jean-Claude; Chernega, Alexander N.; Rusanov, Eduard B.; Krautscheid, Harald; Domasevitch, Konstantin V. Hydrogen Bonding Patterns and Supramolecular Structure of 4,4′-Bipyrazolium Salts Crystal Growth & Design, 2009, 9, 2895 |
4503784 | CIF | C10 H14 O5 | P 1 21 1 | 7.832; 6.1604; 11.563 90; 96.18; 90 | 554.65 | Breen, Meghan E.; Tameze, Shella L.; Dougherty, William G.; Kassel, W. Scott; Wheeler, Kraig A. Structural Studies of Enantiomers, Racemates, and Quasiracemates. 2-(3-Bromophenoxy)propionic Acid and 2-(3-Methoxyphenoxy)propionic Acid Crystal Growth & Design, 2008, 8, 3863 |
4508038 | CIF | C10 H18 O4 | P 1 21/c 1 | 15.056; 4.9866; 10.144 90; 133.14; 90 | 555.7 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4513339 | CIF | C13 H10 Cl N O2 | P -1 | 3.8066; 11.1261; 13.2491 91.314; 90.823; 97.691 | 555.85 | López-Mejías, Vilmalí; Matzger, Adam J. Structure‒Polymorphism Study of Fenamates: Toward Developing an Understanding of the Polymorphophore Crystal Growth & Design, 2015, 15, 3955 |
4512005 | CIF | C10 H12 N2 O3 S | P -1 | 6.9435; 7.5192; 11.5084 86.793; 80.123; 70.172 | 556.85 | Braga, Dario; Grepioni, Fabrizia; Chelazzi, Laura; Nanna, Saverio; Rubini, Katia; Curzi, Marco; Giaffreda, Stefano L.; Saxell, Heidi E.; Bratz, Matthias; Chiodo, Tiziana Bentazon: Effect of Additives on the Crystallization of Pure and Mixed Polymorphic Forms of a Commercial Herbicide Crystal Growth & Design, 2014, 14, 5729 |
4508439 | CIF | C12 H8 Br2 N2 | P 1 21/c 1 | 10.0896; 4.7532; 11.622 90; 91.951; 90 | 557.04 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4503097 | CIF | C10 H6 B2 F4 N4 | C 1 2/m 1 | 10.9005; 9.559; 5.461 90; 101.39; 90 | 557.8 | Cavero, Emma; Giménez, Raquel; Uriel, Santiago; Beltrán, Eduardo; Serrano, José Luis; Alkorta, Ibon; Elguero, José The Boat Conformation in Pyrazaboles. A Theoretical and Experimental Study† Crystal Growth & Design, 2008, 8, 838 |
4500335 | CIF | C4 H6 Ag N3 | P n a 21 | 7.1495; 8.1326; 9.5939 90; 90; 90 | 557.83 | Zhang, Jie-Peng; Qi, Xiao-Lin; Liu, Zhi-Juan; Zhu, Ai-Xin; Chen, Yan; Wang, Jing; Chen, Xiao-Ming Syntheses, Structures, and Porous/Luminescent Properties of Silver 3-Alkyl-1,2,4-Triazolate Frameworks with Rare 3-Connected Topologies Crystal Growth & Design, 2011, 11, 796 |
4513790 | CIF | C9 H13 N5 O3 | P -1 | 6.6316; 8.7905; 9.5955 92.441; 92.929; 90.609 | 558.09 | Eddleston, Mark D.; Arhangelskis, Mihails; Fábián, Laszlo; Tizzard, Graham J.; Coles, Simon J.; Jones, William Investigation of an Amide-Pseudo Amide Hydrogen Bonding Motif within a Series of Theophylline:Amide Cocrystals Crystal Growth & Design, 2015 |
4504100 | CIF | C6 H9 O9 P3 | P -1 | 7.631; 9.3667; 9.5372 110.347; 102.058; 109.887 | 558.13 | Hix, Gary B.; Caignaert, Vincent; Rueff, Jean-Michel; Le Pluart, Loïc; Warren, John E.; Jaffrès, Paul-Alain A Supramolecular Ladderlike Structure Formed by the Auto-Assembly of Benzene-1,3,5-triphosphonic Acid Crystal Growth & Design, 2007, 7, 208 |
4504588 | CIF | C3 H6 Cl N3 | P 1 21/n 1 | 9.3559; 4.9432; 12.182 90; 97.76; 90 | 558.23 | Laus, G.; Kahlenberg, V.; Többens, D. M.; Jetti, R. K. R.; Griesser, U. J.; Schütz, J.; Kristeva, E.; Wurst, K.; Schottenberger, H. Lattice Architecture and Hydrogen-Bonding Networks ofN-Aminoazolium andN,N‘-Diaminoazolium Chlorides Crystal Growth & Design, 2006, 6, 404 |
4513284 | CIF | As4 O6 | P 1 21/a 1 | 12.6524; 4.4082; 16.7237 90; 143.209; 90 | 558.62 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4511296 | CIF | C6 H6 N2 O | P 1 21/c 1 | 3.8563; 15.6302; 9.3702 90; 98.188; 90 | 559.03 | Jarzembska, Katarzyna N.; Hoser, Anna A.; Kamiński, Radosław; Madsen, Anders Ø.; Durka, Krzysztof; Woźniak, Krzysztof Combined Experimental and Computational Studies of Pyrazinamide and Nicotinamide in the Context of Crystal Engineering and Thermodynamics Crystal Growth & Design, 2014, 14, 3453 |
4509867 | CIF | C2 Ca O10.5 P2 | P -1 | 5.7626; 9.672; 10.8216 76.15; 87.995; 72.813 | 559.05 | Niekiel, Felicitas; Stock, Norbert Discovery of New Calcium Etidronates Employing Ultrasound Adapted High-Throughput Methods Crystal Growth & Design, 2014, 14, 599 |
4507301 | CIF | C2 Cl2 F4 | C m c a | 6.305; 10.177; 8.714 90; 90; 90 | 559.1 | Negrier, Philippe; Tamarit, Josep Ll.; Barrio, María; Mondieig, Denise Polymorphism in Halogen-Ethane Derivatives: CCl3‒CCl3and ClF2C‒CF2Cl Crystal Growth & Design, 2013, 13, 782 |
4508892 | CIF | C10 H11 F3 O2 S | P 1 21 1 | 5.0858; 9.5412; 11.5677 90; 93.875; 90 | 560.04 | Asensio, Gregorio; Medio-Simon, Mercedes; Alemán, Pedro; de Arellano, Carmen Ramírez The Role of Organic Fluorine in the Supramolecular Assembly of Halogenated β-Hydroxysulphoxides Diastereomers Crystal Growth & Design, 2006, 6, 2769 |
4502586 | CIF | C4 H7 N3 O2 | P 1 21/c 1 | 7.7179; 9.8143; 7.5218 90; 100.483; 90 | 560.24 | Lee, Tu; Wang, Pu Yun Screening, Manufacturing, Photoluminescence, and Molecular Recognition of Co-Crystals: Cytosine with Dicarboxylic Acids Crystal Growth & Design, 2010, 10, 1419 |
4503656 | CIF | C13 H4 Br F4 N | P 1 c 1 | 9.9477; 5.1827; 11.5038 90; 109.055; 90 | 560.59 | Shirman, Tanya; Lamere, Jean-Francois; Shimon, Linda J. W.; Gupta, Tarkeshwar; Martin, Jan M. L.; van der Boom, Milko E. Halogen-Bonded Supramolecular Assemblies Based on Phenylethynyl Pyridine Derivatives: Driving Crystal Packing through Systematic Chemical Modifications Crystal Growth & Design, 2008, 8, 3066 |
4513110 | CIF | C18 H10 F12 I2 N2 | P -1 | 5.3105; 8.8507; 11.98 92.264; 94.826; 90.157 | 560.64 | Ravat, Prince; SeethaLekshmi, Sunil; Biswas, Sharmita Nandy; Nandy, Purnendu; Varughese, Sunil Equivalence of Ethylene and Azo-Bridges in the Modular Design of Molecular Complexes: Role of Weak Interactions Crystal Growth & Design, 2015, 15, 2389 |
4512518 | CIF | C6 H14 | P n m a | 9.8263; 8.162; 6.9926 90; 90; 90 | 560.8 | Bąk, Joanna M.; Gajda, Roman; Woźniak, Krzysztof New High Pressure Crystal Structures of 2,2-Dimethylbutane and 2,3-Dimethylaniline: Combined X-ray, Raman, and Theoretical Studies Crystal Growth & Design, 2015, 15, 45 |
4502340 | CIF | C12 H14 Cu3 N16 O6 | P -1 | 6.0838; 10.1516; 10.6888 111.677; 100.962; 105.125 | 561.19 | Zeng, Ming-Hua; Zhou, Yan-Ling; Zhang, Wei-Xiong; Du, Miao; Sun, Hao-Ling Microwave-Assisted Stepwise Synthesis and Typically Metamagnetic Behavior of a Unique Two-Dimensional Net-Based Material Based on Linear Cu(II)-Azido Chains Mediated by Discrete Cu(II) Segments Crystal Growth & Design, 2010, 10, 20 |
4506627 | CIF | C13 H8 N4 O | P -1 | 7.7288; 8.6397; 9.7439 74.0993; 81.4628; 63.8558 | 561.44 | Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone Adducts of TCNQ with Neutral Nitrogen Bases. Their Rationalization in Terms of Intermolecular Charge-Transfer (CT) or Electron Donor‒Acceptor (EDA) Interactions Crystal Growth & Design, 2012, 12, 4758 |
4513009 | CIF | C8 H3 F13 O2 | P -1 | 5.122; 6.1827; 18.005 88.91; 87.15; 80.56 | 561.7 | Omorodion, Harrison; Twamley, Brendan; Platts, James A.; Baker, Robert J. Further Evidence on the Importance of Fluorous‒Fluorous Interactions in Supramolecular Chemistry: A Combined Structural and Computational Study Crystal Growth & Design, 2015, 15, 2835 |
4500371 | CIF | C9 H9 B N6 O3 | P -3 | 10.1186; 10.1186; 6.3488 90; 90; 120 | 562.94 | Schubert, David M.; Natan, Daniel T.; Wilson, Duane C.; Hardcastle, Kenneth I. Facile Synthesis and Structures of Cyclic Triimidazole and Its Boric Acid Adduct Crystal Growth & Design, 2011, 11, 843-850 |
4500740 | CIF | C22 H24 N4 O8 | P -1 | 4.7129; 10.011; 12.908 69.426; 87.476; 81.127 | 563.3 | Kohmoto, Shigeo; Okuyama, Shinpei; Yokota, Nobuyuki,; Takahashi, Masahiro; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao Generation of Zwitterionic Water Channels: Biszwitterionic Imidazolium Carboxylates as Hydrogen-Bonding Acceptors Crystal Growth & Design, 2011, 11, 3698 |
4504096 | CIF | C7 H5 N | I 1 2/a 1 | 7.371; 8.701; 9.303 90; 109.05; 90 | 564 | Thalladi, Venkat R.; Dabros, Marta; Gehrke, Annette; Weiss, Hans-Christoph; Boese, Roland Crystal Engineering with ⋮C−H···N and C−H···N Hydrogen Bonds Crystal Growth & Design, 2007, 7, 598 |
4503799 | CIF | C6 H4 N2 O2 | P 1 21/n 1 | 9.0169; 6.8086; 9.3777 90; 101.209; 90 | 564.74 | Copley, Royston C. B.; Barnett, Sarah A.; Karamertzanis, Panagiotis G.; Harris, Kenneth D. M.; Kariuki, Benson M.; Xu, Mingcan; Nickels, E. Anne; Lancaster, Robert W.; Price, Sarah L. Predictable Disorder versus Polymorphism in the Rationalization of Structural Diversity: A Multidisciplinary Study of Eniluracil Crystal Growth & Design, 2008, 8, 3474 |
4511342 | CIF | C18 H22 Ni3 O20 | P -1 | 6.6827; 9.6566; 10.1084 112.735; 93.964; 106.524 | 564.84 | Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer Crystal Growth & Design, 2007, 7, 1205 |
4503977 | CIF | C16 H18 Ag F6 N4 O2 P | P -1 | 4.9284; 10.5139; 11.6977 110.359; 92.989; 93.981 | 565.01 | Chen, Huan-Ching; Hu, Hui-Ling; Chan, Zhi-Kai; Yeh, Chun-Wei; Jia, Hsi-Wei; Wu, Chi-Phi; Chen, Jhy-Der; Wang, Ju-Chun Ag(I) Complexes Containing FlexibleN,N‘-Di(2-pyridyl)adipoamide Ligands: Syntheses, Structures, and Ligand Conformations Crystal Growth & Design, 2007, 7, 698 |
4511341 | CIF | C18 H22 Ni3 O20 | P -1 | 6.6978; 9.6542; 10.1056 112.708; 93.919; 106.591 | 565.79 | Noro, Shin-ichiro; Akutagawa, Tomoyuki; Nakamura, Takayoshi Formation of Strong OH2···-O2C Hydrogen Bonds in a Trinuclear Core-Based Nickel 1,3,5-Benzenetricarboxylate Coordination Polymer Crystal Growth & Design, 2007, 7, 1205 |
4507013 | CIF | C12 H12 N O4 | P -1 | 6.889; 7.714; 11.936 88.649; 82.404; 64.29 | 566.1 | Das, Uttam Kumar; Puranik, Vedavati G.; Dastidar, Parthasarathi Supramolecular Synthon Transferability and Gelation by Diprimary Ammonium Monocarboxylate Salts Crystal Growth & Design, 2012, 12, 5864 |
4508898 | CIF | C10 H11 F3 O2 S | P 1 21 1 | 6.1239; 9.3422; 10.132 90; 102.41; 90 | 566.1 | Asensio, Gregorio; Medio-Simon, Mercedes; Alemán, Pedro; de Arellano, Carmen Ramírez The Role of Organic Fluorine in the Supramolecular Assembly of Halogenated β-Hydroxysulphoxides Diastereomers Crystal Growth & Design, 2006, 6, 2769 |
4503095 | CIF | C10 H10 B2 N4 | P 1 21/m 1 | 4.237; 15.905; 8.414 90; 92.02; 90 | 566.66 | Cavero, Emma; Giménez, Raquel; Uriel, Santiago; Beltrán, Eduardo; Serrano, José Luis; Alkorta, Ibon; Elguero, José The Boat Conformation in Pyrazaboles. A Theoretical and Experimental Study† Crystal Growth & Design, 2008, 8, 838 |
4512700 | CIF | C7 H9 Au N4 S2 | P -1 | 6.3317; 8.1709; 11.3131 77.949; 82.181; 89.668 | 566.92 | Aoyagi, Noboru; Shinha, Yusuke; Ikeda-Ohno, Atsushi; Haga, Yoshinori; Shimojo, Kojiro; Brooks, Neil R.; Izuoka, Akira; Naganawa, Hirochika; Kimura, Takaumi; Binnemans, Koen Photophysical Property ofcatena-Bis(thiocyanato)aurate(I) Complexes in Ionic Liquids Crystal Growth & Design, 2015, 15, 1422 |
4507559 | CIF | C7 H7 F | P n a 21 | 13.215; 4.7872; 8.9622 90; 90; 90 | 567 | Ridout, Joe; Probert, Michael R. High-Pressure and Low-Temperature Polymorphism in C‒H···F‒C Hydrogen Bonded Monofluorotoluenes Crystal Growth & Design, 2013, 13, 1943 |
4511883 | CIF | C14 H10 Cl2 | P 1 21/n 1 | 5.616; 17.1845; 6.2868 90; 110.843; 90 | 567.02 | Harada, Jun; Ogawa, Keiichiro What Molecules Are Likely or Unlikely To Undergo Pedal Motions in Crystals? Crystal Growth & Design, 2014, 14, 5182 |
4508051 | CIF | C4 H4 Li2 O6 | P 1 21/c 1 | 12.0809; 4.9703; 9.4471 90; 91.241; 90 | 567.12 | H.-M. Yeung, Hamish; Kosa, Monica; Parrinello, Michele; Cheetham, Anthony K. Chiral, Racemic, andMeso-Lithium Tartrate Framework Polymorphs: A Detailed Structural Analysis Crystal Growth & Design, 2013, 13, 3705 |
4508982 | CIF | C4 H14 N4 O7 P2 | P -1 | 5.5117; 9.3252; 11.7405 77.762; 79.421; 76.283 | 567.23 | Chen, Shuo-ping; Yuan, Yi-xuan; Pan, Ling-ling; Xu, Shu-qin; Xia, Han; Yuan, Liang-jie A Novel Supramolecular Plaster Based on An Organic Acid−Base Compound: Synthesis, Structure, Mechanical Properties, and Sterilizing Performance Crystal Growth & Design, 2009, 9, 874 |
4500485 | CIF | C5 H5 N O10 Pr S2 | P -1 | 5.0354; 7.0079; 16.6321 88.5; 87.94; 75.47 | 567.679 | Yotnoi, Bunlawee; Rujiwatra, Apinpus; Reddy, M. L. P.; Sarma, Debajit; Natarajan, Srinivasan Lanthanide Sulfate Frameworks: Synthesis, Structure, and Optical Properties Crystal Growth & Design, 2011, 11, 1347 |
4501867 | CIF | C18 H38 N6 S2 | P -1 | 7.9711; 8.9324; 9.7837 69.193; 66.872; 65.622 | 567.79 | Paisner, Kathryn; Zakharov, Lev N.; Doxsee, Kenneth M. A Robust Thiourea Synthon for Crystal Engineering Crystal Growth & Design, 2010, 10, 3757 |
4513283 | CIF | As4 O6 | P 1 21/a 1 | 12.7203; 4.4269; 16.8699 90; 143.284; 90 | 567.94 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4504376 | CIF | C4 H4 Mg O6 | C 1 2/c 1 | 6.866; 9.204; 9.459 90; 108.156; 90 | 568 | Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K. Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues Crystal Growth & Design, 2007, 7, 1522 |
4501793 | CIF | C9 H15 N O8 | P 1 21 1 | 5.223; 8.486; 12.871 90; 95.22; 90 | 568.1 | Kavuru, Padmini; Aboarayes, Dalia; Arora, Kapildev K.; Clarke, Heather D.; Kennedy, Alyssa; Marshall, Lissette; Ong, Tien Teng; Perman, Jason; Pujari, Twarita; Wojtas, Łukasz; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydrogen Bonds Between Carboxylates and Weakly Acidic Hydroxyl Moieties in Cocrystals of Zwitterions Crystal Growth & Design, 2010, 10, 3568-3584 |
4508938 | CIF | C8 H6 Br2 Hg N4 | P 1 21/c 1 | 10.8936; 4.0146; 13.0313 90; 94.357; 90 | 568.26 | Wu, Jing-Yun; Hsu, Hung-Yu; Chan, Chun-Chieh; Wen, Yuh-Sheng; Tsai, Chiitang; Lu, Kuang-Lieh Formation of Infinite Linear Mercury Metal Chains Assisted by Face-to-Face π−π (Aryl−Aryl) Stacking Interactions Crystal Growth & Design, 2009, 9, 258 |
4505215 | CIF | C13 H12 S2 | P 21 21 2 | 10.0741; 12.2003; 4.63 90; 90; 90 | 569.06 | Awaleh, Mohamed Osman; Badia, Antonella; Brisse, François Silver Coodination Polymers with Flexible Ligands. Syntheses, Crystal Structures, and Effect of the Counteranion and the Solvent on the Structure of Complexes [AgL1X]∞of the Bis(Phenylthio)methane LigandL1with Silver(I) Salts, X = ClO4-, BF4-, CF3COO-, CF3SO3-, CF3CF2CF2COO-, and-OOCCF2CF2COO- Crystal Growth & Design, 2005, 5, 1897 |
4503391 | CIF | C16 H20 Fe N14 S2 | P -1 | 7.8691; 8.604; 9.641 77.951; 72.345; 66.951 | 569.3 | Gu, Zhi-Guo; Xu, Yi-Fan; Zhou, Xin-Hui; Zuo, Jing-Lin; You, Xiao-Zeng Assembly of Iron(II)-Triazole Polymers from 1D Chains to 3D Interpenetrated Frameworks: Syntheses, Structures, and Magnetic Properties Crystal Growth & Design, 2008, 8, 1306 |
4504372 | CIF | C4 H4 Mg O6 | I 2 2 2 | 5.1708; 9.359; 11.765 90; 90; 90 | 569.3 | Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K. Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues Crystal Growth & Design, 2007, 7, 1522 |
4513344 | CIF | C13 H10 Br N O2 | P -1 | 3.8698; 11.1898; 13.2866 90.577; 91.09; 98.171 | 569.35 | López-Mejías, Vilmalí; Matzger, Adam J. Structure‒Polymorphism Study of Fenamates: Toward Developing an Understanding of the Polymorphophore Crystal Growth & Design, 2015, 15, 3955 |
4512699 | CIF | C7 H9 Au N4 S2 | P -1 | 6.3546; 8.189; 11.3041 77.928; 82.174; 89.557 | 569.74 | Aoyagi, Noboru; Shinha, Yusuke; Ikeda-Ohno, Atsushi; Haga, Yoshinori; Shimojo, Kojiro; Brooks, Neil R.; Izuoka, Akira; Naganawa, Hirochika; Kimura, Takaumi; Binnemans, Koen Photophysical Property ofcatena-Bis(thiocyanato)aurate(I) Complexes in Ionic Liquids Crystal Growth & Design, 2015, 15, 1422 |
4510659 | CIF | C10 H12 Co N4 | P -4 2 c | 8.81048; 8.81048; 7.34274 90; 90; 90 | 569.98 | Tăbăcaru, Aurel; Pettinari, Claudio; Timokhin, Ivan; Marchetti, Fabio; Carrasco-Marín, Francisco; Maldonado-Hódar, Francisco José; Galli, Simona; Masciocchi, Norberto Enlarging an Isoreticular Family: 3,3′,5,5′-Tetramethyl-4,4′-bipyrazolato-Based Porous Coordination Polymers Crystal Growth & Design, 2013, 13, 3087 |
4508440 | CIF | C12 H8 Br2 N2 | P 1 21/c 1 | 10.9225; 4.4318; 11.9113 90; 98.145; 90 | 570.77 | Karanam, Maheswararao; Choudhury, Angshuman Roy Study of Halogen-Mediated Weak Interactions in a Series of Halogen-Substituted Azobenzenes Crystal Growth & Design, 2013, 13, 4803 |
4517059 | CIF | C12 H11 N3 O S | P -1 | 3.9533; 10.6197; 14.3961 74.675; 82.622; 79.443 | 570.99 | Trzesowska-Kruszynska, Agata Solvent-Free and Catalysis-Free Approach to the Solid State in Situ Growth of Crystalline Isoniazid Hydrazones Crystal Growth & Design, 2013, 13, 3892 |
4509498 | CIF | C11 H14 N2 O4 | P -1 | 7.4036; 8.1567; 10.1469 81.381; 89.228; 70.789 | 571.68 | Mohamed, Sharmarke; Tocher, Derek A.; Vickers, Martin; Karamertzanis, Panagiotis G.; Price, Sarah L. Salt or Cocrystal? A New Series of Crystal Structures Formed from Simple Pyridines and Carboxylic Acids Crystal Growth & Design, 2009, 9, 2881 |
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 |
4513077 | CIF | C10 H7 N3 O S3 | P 1 21 1 | 9.3997; 4.2844; 14.2053 90; 91.627; 90 | 571.85 | Yutronkie, Nathan J.; Leitch, Alicea A.; Korobkov, Ilia; Brusso, Jaclyn L. 1,2,4,6-Thiatriazinyl Radicals and Dimers: Structural and Electronic Tuning through Heteroaromatic Substituent Modification Crystal Growth & Design, 2015, 15, 2524 |
4510662 | CIF | C10 H12 N4 Zn | P -4 2 c | 8.81181; 8.81181; 7.36675 90; 90; 90 | 572.01 | Tăbăcaru, Aurel; Pettinari, Claudio; Timokhin, Ivan; Marchetti, Fabio; Carrasco-Marín, Francisco; Maldonado-Hódar, Francisco José; Galli, Simona; Masciocchi, Norberto Enlarging an Isoreticular Family: 3,3′,5,5′-Tetramethyl-4,4′-bipyrazolato-Based Porous Coordination Polymers Crystal Growth & Design, 2013, 13, 3087 |
4510641 | CIF | C7 H4 Ba0.5 O2 | C 1 2/m 1 | 6.9551; 5.9467; 13.852 90; 92.399; 90 | 572.4 | Foo, Maw Lin; Horike, Satoshi; Duan, Jingui; Chen, Wenqian; Kitagawa, Susumu Tuning the Dimensionality of Inorganic Connectivity in Barium Coordination Polymers via Biphenyl Carboxylic Acid Ligands Crystal Growth & Design, 2013, 13, 2965 |
4511722 | CIF | C7 H14 Br2 O3 | P m n 21 | 12.016; 10.6738; 4.4634 90; 90; 90 | 572.46 | Yufit, D. S.; Shishkin, O. V.; Zubatyuk, R. I.; Howard, J. A. K. Trimethyltrioxane (Paraldehyde) and Its Halomethanes Complexes: Crystallization, Structures, and Analysis of Packing Motifs Crystal Growth & Design, 2014, 14, 4303 |
4510210 | CIF | C12 H13 N3 S | P -1 | 5.9338; 7.3798; 13.2891 99.4247; 93.1907; 92.2136 | 572.51 | Lumpi, Daniel; Glöcklhofer, Florian; Holzer, Brigitte; Stöger, Berthold; Hametner, Christian; Reider, Georg A.; Fröhlich, Johannes Systematic Investigations on 1,2,3-Triazole-Based Compounds Capable of Second Harmonic Generation Crystal Growth & Design, 2014, 14, 1018 |
4504590 | CIF | C2 H6 Cl N5 | P 21 21 21 | 5.5395; 13.402; 7.715 90; 90; 90 | 572.76 | Laus, G.; Kahlenberg, V.; Többens, D. M.; Jetti, R. K. R.; Griesser, U. J.; Schütz, J.; Kristeva, E.; Wurst, K.; Schottenberger, H. Lattice Architecture and Hydrogen-Bonding Networks ofN-Aminoazolium andN,N‘-Diaminoazolium Chlorides Crystal Growth & Design, 2006, 6, 404 |
4503096 | CIF | C10 H6 B2 F4 N4 | C 1 2/m 1 | 10.974; 9.604; 5.5258 90; 100.205; 90 | 573.2 | Cavero, Emma; Giménez, Raquel; Uriel, Santiago; Beltrán, Eduardo; Serrano, José Luis; Alkorta, Ibon; Elguero, José The Boat Conformation in Pyrazaboles. A Theoretical and Experimental Study† Crystal Growth & Design, 2008, 8, 838 |
4511790 | CIF | C32 H24 N2 O2 | P -1 | 5.8501; 7.8284; 13.0761 74.624; 83.442; 86.913 | 573.46 | Calvo-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 |
4503165 | CIF | C12 H8 Ca2 O6 | P 1 21/c 1 | 12.627; 7.8053; 5.8555 90; 95.954; 90 | 573.99 | Volkringer, Christophe; Marrot, Jérôme; Férey, Gérard; Loiseau, Thierry Hydrothermal Crystallization of Three Calcium-Based Hybrid Solids with 2,6-Naphthalene- or 4,4′-Biphenyl-Dicarboxylates Crystal Growth & Design, 2008, 8, 685 |
4503136 | CIF | C8 H11 N O2 | P 1 21/c 1 | 7.938; 9.754; 7.481 90; 97.03; 90 | 574.9 | Wood, Peter A.; Haynes, Delia A.; Lennie, Alistair R.; Motherwell, W. D. Samuel; Parsons, Simon; Pidcock, Elna; Warren, John E. The Anisotropic Compression of the Crystal Structure of 3-Aza-bicyclo(3.3.1)nonane-2,4-dione to 7.1 GPa Crystal Growth & Design, 2008, 8, 549 |
4513189 | CIF | C13 H8 N2 O5 | P -1 | 7.509; 7.967; 10.623 75.53; 83.95; 69.2 | 575.2 | Thakur, Tejender S.; Singh, Shiv Shankar Studying the Role of C═O···C═O, C═O···N‒O, and N‒O···N‒O Dipole‒Dipole Interactions in the Crystal Packing of 4-Nitrobenzoic Acid and 3,3′-Dinitrobenzophenone Polymorphs: An Experimental Charge Density Study Crystal Growth & Design, 2015, 15, 3280 |
4504285 | CIF | B2 Ba O4 | R 3 c :R | 8.3824; 8.3824; 8.3824 96.86; 96.86; 96.86 | 575.22 | Pan, Shilie; Smit, Jared P.; Lanier, Courtney H.; Marvel, Michael R.; Marks, Laurence D.; Poeppelmeier, Kenneth R. Optical Floating Zone Growth of β-BaB2O4from a LiBa2B5O10-Based Solvent Crystal Growth & Design, 2007, 7, 1561 |
4500099 | CIF | C8 H12 N2 O4 S2 Zn | P 1 21 1 | 9.733; 5.7183; 10.359 90; 93.193; 90 | 575.6 | Dong, Lanjun; Chu, Wei; Zhu, Qinlei; Huang, Rudan Three Novel Homochiral Helical Metal−Organic Frameworks Based on Amino Acid Ligand: Syntheses, Crystal Structures, and Properties Crystal Growth & Design, 2011, 11, 93 |
4503635 | CIF | C2 Mg O6 | P 1 21/c 1 | 8.65107; 7.15222; 9.4041 90; 98.1659; 90 | 575.97 | Rossin, Andrea; Ienco, Andrea; Costantino, Ferdinando; Montini, Tiziano; Di Credico, Barbara; Caporali, Maria; Gonsalvi, Luca; Fornasiero, Paolo; Peruzzini, Maurizio Phase Transitions and CO2Adsorption Properties of Polymeric Magnesium Formate Crystal Growth & Design, 2008, 8, 3302 |
4513481 | CIF | Cs2 O12 Te W3 | P 63 | 7.3279; 7.3279; 12.4075 90; 90; 120 | 577 | Zhao, Peng; Cong, Hengjiang; Tian, Xiangxin; Sun, Youxuan; Zhang, Chengqian; Xia, Shengqing; Gao, Zeliang; Tao, Xutang Top-Seeded Solution Growth, Structure, Morphology, and Functional Properties of a New Polar Crystal — Cs2TeW3O12 Crystal Growth & Design, 2015, 15, 4484 |
4508471 | CIF | C13 H12 N2 O3 | P -1 | 7.248; 7.5279; 11.8142 92.36; 96.283; 115.193 | 577.02 | Mocilac, Pavle; Gallagher, John F. The First Phenyl-N-pyridinylcarbamate Structures: Structural and Conformational Analysis of Nine Methoxyphenyl-N-pyridinylcarbamates Crystal Growth & Design, 2013, 13, 5295 |
4503664 | CIF | C13 H13 N3 O | P 1 n 1 | 6.3926; 8.4521; 10.6951 90; 91.899; 90 | 577.55 | Byrne, Peter; Turner, David R.; Lloyd, Gareth O.; Clarke, Nigel; Steed, Jonathan W. Gradual Transition from NH···Pyridyl Hydrogen Bonding to the NH···O Tape Synthon in Pyridyl Ureas Crystal Growth & Design, 2008, 8, 3335 |
4513190 | CIF | C13 H8 N2 O5 | P 21 21 2 | 18.94; 5.029; 6.071 90; 90; 90 | 578.3 | Thakur, Tejender S.; Singh, Shiv Shankar Studying the Role of C═O···C═O, C═O···N‒O, and N‒O···N‒O Dipole‒Dipole Interactions in the Crystal Packing of 4-Nitrobenzoic Acid and 3,3′-Dinitrobenzophenone Polymorphs: An Experimental Charge Density Study Crystal Growth & Design, 2015, 15, 3280 |
4510136 | CIF | C29 H24 N4 O5 | P -1 | 4.5301; 11.579; 12.321 111.787; 99.823; 97.184 | 578.7 | Xu, Weiwei L.; Smith, Mark D.; Krause, Jeanette A.; Greytak, Andrew B.; Ma, Shuguo; Read, Cory M.; Shimizu, Linda S. Single Crystal to Single Crystal Polymerization of a Self-Assembled Diacetylene Macrocycle Affords Columnar Polydiacetylenes Crystal Growth & Design, 2014, 14, 993 |
4511882 | CIF | C14 H10 Cl2 | P 1 21/n 1 | 5.6669; 17.2268; 6.3486 90; 110.947; 90 | 578.81 | Harada, Jun; Ogawa, Keiichiro What Molecules Are Likely or Unlikely To Undergo Pedal Motions in Crystals? Crystal Growth & Design, 2014, 14, 5182 |
4512737 | CIF | C7 H6 Br4 N2 S | P -1 | 8.2516; 8.6933; 8.9277 98.4; 113.166; 92.397 | 578.98 | Koskinen, Laura; Jääskeläinen, Sirpa; Hirva, Pipsa; Haukka, Matti Tunable Interaction Strength and Nature of the S···Br Halogen Bonds in [(Thione)Br2] Systems Crystal Growth & Design, 2015, 15, 1160 |
4500910 | CIF | C18 H28 N6 Ni O10 | P -1 | 5.063; 11.085; 11.423 114.762; 94.467; 91.743 | 579 | Seth, Saikat Kumar; Saha, Indranil; Estarellas, Carolina; Frontera, Antonio; Kar, Tanusree; Mukhopadhyay, Subrata Supramolecular Self-Assembly of M-IDA Complexes Involving Lone-Pair···π Interactions: Crystal Structures, Hirshfeld Surface Analysis, and DFT Calculations [H2IDA = iminodiacetic acid, M = Cu(II), Ni(II)] Crystal Growth & Design, 2011, 11, 3250 |
4505801 | CIF | C9 H9 I3 | P -1 | 7.982; 9.587; 9.627 120.01; 108.548; 94.437 | 579.2 | Bosch, Eric; Barnes, Charles L. Triangular Halogen−Halogen−Halogen Interactions as a Cohesive Force in the Structures of Trihalomesitylenes Crystal Growth & Design, 2002, 2, 299 |
4509942 | CIF | C8 H2 Br4 O4 | C 1 2/m 1 | 8.0299; 10.3117; 7.0948 90; 99.5592; 90 | 579.31 | Dey, Sanjoy Kumar; Saha, Rajat; Biswas, Susobhan; Layek, Animesh; Middya, Somnath; Steele, Ian M.; Fleck, Michel; Ray, Partha Pratim; Kumar, Sanjay Tetrabromoterepthalic Acid in Designing Co-crystals and Salts: Modification of Optical Properties and Schottky Barrier Effect Crystal Growth & Design, 2014, 14, 207 |
4505655 | CIF | C6 H6 N2 O | P 1 21/c 1 | 10.1756; 5.7319; 10.034 90; 98.042; 90 | 579.48 | Aakeröy, Christer B.; Beatty, Alicia M.; Helfrich, Brian A.; Nieuwenhuyzen, Mark Do Polymorphic Compounds Make Good Cocrystallizing Agents? A Structural Case Study that Demonstrates the Importance of Synthon Flexibility Crystal Growth & Design, 2003, 3, 159 |
4500649 | CIF | Cs2 Mo3 O12 Te | P 63 | 7.4045; 7.4045; 12.2053 90; 90; 120 | 579.523 | Zhang, Junjie; Tao, Xutang; Sun, Youxuan; Zhang, Zhonghan; Zhang, Chengqian; Gao, Zeliang; Xia, Haibing; Xia, Shengqing Top-Seeded Solution Growth, Morphology, and Properties of a Polar Crystal Cs2TeMo3O12 Crystal Growth & Design, 2011, 11, 1863 |
4506934 | CIF | C18 H20 Cu N6 O10 | P -1 | 8.3131; 8.4982; 8.8252 69.901; 86.713; 82.023 | 579.8 | Banerjee, Subhabrata; Kumar, Dhurjati Prasad; Bandyopadhay, Sabyasachi; Adarsh, N. N.; Dastidar, Parthasarathi A New Series of CuIICoordination Polymers Derived from Bis-pyridyl-bis-urea Ligands and Various Dicarboxylates and Their Role in Methanolysis of Epoxide Ring-Opening Catalysis Crystal Growth & Design, 2012, 12, 5546 |
4509579 | CIF | C20 H22 N2 Ni O10 S2 | P -1 | 8.4893; 8.6526; 9.101 101.348; 90.266; 117.075 | 580.2 | Kanoo, Prakash; K. L., Gurunatha; Maji, Tapas Kumar Temperature-Controlled Synthesis of Metal-Organic Coordination Polymers: Crystal Structure, Supramolecular Isomerism, and Porous Property Crystal Growth & Design, 2009, 9, 4147 |
4502537 | CIF | C26 H19.32 N4 O11.68 | P -1 | 3.6207; 12.4908; 13.5227 72.641; 89.258; 83.979 | 580.39 | Clarke, Heather D.; Arora, Kapildev K.; Bass, Heather; Kavuru, Padmini; Ong, Tien Teng; Pujari, Twarita; Wojtas, Lukasz; Zaworotko, Michael J. Structure−Stability Relationships in Cocrystal Hydrates: Does the Promiscuity of Water Make Crystalline Hydrates the Nemesis of Crystal Engineering? Crystal Growth & Design, 2010, 10, 2152 |
4509511 | CIF | C6 H8 Cl2 N4 O8 | P 1 21/n 1 | 5.1021; 13.9416; 8.3028 90; 100.191; 90 | 581.27 | Boldog, Ishtvan; Daran, Jean-Claude; Chernega, Alexander N.; Rusanov, Eduard B.; Krautscheid, Harald; Domasevitch, Konstantin V. Hydrogen Bonding Patterns and Supramolecular Structure of 4,4′-Bipyrazolium Salts Crystal Growth & Design, 2009, 9, 2895 |
4513078 | CIF | C12 H9 N5 O S | P -1 | 6.4045; 7.617; 12.4324 82.682; 82.181; 76.697 | 581.82 | Yutronkie, Nathan J.; Leitch, Alicea A.; Korobkov, Ilia; Brusso, Jaclyn L. 1,2,4,6-Thiatriazinyl Radicals and Dimers: Structural and Electronic Tuning through Heteroaromatic Substituent Modification Crystal Growth & Design, 2015, 15, 2524 |
4509555 | CIF | B2 Bi2 O7 Zn | P b a 2 | 10.823; 11.016; 4.8844 90; 90; 90 | 582.35 | Li, Feng; Pan, Shilie; Hou, Xueling; Yao, Jun A Novel Nonlinear Optical Crystal Bi2ZnOB2O6 Crystal Growth & Design, 2009, 9, 4091 |
4503219 | CIF | C20 H24 Cl4 N2 O4 Pd | P -1 | 7.033; 8.1804; 10.1362 87.805; 88.231; 89.157 | 582.4 | Yue, Chengyang; Jiang, Feilong; Xu, Ying; Yuan, Daqiang; Chen, Lian; Yan, Chunfeng; Hong, Maochun The Aggregations and Strong Emissions of d8 and d10 Metal‒8-Hydroxyquinaldine Complexes Crystal Growth & Design, 2008, 8, 2721-2728 |
4511460 | CIF | C2 H2 Cl2 Cu2 N3 | I m m a | 6.764; 6.981; 12.338 90; 90; 90 | 582.6 | Zhai, Quan-Guo; Lu, Can-Zhong; Chen, Shu-Mei; Xu, Xin-Jiang; Yang, Wen-Bin Design of Novel Three-Dimensional Coordination Polymers Based on Triangular Trinuclear Copper 1,2,4-Triazolate Units Crystal Growth & Design, 2006, 6, 1393 |
4511255 | CIF | C16 H30 N4 O8 P2 S2 | P -1 | 4.8022; 10.3715; 12.108 99.771; 93.061; 99.947 | 583.24 | Lie, 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 |
4514294 | CIF | C5 Ca4 Na2 O15 | P 63 m c | 10.37402; 10.37402; 6.25935 90; 90; 120 | 583.383 | Rashchenko, Sergey V.; Bakakin, Vladimir V.; Shatskiy, Anton F.; Gavryushkin, Pavel N.; Seryotkin, Yurii V.; Litasov, Konstantin D. Noncentrosymmetric Na2Ca4(CO3)5 Carbonate of “M13M23XY3Z” Structural Type and Affinity between Borate and Carbonate Structures for Design of New Optical Materials Crystal Growth & Design, 2017, 17, 6079 |
4500403 | CIF | C12 H20 N O2 | P -1 | 6.5205; 9.0147; 11.2738 67.047; 74.083; 79.039 | 584.22 | Lemmerer, Andreas Two-Dimensional Hydrogen-Bonding Patterns in a Series of Salts of Terephthalic Acid and the Cyclic Amines CnH2n−1NH2,n= 3, 4, 5, 6, 7, 8, and 12 Crystal Growth & Design, 2011, 11, 583 |
4508004 | CIF | C5 H8 O4 | C 1 2/c 1 | 12.961; 4.7227; 9.6498 90; 98.41; 90 | 584.32 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4511788 | CIF | C12 H8 Ca N2 O6 | P 1 21/c 1 | 7.0489; 10.8422; 8.0341 90; 107.826; 90 | 584.53 | White, Keith F.; Abrahams, Brendan F.; Maynard-Casely, Helen; Robson, Richard Li+and Ca2+Derivatives of the Isonicotinate-N-oxide Ion Including Single Crystal-to-Single Crystal Transformations Crystal Growth & Design, 2014, 14, 4602 |
4505685 | CIF | C24 H12 I4 N2 | P -1 | 7.362; 19.278; 4.2134 94.07; 98.13; 97.22 | 584.88 | Crihfield, April; Hartwell, Joshua; Phelps, Dustin; Walsh, Rosa Bailey; Harris, Jeffery L.; Payne, John F.; Pennington, William T.; Hanks, Timothy W. Crystal Engineering through Halogen Bonding. 2. Complexes of Diacetylene-Linked Heterocycles with Organic Iodides Crystal Growth & Design, 2003, 3, 313 |
4504112 | CIF | C6 H14 F Ga N2 O8 Se | P -1 | 6.377; 9.282; 11.4112 66.531; 77.448; 71.889 | 585.47 | Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures Crystal Growth & Design, 2007, 7, 770 |
4513282 | CIF | As4 O6 | P 1 21/a 1 | 12.8439; 4.4632; 17.122 90; 143.381; 90 | 585.47 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4512190 | CIF | C7 H6 Cu Mo2 N4 O7 | P -1 | 5.129; 9.7697; 12.5421 110.797; 93.722; 90.436 | 585.97 | Qi, Zhi-Kai; Liu, Jun-Liang; Hou, Juan-Juan; Liu, Min-Min; Zhang, Xian-Ming Planar Cu2(ppz)2Dimers as SBUs for Diverse Polyoxometalate-Based Metal Organic Frameworks Crystal Growth & Design, 2014, 14, 5773 |
4506226 | CIF | C7 H7 N O2 | P 1 21/a 1 | 21.3393; 7.29604; 3.77733 90; 94.824; 90 | 586.02 | Williams, P. Andrew; Hughes, Colan E.; Lim, Gin Keat; Kariuki, Benson M.; Harris, Kenneth D. M. Discovery of a New System Exhibiting Abundant Polymorphism:m-Aminobenzoic Acid Crystal Growth & Design, 2012, 12, 3104 |
4508292 | CIF | C22 H24 Br F4 I N4 | P -1 | 7.082; 9.4394; 9.9426 70.354; 69.519; 83.639 | 586.38 | Aaker Christer B.; Chopade, Prashant D.; Desper, John Establishing a Hierarchy of Halogen Bonding by Engineering Crystals without Disorder Crystal Growth & Design, 2013, 13, 4145 |
4507463 | CIF | C22 H32 N6 O6 | P -1 | 6.8942; 7.1004; 12.4475 104.455; 92.4; 95.106 | 586.4 | Sarcevica, Inese; Orola, Liana; Veidis, Mikelis V.; Podjava, Anton; Belyakov, Sergey Crystal and Molecular Structure and Stability of Isoniazid Cocrystals with Selected Carboxylic Acids Crystal Growth & Design, 2013, 13, 1082 |
4508260 | CIF | Bi4 Mn S7 | C 1 2/m 1 | 12.916; 3.97; 11.831 90; 104.755; 90 | 586.6 | Luo, Zhong-Zhen; Lin, Chen-Sheng; Cheng, Wen-Dan; Zhang, Wei-Long; Li, Yuan-Bing; Yang, Yi; Zhang, Hao; He, Zhang-Zhen From One-Dimensional Linear Chain to Two-Dimensional Layered Chalcogenides XBi4S7(X = Mn, Fe): Syntheses, Crystal and Electronic Structures, and Physical Properties Crystal Growth & Design, 2013, 13, 4118 |
4508052 | CIF | C4 H4 Li2 O6 | C 1 2 1 | 15.153; 5.0136; 10.376 90; 131.89; 90 | 586.8 | H.-M. Yeung, Hamish; Kosa, Monica; Parrinello, Michele; Cheetham, Anthony K. Chiral, Racemic, andMeso-Lithium Tartrate Framework Polymorphs: A Detailed Structural Analysis Crystal Growth & Design, 2013, 13, 3705 |
4503848 | CIF | C8 H11 O7 P2 Pr | P -1 | 5.6753; 9.528; 11.5759 73.985; 80.573; 79.193 | 586.82 | Shi, Fa-Nian; Trindade, Tito; Rocha, João; Paz, Filipe A. Almeida Hydro-Ionothermal Synthesis of Lanthanide-Organic Frameworks with 1,4-Phenylenebis(methylene)diphosphonate Crystal Growth & Design, 2008, 8, 3917 |
4511880 | CIF | C16 H16 | P 1 21/n 1 | 5.7047; 16.8879; 6.5872 90; 112.365; 90 | 586.88 | Harada, Jun; Ogawa, Keiichiro What Molecules Are Likely or Unlikely To Undergo Pedal Motions in Crystals? Crystal Growth & Design, 2014, 14, 5182 |
4508005 | CIF | C5 H8 O4 | C 1 2/c 1 | 12.939; 4.7343; 9.6827 90; 98.244; 90 | 587 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4503135 | CIF | C8 H11 N O2 | P 1 21/c 1 | 8.054; 9.782; 7.5043 90; 96.8; 90 | 587.1 | Wood, Peter A.; Haynes, Delia A.; Lennie, Alistair R.; Motherwell, W. D. Samuel; Parsons, Simon; Pidcock, Elna; Warren, John E. The Anisotropic Compression of the Crystal Structure of 3-Aza-bicyclo(3.3.1)nonane-2,4-dione to 7.1 GPa Crystal Growth & Design, 2008, 8, 549 |
4504592 | CIF | C3 H7 Cl N4 | C 1 2/c 1 | 4.6613; 16.2967; 7.8232 90; 98.524; 90 | 587.72 | Laus, G.; Kahlenberg, V.; Többens, D. M.; Jetti, R. K. R.; Griesser, U. J.; Schütz, J.; Kristeva, E.; Wurst, K.; Schottenberger, H. Lattice Architecture and Hydrogen-Bonding Networks ofN-Aminoazolium andN,N‘-Diaminoazolium Chlorides Crystal Growth & Design, 2006, 6, 404 |
4506052 | CIF | C4 H4 N2 S2 | P 1 21/c 1 | 4.1926; 14.5355; 9.786 90; 99.772; 90 | 587.72 | Jarzembska, Katarzyna N.; Kubsik, Marcin; Kamiński, Radosław; Woźniak, Krzysztof; Dominiak, Paulina M. From a Single Molecule to Molecular Crystal Architectures: Structural and Energetic Studies of Selected Uracil Derivatives Crystal Growth & Design, 2012, 12, 2508 |
4504646 | CIF | C24 H34 N4 O6 | P -1 | 5.3767; 6.5416; 17.0662 92.809; 90.247; 101.314 | 587.82 | Aakeröy, Christer B.; Hussain, Izhar; Desper, John 2-Acetaminopyridine: A Highly Effective Cocrystallizing Agent Crystal Growth & Design, 2006, 6, 474 |
4507106 | CIF | C11 H8 I N3 O2 | P -1 | 6.7767; 8.0047; 11.1806 83.315; 77.745; 85.862 | 587.94 | Aakeröy, Christer B.; Hurley, Evan P.; Desper, John Modulating Supramolecular Reactivity Using Covalent “Switches” on a Pyrazole Platform Crystal Growth & Design, 2012, 12, 5806 |
4508261 | CIF | Bi4 Fe S7 | C 1 2/m 1 | 12.823; 3.987; 11.878 90; 104.38; 90 | 588.2 | Luo, Zhong-Zhen; Lin, Chen-Sheng; Cheng, Wen-Dan; Zhang, Wei-Long; Li, Yuan-Bing; Yang, Yi; Zhang, Hao; He, Zhang-Zhen From One-Dimensional Linear Chain to Two-Dimensional Layered Chalcogenides XBi4S7(X = Mn, Fe): Syntheses, Crystal and Electronic Structures, and Physical Properties Crystal Growth & Design, 2013, 13, 4118 |
4501870 | CIF | C20 H42 N6 S2 | P -1 | 8.5296; 8.9162; 9.0911 64.991; 88.749; 71.49 | 589.05 | Paisner, Kathryn; Zakharov, Lev N.; Doxsee, Kenneth M. A Robust Thiourea Synthon for Crystal Engineering Crystal Growth & Design, 2010, 10, 3757 |
4502124 | CIF | C21 H18 Co N4 O7 | P -1 | 5.883; 8.621; 12.088 84.727; 76.275; 82.535 | 589.3 | Adarsh, N. N.; Sahoo, Pathik; Dastidar, Parthasarathi Is a Crystal Engineering Approach Useful in Designing Metallogels? A Case Study Crystal Growth & Design, 2010, 10, 4976 |
4500394 | CIF | C14 H8 Cl2 O2 | P 1 2/n 1 | 6.0292; 3.8688; 25.3201 90; 92.004; 90 | 590.25 | Felsmann, Marika; Eissmann, Frank; Schwarzer, Anke; Weber, Edwin Competitive Interactions in the Crystal Structures of Benzils Effected by Different Halogen Substitution Crystal Growth & Design, 2011, 11, 982 |
4505085 | CIF | C6 H12 Co N O9 P | P -1 | 7.292; 8.255; 10.055 97.329; 90.552; 100.293 | 590.3 | Kong, Deyuan; Clearfield, Abraham Supramolecular Hydrogen-Bonded Frameworks from 6-Phosphonopyridine-2-carboxylic Acid and Transition Metal Ions Crystal Growth & Design, 2005, 5, 1263 |
4512802 | CIF | C30 H28 O4 | P -1 | 7.4245; 9.1185; 9.7082 65.447; 81.305; 87.384 | 590.84 | Saraswatula, Viswanadha G.; Saha, Binoy K. Modulation of Thermal Expansion by Guests and Polymorphism in a Hydrogen Bonded Host Crystal Growth & Design, 2015, 15, 593 |
4507040 | CIF | C13 H13 N O4 | P -1 | 7.0778; 7.3457; 11.6711 88.147; 79.634; 81.894 | 590.91 | Stilinović, Vladimir; Kaitner, Branko Salts and Co-Crystals of Gentisic Acid with Pyridine Derivatives: The Effect of Proton Transfer on the Crystal Packing (and Vice Versa) Crystal Growth & Design, 2012, 12, 5763 |
4512474 | CIF | B6 Ba2 F Na3 O12 | P 63/m | 7.3489; 7.3489; 12.642 90; 90; 120 | 591.3 | Zhang, Hui; Zhang, Min; Pan, Shilie; Yang, Zhihua; Wang, Zheng; Bian, Qiang; Hou, Xueling; Yu, Hongwei; Zhang, Fangfang; Wu, Kui; Yang, Feng; Peng, Qinjun; Xu, Zuyan; Chang, Kelvin B.; Poeppelmeier, Kenneth R. Na3Ba2(B3O6)2F: Next Generation of Deep-Ultraviolet Birefringent Materials Crystal Growth & Design, 2015, 15, 523 |
4510516 | CIF | C11 H11 N3 S2 | P -1 | 5.7601; 8.871; 12.097 103.779; 96.286; 95.705 | 591.67 | Phukan, 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 |
4503847 | CIF | C8 H11 Ce O7 P2 | P -1 | 5.7048; 9.5728; 11.6025 73.808; 80.12; 78.725 | 592.12 | Shi, Fa-Nian; Trindade, Tito; Rocha, João; Paz, Filipe A. Almeida Hydro-Ionothermal Synthesis of Lanthanide-Organic Frameworks with 1,4-Phenylenebis(methylene)diphosphonate Crystal Growth & Design, 2008, 8, 3917 |
4501533 | CIF | C11 H14 Cu N5 | P -1 | 8.1924; 8.312; 8.9434 85.22; 86.68; 77.72 | 592.5 | Xia, Jun; Zhang, Zhen-jie; Shi, Wei; Wei, Jun-fu; Cheng, Peng Copper(I) Cyanide Coordination Polymers Constructed from Bis(Pyrazole-1-yl)alkane Ligands: Observation of the Odd−Even Dependence in the Structures Crystal Growth & Design, 2010, 10, 2323 |
4513298 | CIF | As4 O6 | P 1 21/a 1 | 12.905; 4.4711; 17.262 90; 143.483; 90 | 592.7 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4508132 | CIF | Au Eu In4 | C m c m | 4.608; 17.0454; 7.5462 90; 90; 90 | 592.72 | Sarkar, Sumanta; Gutmann, Matthias J.; Peter, Sebastian C. Crystal Structure and Magnetic Properties of Indium Flux Grown EuAu2In4and EuAuIn4 Crystal Growth & Design, 2013, 13, 4285 |
4507757 | CIF | C19 H17 N13 O7 S | P -1 | 6.521; 8.064; 11.952 76.591; 75.856; 87.095 | 592.8 | Sanphui, Palash; Babu, N. Jagadeesh; Nangia, Ashwini Temozolomide Cocrystals with Carboxamide Coformers Crystal Growth & Design, 2013, 13, 2208 |
4501590 | CIF | C9 H21 O4 P | P 63 | 9.736; 9.736; 7.223 90; 90; 120 | 592.9 | Durrell, Alec C.; Gray, Harry B.; Hazari, Nilay; Incarvito, Christopher D.; Liu, Jian; Yan, Elsa C. Y. Tris(hydroxypropyl)phosphine Oxide: A Chiral Three-Dimensional Material with Nonlinear Optical Properties Crystal Growth & Design, 2010, 10, 1482 |
4501433 | CIF | C24 H22 Cu2 I2 N4 | P -1 | 7.1455; 8.7718; 10.462 67.487; 87.84; 78.498 | 593.07 | Samai, Suman; Biradha, Kumar Coordination Polymers of Flexible Bis(benzimidazole) Ligand: Halogen Bridging and Metal···Arene Interactions Crystal Growth & Design, 2011, 11, 5723 |
4511881 | CIF | C14 H10 Cl2 | P 1 21/n 1 | 5.721; 17.3014; 6.4223 90; 111.047; 90 | 593.28 | Harada, Jun; Ogawa, Keiichiro What Molecules Are Likely or Unlikely To Undergo Pedal Motions in Crystals? Crystal Growth & Design, 2014, 14, 5182 |
4503166 | CIF | C14 H8 Ca O5 | P 1 21 1 | 5.8237; 6.9339; 14.7231 90; 93.588; 90 | 593.37 | Volkringer, Christophe; Marrot, Jérôme; Férey, Gérard; Loiseau, Thierry Hydrothermal Crystallization of Three Calcium-Based Hybrid Solids with 2,6-Naphthalene- or 4,4′-Biphenyl-Dicarboxylates Crystal Growth & Design, 2008, 8, 685 |
4508050 | CIF | C4 H4 Li2 O6 | C 1 c 1 | 9.688; 5.3821; 11.409 90; 93.959; 90 | 593.47 | H.-M. Yeung, Hamish; Kosa, Monica; Parrinello, Michele; Cheetham, Anthony K. Chiral, Racemic, andMeso-Lithium Tartrate Framework Polymorphs: A Detailed Structural Analysis Crystal Growth & Design, 2013, 13, 3705 |
4510956 | CIF | C7 H8 Cu0.5 F3 N4 O3 S | P -1 | 8.389; 8.824; 9.945 111.344; 91.105; 117.297 | 593.71 | Di Nicola, Corrado; Garau, Federica; Gazzano, Massimo; Monari, Magda; Pandolfo, Luciano; Pettinari, Claudio; Pettinari, Riccardo Reactions of a Coordination Polymer Based on the Triangular Cluster [Cu3(μ3-OH)(μ-pz)3]2+with Strong Acids. Crystal Structure and Supramolecular Assemblies of New Mono-, Tri-, and Hexanuclear Complexes and Coordination Polymers Crystal Growth & Design, 2010, 10, 3120 |
4512803 | CIF | C30 H28 O4 | P -1 | 7.433; 9.1346; 9.726 65.509; 81.163; 87.357 | 593.71 | Saraswatula, Viswanadha G.; Saha, Binoy K. Modulation of Thermal Expansion by Guests and Polymorphism in a Hydrogen Bonded Host Crystal Growth & Design, 2015, 15, 593 |
4512804 | CIF | C30 H28 O4 | P -1 | 7.4305; 9.1357; 9.7242 65.621; 81.044; 87.369 | 593.79 | Saraswatula, Viswanadha G.; Saha, Binoy K. Modulation of Thermal Expansion by Guests and Polymorphism in a Hydrogen Bonded Host Crystal Growth & Design, 2015, 15, 593 |
4509945 | CIF | C18 H10 Br4 I2 N2 O4 | P -1 | 6.8225; 8.9985; 10.1541 96.117; 90.172; 106.548 | 593.8 | Dey, Sanjoy Kumar; Saha, Rajat; Biswas, Susobhan; Layek, Animesh; Middya, Somnath; Steele, Ian M.; Fleck, Michel; Ray, Partha Pratim; Kumar, Sanjay Tetrabromoterepthalic Acid in Designing Co-crystals and Salts: Modification of Optical Properties and Schottky Barrier Effect Crystal Growth & Design, 2014, 14, 207 |
4510496 | CIF | C8 H10 K2 O10 | P 1 21/n 1 | 6.2679; 15.3935; 6.3897 90; 105.5; 90 | 594.09 | Chanthapally, 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 |
4502659 | CIF | C24 H26 Mn N8 O2 | P -1 | 5.5655; 9.3702; 11.7543 94.321; 96.734; 100.837 | 594.91 | Abrahams, Brendan F.; Hudson, Timothy A.; Robson, Richard A New Approach to DCNQI-Based Coordination Polymers via DCNQIH2 Crystal Growth & Design, 2010, 10, 1468 |
4507163 | CIF | C8 H11 La O7 P2 | P -1 | 5.7098; 9.6259; 11.822 104.874; 96.054; 105.347 | 595.02 | Vilela, Sérgio M. F.; Mendes, Ricardo F.; Silva, Patrícia; Fernandes, José A.; Tomé, João P. C.; Paz, Filipe A. Almeida Structural Diversity of Lanthanum‒Organic Frameworks Based on 1,4-Phenylenebis(methylene)diphosphonic Acid Crystal Growth & Design, 2013, 13, 543 |
4508006 | CIF | C5 H8 O4 | C 1 2/c 1 | 12.978; 4.756; 9.7382 90; 97.85; 90 | 595.4 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4501394 | CIF | C20 H24 Cl2 Cu N4 O6 | P -1 | 8.403; 8.825; 8.895 89.555; 67.609; 78.394 | 595.7 | Mukherjee, Gargi; Biradha, Kumar Crystal Engineering Studies with Monocarboxamidoalkanes Having C- or N-Terminal Pyridine and Their Coordination Complexes Crystal Growth & Design, 2011, 11, 5649 |
4510878 | CIF | C22 H24 N4 O10 | P 1 | 7.0988; 7.3613; 12.1428 77.496; 88.25; 74.232 | 595.91 | George, 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 |
4512805 | CIF | C30 H28 O4 | P -1 | 7.4368; 9.1491; 9.7361 65.702; 80.946; 87.395 | 596.1 | Saraswatula, Viswanadha G.; Saha, Binoy K. Modulation of Thermal Expansion by Guests and Polymorphism in a Hydrogen Bonded Host Crystal Growth & Design, 2015, 15, 593 |
4513281 | CIF | As4 O6 | P 1 21/a 1 | 12.9231; 4.4816; 17.2952 90; 143.48; 90 | 596.1 | Guńka, Piotr A.; Dranka, Maciej; Hanfland, Michael; Dziubek, Kamil F.; Katrusiak, Andrzej; Zachara, Janusz Cascade of High-Pressure Transitions of Claudetite II and the First Polar Phase of Arsenic(III) Oxide Crystal Growth & Design, 2015, 15, 3950 |
4503323 | CIF | C5 H3 N2 S2 | P 1 21 1 | 6.1262; 14.4772; 7.2157 90; 111.217; 90 | 596.58 | Alberola, Antonio; Clements, Owen P.; Collis, Rebecca J.; Cubbitt, Louisa; Grant, Craig M.; Less, Robert J.; Oakley, Richard T.; Rawson, Jeremy M.; Reed, Robert W.; Robertson, Craig M. Polymorphism in a π-Stacked 1,3,2-Dithiazolyl Radical: Pyridyl-1,3,2-Dithiazolyl Crystal Growth & Design, 2008, 8, 155 |
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 |
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 |
4501980 | CIF | C28 H12 F4 N4 | C 1 2/c 1 | 7.1005; 13.201; 7.0522 90; 115.11; 90 | 598.6 | Vasylyeva, Vera; Merz, Klaus Fluorobenzonitriles: Influence of the Substitution Pattern on Melting and Crystallization Properties Crystal Growth & Design, 2010, 10, 4250 |
4506362 | CIF | C10 H12 N2 O6 S2 | P 1 21/c 1 | 10.837; 7.6503; 7.2566 90; 95.41; 90 | 598.9 | Deng, Zhao-Peng; Huo, Li-Hua; Zhao, Hui; Gao, Shan A Co-Crystal Strategy to Tune the Supramolecular Patterns and Luminescent Properties: Ten Well-Designed Salts Assembled by Arenedisulfonic Acid with Diverse Diamines Crystal Growth & Design, 2012, 12, 3342 |
4501252 | CIF | C16 H14 F8 O15 Pb2 | P -1 | 7.3534; 8.8387; 10.4471 76.527; 73.958; 68.095 | 598.99 | Seidel, Christiane; Ahlers, Ruth; Ruschewitz, Uwe Coordination Polymers with Tetrafluoroterephthalate as Bridging Ligand Crystal Growth & Design, 2011, 11, 5053 |
4507616 | CIF | C13 H11 N Ni O6 | P -1 | 6.3725; 7.7363; 12.7332 74.359; 83.755; 83.938 | 599 | Hou, Juan-Juan; Zhang, Rong; Qin, Ying-Lian; Zhang, Xian-Ming From (3,6)-Connectedkgd,chiralanhto (3,8)-connectedtfz-dNets in Low Nuclear Metal Cluster-Based Networks with Triangular Pyridinedicarboxylate Ligand Crystal Growth & Design, 2013, 13, 1618 |
4508007 | CIF | C5 H8 O4 | C 1 2/c 1 | 12.915; 4.7781; 9.7968 90; 97.468; 90 | 599.4 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4512806 | CIF | C30 H28 O4 | P -1 | 7.448; 9.1675; 9.7565 65.783; 80.844; 87.403 | 599.66 | Saraswatula, Viswanadha G.; Saha, Binoy K. Modulation of Thermal Expansion by Guests and Polymorphism in a Hydrogen Bonded Host Crystal Growth & Design, 2015, 15, 593 |
4511879 | CIF | C16 H16 | P 1 21/n 1 | 5.7726; 17.0351; 6.6086 90; 112.553; 90 | 600.17 | Harada, Jun; Ogawa, Keiichiro What Molecules Are Likely or Unlikely To Undergo Pedal Motions in Crystals? Crystal Growth & Design, 2014, 14, 5182 |
4512807 | CIF | C30 H28 O4 | P -1 | 7.4471; 9.17; 9.7603 65.866; 80.746; 87.396 | 600.2 | Saraswatula, Viswanadha G.; Saha, Binoy K. Modulation of Thermal Expansion by Guests and Polymorphism in a Hydrogen Bonded Host Crystal Growth & Design, 2015, 15, 593 |
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 |
4506050 | CIF | C5 H6 N2 O S | P 1 21/c 1 | 4.3405; 14.458; 9.5743 90; 90.758; 90 | 600.78 | Jarzembska, Katarzyna N.; Kubsik, Marcin; Kamiński, Radosław; Woźniak, Krzysztof; Dominiak, Paulina M. From a Single Molecule to Molecular Crystal Architectures: Structural and Energetic Studies of Selected Uracil Derivatives Crystal Growth & Design, 2012, 12, 2508 |
4500511 | CIF | C19 H17 Na O19 Zn3 | P 1 | 7.9024; 9.3784; 9.7093 61.65; 71.6; 80.38 | 600.8 | Fu, Ying; Su, Jie; Yang, Sihai; Zou, Zhibo; Li, Guobao; Liao, Fuhui; Xiong, Ming; Lin, Jianhua Syntheses, Structures, and Structural Transformations of Mixed Na(I) and Zn(II) Metal‒Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands Crystal Growth & Design, 2011, 11, 2243 |
4504283 | CIF | C20 H14 Cd N16 S2 | P -1 | 7.954; 8.984; 9.863 71.192; 86.803; 64.858 | 601.2 | Liu, Yuan-Yuan; Huang, Yong-Quan; Shi, Wei; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping Syntheses, Structures, and Characterization of a Series of Novel Zinc(II) and Cadmium(II) Compounds Based on 2,6-Di-(1,2,4-triazole-4-yl)pyridine Crystal Growth & Design, 2007, 7, 1483 |
4509407 | CIF | C30 H22 N6 | P -1 | 7.9311; 7.9821; 10.7052 111.703; 104.192; 93.7 | 601.32 | Hudson, Timothy A.; Robson, Richard A New Class of TCNQ Derivatives Easily Generated from TCNQH2Containing Discrete TCNQ2−Anions and Noncoordinating Cations Crystal Growth & Design, 2009, 9, 1658 |
4505686 | CIF | C28 H12 F4 I2 N2 | P -1 | 4.023; 7.54; 20.239 80.96; 85.29; 84 | 601.6 | Crihfield, April; Hartwell, Joshua; Phelps, Dustin; Walsh, Rosa Bailey; Harris, Jeffery L.; Payne, John F.; Pennington, William T.; Hanks, Timothy W. Crystal Engineering through Halogen Bonding. 2. Complexes of Diacetylene-Linked Heterocycles with Organic Iodides Crystal Growth & Design, 2003, 3, 313 |
4504263 | CIF | C28 H20 N4 O10 | P -1 | 8.307; 8.894; 9.179 110.23; 103.873; 97.109 | 601.7 | Cheney, Miranda L.; McManus, Gregory J.; Perman, Jason A.; Wang, Zhenqiang; Zaworotko, Michael J. The Role of Cocrystals in Solid-State Synthesis: Cocrystal-Controlled Solid-State Synthesis of Imides Crystal Growth & Design, 2007, 7, 616 |
4502116 | CIF | C4 N4 Te | P 21 21 21 | 5.983; 7.781; 12.932 90; 90; 90 | 602 | Cozzolino, Anthony F.; Yang, Qin; Vargas-Baca, Ignacio Engineering Second-Order Nonlinear Optical Activity by Means of a Noncentrosymmetric Distortion of the [Te−N]2Supramolecular Synthon Crystal Growth & Design, 2010, 10, 4959 |
4500980 | CIF | C15 H11 N O4 | P -1 | 5.584; 10.23; 10.962 75.17; 84.53; 86.35 | 602.1 | Orola, Liana; Veidis, Mikelis V.; Mutikainen, Ilpo; Sarcevica, Inese Neutral and Ionic Supramolecular Complexes of Phenanthridine and Some Common Dicarboxylic Acids: Hydrogen Bond and Melting Point Considerations Crystal Growth & Design, 2011, 11, 4009 |
4508386 | CIF | C11 H12 N2 O5 | P 1 21 1 | 8.004; 5.427; 13.896 90; 93.791; 90 | 602.3 | Ivanova, Bojidarka; Spiteller, Michael On the application of the organic barbiturates as NLO materials Crystal Growth and Design, 2010, 10, 2470-2474 |
4509944 | CIF | C20 H14 Br4 N6 O6 | P -1 | 8.4983; 8.7073; 9.9547 92.062; 112.55; 114.459 | 602.4 | Dey, Sanjoy Kumar; Saha, Rajat; Biswas, Susobhan; Layek, Animesh; Middya, Somnath; Steele, Ian M.; Fleck, Michel; Ray, Partha Pratim; Kumar, Sanjay Tetrabromoterepthalic Acid in Designing Co-crystals and Salts: Modification of Optical Properties and Schottky Barrier Effect Crystal Growth & Design, 2014, 14, 207 |
4500101 | CIF | C8 H12 N2 Ni O4 S2 | P 1 21 1 | 5.897; 10.146; 10.077 90; 90.165; 90 | 602.9 | Dong, Lanjun; Chu, Wei; Zhu, Qinlei; Huang, Rudan Three Novel Homochiral Helical Metal−Organic Frameworks Based on Amino Acid Ligand: Syntheses, Crystal Structures, and Properties Crystal Growth & Design, 2011, 11, 93 |
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 |
4513700 | CIF | C30 H36 N2 O2 | P -1 | 5.3489; 6.6509; 17.1429 85.8818; 82.6144; 88.9028 | 603.207 | Zhang, Qian-Chong; Takeda, Takashi; Hoshino, Norihisa; Noro, Shin-ichiro; Nakamura, Takayoshi; Akutagawa, Tomoyuki Liquid Crystalline Phase Induced by Molecular Rotator and Dipole Fluctuation Crystal Growth & Design, 2015, 15, 5705 |
4507701 | CIF | C10 H4 Bi N4 O8 | P -1 | 6.955; 6.9973; 12.8905 81.541; 81.012; 78.708 | 603.22 | Sushrutha, S. R.; Natarajan, Srinivasan Bismuth Carboxylates with Brucite- and Fluorite-Related Structures: Synthesis Structure and Properties Crystal Growth & Design, 2013, 13, 1743 |
4502490 | CIF | C4 H6 N6 O8 S2 Zn2 | P -1 | 5.1572; 7.801; 15.051 88.404; 87.843; 85.791 | 603.27 | Li, Dong-Ping; Zhou, Xin-Hui; Liang, Xiao-Qiang; Li, Cheng-Hui; Chen, Chao; Liu, Jian; You, Xiao-Zeng Novel Structural Diversity of Triazolate-Based Coordination Polymers Generated Solvothermally with Anions Crystal Growth & Design, 2010, 10, 2136 |
4508470 | CIF | C13 H12 N2 O3 | P -1 | 5.0984; 10.4111; 12.2585 107.342; 101.655; 93.337 | 603.4 | Mocilac, Pavle; Gallagher, John F. The First Phenyl-N-pyridinylcarbamate Structures: Structural and Conformational Analysis of Nine Methoxyphenyl-N-pyridinylcarbamates Crystal Growth & Design, 2013, 13, 5295 |
4516483 | CIF | C12 H16 N2 O4 | P 1 21 1 | 11.1237; 6.1915; 8.9145 90; 100.561; 90 | 603.56 | Jeziorna, Agata; Stopczyk, Karolina; Skorupska, Ewa; Luberda-Durnas, Katarzyna; Oszajca, Marcin; Lasocha, Wiesław; Górecki, Marcin; Frelek, Jadwiga; Potrzebowski, Marek J. Cyclic Dipeptides as Building Units of Nano- and Microdevices: Synthesis, Properties, and Structural Studies Crystal Growth & Design, 2015, 15, 5138 |
4502489 | CIF | C4 H6 N8 O7 Zn2 | P -1 | 8.0316; 9.0376; 9.753 77.17; 68.834; 66.673 | 603.62 | Li, Dong-Ping; Zhou, Xin-Hui; Liang, Xiao-Qiang; Li, Cheng-Hui; Chen, Chao; Liu, Jian; You, Xiao-Zeng Novel Structural Diversity of Triazolate-Based Coordination Polymers Generated Solvothermally with Anions Crystal Growth & Design, 2010, 10, 2136 |
4516481 | CIF | C12 H13 N2 O4 | P 1 21 1 | 11.1238; 6.1919; 8.9149 90; 100.563; 90 | 603.63 | Jeziorna, Agata; Stopczyk, Karolina; Skorupska, Ewa; Luberda-Durnas, Katarzyna; Oszajca, Marcin; Lasocha, Wiesław; Górecki, Marcin; Frelek, Jadwiga; Potrzebowski, Marek J. Cyclic Dipeptides as Building Units of Nano- and Microdevices: Synthesis, Properties, and Structural Studies Crystal Growth & Design, 2015, 15, 5138 |
4508300 | CIF | C25 H11 Br F8 I N3 O | P 1 | 4.6568; 11.0639; 12.2258 98.373; 100.443; 97.995 | 603.94 | Aaker Christer B.; Chopade, Prashant D.; Desper, John Establishing a Hierarchy of Halogen Bonding by Engineering Crystals without Disorder Crystal Growth & Design, 2013, 13, 4145 |
4513701 | CIF | C29 H34 N3 O2 | P -1 | 5.3499; 6.6535; 17.1551 85.881; 82.6239; 88.9109 | 603.998 | Zhang, Qian-Chong; Takeda, Takashi; Hoshino, Norihisa; Noro, Shin-ichiro; Nakamura, Takayoshi; Akutagawa, Tomoyuki Liquid Crystalline Phase Induced by Molecular Rotator and Dipole Fluctuation Crystal Growth & Design, 2015, 15, 5705 |
4511843 | CIF | C9 H14 F6 N P | P -1 | 8.8517; 9.1524; 9.2668 63.953; 64.555; 85.076 | 604.15 | Maximo, Guilherme J.; Santos, Ricardo J. B. N.; Brandão, Paula; Esperança, José M. S. S.; Costa, Mariana C.; Meirelles, Antonio J. A.; Freire, Mara G.; Coutinho, João A. P. Generating Ionic Liquids from Ionic Solids: An Investigation of the Melting Behavior of Binary Mixtures of Ionic Liquids Crystal Growth & Design, 2014, 14, 4270 |
4512382 | CIF | C16 H30 Cl4 N4 O2 U | P -1 | 8.9048; 8.9663; 9.0618 73.85; 68.9; 64.912 | 604.55 | Qu, Feng; Zhu, Qian-Qian; Liu, Chun-Li Crystallization in Ionic Liquids: Synthesis, Properties, and Polymorphs of Uranyl Salts Crystal Growth & Design, 2014, 14, 6421 |
4503474 | CIF | C14 H20 Co N18 S2 | P -1 | 6.5628; 9.2726; 11.037 66.93; 83.14; 78.35 | 604.6 | Liu, Pei-Pei; Cheng, Ai-Ling; Yue, Qi; Liu, Na; Sun, Wei-Wei; Gao, En-Qing Cobalt(II) Coordination Networks Dependent upon the Spacer Length of Flexible Bis(tetrazole) Ligands Crystal Growth & Design, 2008, 8, 1668 |
4508215 | CIF | C24 H30 N4 O6 P2 | P -1 | 7.6792; 9.3143; 9.942 105.206; 110.74; 102.028 | 604.93 | Białek, Michał J.; Zaręba, Jan K.; Janczak, Jan; Zoń, Jerzy Chains, Layers, Channels, and More: Supramolecular Chemistry of Potent Diphosphonic Tectons with Tuned Flexibility. The Generation of Pseudopolymorphs, Polymorphs, and Adducts Crystal Growth & Design, 2013, 13, 4039 |
4500357 | CIF | C3 H10 O Sn | P 1 21/c 1 | 10.793; 6.6883; 8.3828 90; 90.13; 90 | 605.1 | Anderson, Kirsty M.; Tallentire, Sarah E.; Probert, Michael R.; Goeta, Andrés E.; Mendis, Budhika G.; Steed, Jonathan W. Trimethyltin Hydroxide: A Crystallographic and HighZ′ Curiosity Crystal Growth & Design, 2011, 11, 820 |
4509512 | CIF | C6 H10 N4 O8 S2 | P -1 | 7.6813; 9.3288; 9.6311 70.297; 88.267; 69.397 | 605.11 | Boldog, Ishtvan; Daran, Jean-Claude; Chernega, Alexander N.; Rusanov, Eduard B.; Krautscheid, Harald; Domasevitch, Konstantin V. Hydrogen Bonding Patterns and Supramolecular Structure of 4,4′-Bipyrazolium Salts Crystal Growth & Design, 2009, 9, 2895 |
4504045 | CIF | C2 H8 N2 O3 W | C 1 2 1 | 11.101; 7.2843; 7.5086 90; 94.49; 90 | 605.3 | Yang, Sihai; Li, Guobao; Tian, Shujian; Liao, Fuhui; Lin, Jianhua Synthesis and Structure of [C2H10N2][B5O8(OH)]: A Nonmetal Pentaborate with Nonlinear Optical Properties Crystal Growth & Design, 2007, 7, 1246-1250 |
4508008 | CIF | C5 H8 O4 | C 1 2/c 1 | 12.9084; 4.8009; 9.8512 90; 97.242; 90 | 605.63 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4510944 | CIF | C7 H6 F2 | P 1 21/n 1 | 5.854; 7.9654; 13.198 90; 100.18; 90 | 605.7 | Merz, Klaus; Evers, Mathies V.; Uhl, Felix; Zubatyuk, Roman I.; Shishkin, Oleg V. Role of CHF2- and CF3-Substituents on Molecular Arrangement in the Solid State: Experimental and Theoretical Crystal Structure Analysis of CH3/CHF2/CF3-Substituted Benzene Crystal Growth & Design, 2014, 14, 3124 |
4505518 | CIF | C12 H17 N S2 | P 1 21 1 | 8.6849; 5.6723; 12.7991 90; 105.937; 90 | 606.29 | Park, Sunhong; Lindoy, Leonard F.; Lee, Shim Sung Assembly of Silver(I) Complexes of Isomeric NS2-Macrocycles Displaying Cyclic Oligomer, Helix, and Zigzag Structures Crystal Growth & Design, 2012, 12, 1320 |
4504523 | CIF | C8 H8 Br2 N2 O S Te | P -1 | 6.9047; 8.4309; 11.932 100.118; 104.354; 109.822 | 606.8 | Cozzolino, Anthony F.; Britten, James F.; Vargas-Baca, Ignacio The Effect of Steric Hindrance on the Association of Telluradiazoles through Te−N Secondary Bonding Interactions Crystal Growth & Design, 2006, 6, 181 |
4500641 | CIF | C11 H18 I N O | P -1 | 7.6216; 7.6754; 11.0946 83.537; 84.005; 70.642 | 606.88 | Kennedy, Alan R.; Morrison, Catriona A.; Briggs, Naomi E. B.; Arbuckle, William Density and Stability Differences Between Enantiopure and Racemic Salts: Construction and Structural Analysis of a Systematic Series of Crystalline Salt Forms of Methylephedrine Crystal Growth & Design, 2011, 11, 1821 |
4511470 | CIF | C12 H11 N3 O4 | P 1 21 1 | 8.175; 6.719; 11.189 90; 98.991; 90 | 607 | Tan, Ting-Feng; Han, Jie; Pang, Mei-Li; Song, Hai-Bin; Ma, Yu-Xin; Meng, Ji-Ben Achiral Benzoic Acid Derivatives as Chiral Cocrystal Building Blocks in Supramolecular Chemistry: Adducts with Organic Amines Crystal Growth & Design, 2006, 6, 1186 |
4503134 | CIF | C8 H11 N O2 | P 1 21/c 1 | 8.254; 9.8542; 7.5245 90; 96.63; 90 | 607.9 | Wood, Peter A.; Haynes, Delia A.; Lennie, Alistair R.; Motherwell, W. D. Samuel; Parsons, Simon; Pidcock, Elna; Warren, John E. The Anisotropic Compression of the Crystal Structure of 3-Aza-bicyclo(3.3.1)nonane-2,4-dione to 7.1 GPa Crystal Growth & Design, 2008, 8, 549 |
4509596 | CIF | C3 H15 N3 O8 P2 | P -1 | 5.4959; 9.048; 12.673 83.611; 82.503; 77.561 | 607.9 | Chen, Shuo-ping; Hu, Le; Hu, Xue-jia; Yuan, Yi-xuan; Pan, Ling-ling; Yuan, Liang-jie (AEDPH3)·(ureaH)·(H2O): A Novel Organic Supramolecular Plaster with Gas Adsorption Performance Crystal Growth & Design, 2009, 9, 3835 |
4501543 | CIF | C12 H16 Ca Co2 N4 O16 | P -4 | 8.898; 8.898; 7.679 90; 90; 90 | 608 | Borel, Cédric; Davies, Kate; Handa, Paul; Hedberg, Gustav; Oliver, Clive L.; Bourne, Susan A.; Håkansson, Mikael; Langer, Vratislav; Öhrström, Lars Family of Isoreticular Chiral Metal−Organic Frameworks Based on Coordination and Hydrogen Bonds in [M[Co(ethylenediamine)(oxalato)2]2] Crystal Growth & Design, 2010, 10, 1971 |
4509831 | CIF | C14 H8 N2 O4 | P 1 c 1 | 13.053; 6.321; 7.45 90; 98.47; 90 | 608 | Perman, Jason A.; Dubois, Kevin; Nouar, Farid; Zoccali, Sandra; Wojtas, Łukasz; Eddaoudi, Mohamed; Larsen, Randy W.; Zaworotko, Michael J. Cocrystal Controlled Solid-State Synthesis of a Thermally Stable Nicotinate Analogue That Sustains an Isostructural Series of Porous Metal−Organic Materials Crystal Growth & Design, 2009, 9, 5021 |
4509059 | CIF | C14 H9 I N2 | P -1 | 4.1333; 11.5489; 13.6092 70.583; 88.69; 83.109 | 608.16 | Ojala, William H.; Lystad, Kendra M.; Deal, Tera L.; Engebretson, Jessica E.; Spude, Jill M.; Balidemaj, Barjeta; Ojala, Charles R. Bridge Orientation as a Selector of Intermolecular Interactions in a Series of Crystalline Isomeric Benzylideneanilines Crystal Growth & Design, 2009, 9, 964 |
4511350 | CIF | C14 H10 F2 N2 O2 | P 1 21/c 1 | 4.7817; 6.9484; 18.366 90; 93.863; 90 | 608.83 | Zhu, Yuan-Yuan; Wu, Jing; Li, Chuang; Zhu, Jiang; Hou, Jun-Li; Li, Chang-Zhi; Jiang, Xi-Kui; Li, Zhan-Ting F···H−N and MeO···H−N Hydrogen-Bonding in the Solid States of Aromatic Amides and Hydrazides: A Comparison Study Crystal Growth & Design, 2007, 7, 1490 |
4511965 | CIF | C4 H9 N3 O2 | P n a 21 | 11.9504; 5.3453; 9.5314 90; 90; 90 | 608.85 | Braun, Doris E.; Orlova, Maria; Griesser, Ulrich J. Creatine: Polymorphs Predicted and Found Crystal Growth & Design, 2014, 14, 4895 |
4512830 | CIF | C3 H Cl3 N2 | A m a 2 | 9.9264; 16.0761; 3.8161 90; 90; 90 | 608.96 | Andrzejewski, Michał; Marciniak, Jędrzej; Rajewski, Kacper W.; Katrusiak, Andrzej Halogen and Hydrogen Bond Architectures in Switchable Chains of Di- and Trihaloimidazoles Crystal Growth & Design, 2015, 15, 1658 |
4511277 | CIF | C8 H5 F | P n a 21 | 7.578; 13.024; 6.171 90; 90; 90 | 609.1 | Ridout, Joe; Price, Louise S.; Howard, Judith A. K.; Probert, Michael R. Polymorphism Arising from Differing Rates of Compression of Liquids Crystal Growth & Design, 2014, 14, 3384 |
4510579 | CIF | C8 H7 N O10 U | P -1 | 7.8201; 8.1694; 10.2669 106.698; 103.2; 90.842 | 609.38 | Cantos, 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 |
4512037 | CIF | C20 H34 N4 O4 S2 | P -1 | 7.8169; 7.8365; 11.4009 73.31; 82.018; 65.685 | 609.46 | Yadav, Priyanka; Dutta, Pradip Kr.; Ballabh, Amar Combinatorial Library Approach to Realize 2-Aminothiazole-Based Two-Component Hydrogelator: A Structure‒Property Correlation Crystal Growth & Design, 2014, 14, 5966 |
4500701 | CIF | C4 H4 Fe O26 P2 U2 | P -1 | 7.0208; 8.2937; 11.0388 80.96; 74.05; 89.85 | 609.79 | Alsobrook, Andrea N.; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E. Incorporation of Mn(II) and Fe(II) into Uranyl Carboxyphosphonates Crystal Growth & Design, 2011, 11, 2358 |
4507706 | CIF | C10 H24 N2 O2 | P 1 21 1 | 7.1428; 8.4149; 10.1973 90; 95.633; 90 | 609.96 | Cherukuvada, Suryanarayan; Nangia, Ashwini Salts and Ionic Liquid of The Antituberculosis DrugS,S-Ethambutol Crystal Growth & Design, 2013, 13, 1752 |
4500164 | CIF | C4 H4 Li2 O6 | C 2 2 21 | 5.58; 9.1055; 12.018 90; 90; 90 | 610.62 | Yeung, Hamish H.-M.; Kosa, Monica; Parrinello, Michele; Forster, Paul M.; Cheetham, Anthony K. Structural Diversity and Energetics in Anhydrous Lithium Tartrates: Experimental and Computational Studies of Novel Chiral Polymorphs and Their Racemic and Meso Analogues Crystal Growth & Design, 2011, 11, 221 |
4505331 | CIF | C5 H9 Ag3 N2 O8 | P -1 | 7.1933; 9.374; 9.9 87.55; 68.912; 78.787 | 610.7 | Yang, Jin-Hua; Zheng, Shao-Liang; Yu, Xiao-Lan; Chen, Xiao-Ming Syntheses, Structures, and Photoluminescent Properties of Three Silver(I) Cluster-Based Coordination Polymers with Heteroaryldicarboxylate Crystal Growth & Design, 2004, 4, 831 |
4502484 | CIF | C24 H18 Ag2 N8 O6 | P -1 | 8.2886; 9.0739; 9.8794 106.184; 96.569; 116.873 | 610.95 | Kundu, Nabanita; Audhya, Anandalok; Abtab, Sk Md Towsif; Ghosh, Sanjib; Tiekink, Edward R. T.; Chaudhury, Muktimoy Anion-Controlled Assembly of Silver(I) Complexes of Multiring Heterocyclic Ligands: A Structural and Photophysical Study Crystal Growth & Design, 2010, 10, 1269 |
4504304 | CIF | C34 H26 | P -1 | 6.6687; 8.0335; 11.706 80.01; 83.27; 83.93 | 611 | Xie, Zengqi; Wang, Huan; Li, Feng; Xie, Weijie; Liu, Linlin; Yang, Bing; Ye, Ling; Ma, Yuguang Crystal Structure of a Highly Luminescent Slice Crystal Grown in the Vapor Phase: A New Polymorph of 2,5-Diphenyl-1,4-distyrylbenzene Crystal Growth & Design, 2007, 7, 2512 |
4505089 | CIF | C11 H19 N O6 | P -1 | 7.6682; 8.4743; 9.5164 91.741; 94.436; 97.239 | 611.13 | Bhogala, Balakrishna R.; Vishweshwar, Peddy; Nangia, Ashwini Equivalence of NH4+, NH2NH3+, and OHNH3+in Directing the Noncentrosymmetric Diamondoid Network of O−H···O-Hydrogen Bonds in Dihydrogen Cyclohexane Tricarboxylate Crystal Growth & Design, 2005, 5, 1271 |
4500509 | CIF | C9 H9 Na O9 Zn | P -1 | 9.6721; 9.6817; 7.7419 99.39; 104.54; 60.72 | 611.4 | Fu, Ying; Su, Jie; Yang, Sihai; Zou, Zhibo; Li, Guobao; Liao, Fuhui; Xiong, Ming; Lin, Jianhua Syntheses, Structures, and Structural Transformations of Mixed Na(I) and Zn(II) Metal‒Organic Frameworks with 1,3,5-Benzenetricarboxylate Ligands Crystal Growth & Design, 2011, 11, 2243 |
4502487 | CIF | C12 H8 Ag N3 O3 S | P -1 | 8.6754; 8.8529; 9.5078 102.345; 114.366; 102.287 | 611.49 | Kundu, Nabanita; Audhya, Anandalok; Abtab, Sk Md Towsif; Ghosh, Sanjib; Tiekink, Edward R. T.; Chaudhury, Muktimoy Anion-Controlled Assembly of Silver(I) Complexes of Multiring Heterocyclic Ligands: A Structural and Photophysical Study Crystal Growth & Design, 2010, 10, 1269 |
4501545 | CIF | C12 H16 Cd Co2 N4 O16 | P -4 | 8.918; 8.918; 7.69 90; 90; 90 | 611.6 | Borel, Cédric; Davies, Kate; Handa, Paul; Hedberg, Gustav; Oliver, Clive L.; Bourne, Susan A.; Håkansson, Mikael; Langer, Vratislav; Öhrström, Lars Family of Isoreticular Chiral Metal−Organic Frameworks Based on Coordination and Hydrogen Bonds in [M[Co(ethylenediamine)(oxalato)2]2] Crystal Growth & Design, 2010, 10, 1971 |
4508214 | CIF | C24 H30 N4 O6 P2 | P -1 | 7.7904; 9.7947; 9.9097 119.461; 99.979; 101.479 | 611.76 | Białek, Michał J.; Zaręba, Jan K.; Janczak, Jan; Zoń, Jerzy Chains, Layers, Channels, and More: Supramolecular Chemistry of Potent Diphosphonic Tectons with Tuned Flexibility. The Generation of Pseudopolymorphs, Polymorphs, and Adducts Crystal Growth & Design, 2013, 13, 4039 |
4513147 | CIF | C30 H18 Cu2 N6 | P -1 | 7.9934; 8.3301; 10.115 109.748; 97.865; 99.444 | 611.76 | Abrahams, Brendan F.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Sutton, Ashley L. New CuI2(TCNQ‒II) and CuI2(F4TCNQ‒II) Coordination Polymers Crystal Growth & Design, 2015, 15, 2437 |
4505845 | CIF | C9 H17 Co N6 | P -1 | 6.594; 7.217; 14.305 77.61; 78.56; 68.17 | 611.9 | Chun, Hyungphil; Bernal, Ivan Crystal Structures of Neutral Cobalt(III) Complexes: Common Hydrogen-Bonding Patterns Observed in Compounds of Different Molecular Structures Crystal Growth & Design, 2001, 1, 143 |
4508009 | CIF | C5 H8 O4 | C 1 2/c 1 | 12.89; 4.8194; 9.917 90; 96.67; 90 | 611.9 | Bhattacharya, Suman; Saraswatula, Viswanadha G.; Saha, Binoy K. Thermal Expansion in Alkane Diacids—Another Property Showing Alternation in an Odd‒Even Series Crystal Growth & Design, 2013, 13, 3651 |
4504068 | CIF | C8 H15 F6 N2 P | P 1 21/m 1 | 8.139; 8.4796; 9.1333 90; 103.697; 90 | 612.41 | Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D. Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses Crystal Growth & Design, 2007, 7, 1106 |
4510937 | CIF | C8 H5 F | P 1 21/c 1 | 7.101; 6.5984; 13.273 90; 99.882; 90 | 612.7 | Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R. Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine Crystal Growth & Design, 2011, 11, 3954 |
4507205 | CIF | C10 H12 Cu N4 O4 | P 1 21/c 1 | 4.863; 13.578; 9.3241 90; 95.563; 90 | 612.77 | Di Nicola, Corrado; Forlin, Enrico; Garau, Federica; Gazzano, Massimo; Lanza, Arianna; Monari, Magda; Nestola, Fabrizio; Pandolfo, Luciano; Pettinari, Claudio; Zorzi, Alberto; Zorzi, Federico Coordination Polymers Based on the Trinuclear Triangular Secondary Building Unit [Cu3(μ3-OH)(μ-pz)3]2+(pz = pyrazolate) and Succinate Anion Crystal Growth & Design, 2013, 13, 126 |
4516482 | CIF | C12 H16 N2 O4 | P 1 21 1 | 11.6892; 6.1603; 8.8732 90; 106.419; 90 | 612.89 | Jeziorna, Agata; Stopczyk, Karolina; Skorupska, Ewa; Luberda-Durnas, Katarzyna; Oszajca, Marcin; Lasocha, Wiesław; Górecki, Marcin; Frelek, Jadwiga; Potrzebowski, Marek J. Cyclic Dipeptides as Building Units of Nano- and Microdevices: Synthesis, Properties, and Structural Studies Crystal Growth & Design, 2015, 15, 5138 |
4516480 | CIF | C12 H13 N2 O4 | P 1 21 1 | 11.6891; 6.1604; 8.8738 90; 106.424; 90 | 612.92 | Jeziorna, Agata; Stopczyk, Karolina; Skorupska, Ewa; Luberda-Durnas, Katarzyna; Oszajca, Marcin; Lasocha, Wiesław; Górecki, Marcin; Frelek, Jadwiga; Potrzebowski, Marek J. Cyclic Dipeptides as Building Units of Nano- and Microdevices: Synthesis, Properties, and Structural Studies Crystal Growth & Design, 2015, 15, 5138 |
4501917 | CIF | C11 H20 N2 O2 | P 1 c 1 | 9.3072; 9.5775; 7.5116 90; 113.735; 90 | 612.95 | Chattopadhyay, Basab; Mukherjee, Alok K.; Narendra, N.; Hemantha, H. P.; Sureshbabu, Vommina V.; Helliwell, Madeliene; Mukherjee, Monika Supramolecular Architectures in 5,5′-Substituted Hydantoins: Crystal Structures and Hirshfeld Surface Analyses Crystal Growth & Design, 2010, 10, 4476 |
4508895 | CIF | C12 H18 O2 S | P 1 21 1 | 9.3954; 5.3324; 12.688 90; 105.36; 90 | 613 | Asensio, Gregorio; Medio-Simon, Mercedes; Alemán, Pedro; de Arellano, Carmen Ramírez The Role of Organic Fluorine in the Supramolecular Assembly of Halogenated β-Hydroxysulphoxides Diastereomers Crystal Growth & Design, 2006, 6, 2769 |
4505682 | CIF | C24 H12 I4 N2 | P -1 | 7.136; 8.9258; 10.2314 95.699; 108.631; 91.813 | 613.09 | Crihfield, April; Hartwell, Joshua; Phelps, Dustin; Walsh, Rosa Bailey; Harris, Jeffery L.; Payne, John F.; Pennington, William T.; Hanks, Timothy W. Crystal Engineering through Halogen Bonding. 2. Complexes of Diacetylene-Linked Heterocycles with Organic Iodides Crystal Growth & Design, 2003, 3, 313 |
4504611 | CIF | C4 H16 Cl4 N2 O2 Pd | P 1 21/c 1 | 8.5472; 7.0726; 10.9161 90; 111.502; 90 | 613.96 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4504226 | CIF | C12 H9 Ag N4 O3 | P -1 | 8.314; 9.078; 9.898 106.08; 96.76; 116.83 | 614.345 | Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands Crystal Growth & Design, 2007, 7, 2481 |
4517109 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.91134; 12.9311; 12.1805 90; 93.2477; 90 | 615.075 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517110 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.91134; 12.9311; 12.1805 90; 93.2477; 90 | 615.075 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4510935 | CIF | C8 H5 F | P n a 21 | 7.584; 13.088; 6.198 90; 90; 90 | 615.2 | Dikundwar, Amol G.; Sathishkumar, Ranganathan; Guru Row, Tayur N.; Desiraju, Gautam R. Structural Variability in the Monofluoroethynylbenzenes Mediated through Interactions Involving “Organic” Fluorine Crystal Growth & Design, 2011, 11, 3954 |
4507462 | CIF | C13 H13 N3 O3 | P 1 21 1 | 25.8154; 3.888; 6.1323 90; 88.416; 90 | 615.27 | Sarcevica, Inese; Orola, Liana; Veidis, Mikelis V.; Podjava, Anton; Belyakov, Sergey Crystal and Molecular Structure and Stability of Isoniazid Cocrystals with Selected Carboxylic Acids Crystal Growth & Design, 2013, 13, 1082 |
4506728 | CIF | C5 H5 N O3 S | P 1 21/n 1 | 5.4285; 15.583; 7.6802 90; 108.61; 90 | 615.7 | Akiri, Kalyanachakravarthi; Cherukuvada, Suryanarayan; Rana, Soumendra; Nangia, Ashwini Crystal Structures of Pyridine Sulfonamides and Sulfonic Acids Crystal Growth & Design, 2012, 12, 4567 |
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 |
4511878 | CIF | C16 H16 | P 1 21/n 1 | 5.8389; 17.2035; 6.6533 90; 112.747; 90 | 616.34 | Harada, Jun; Ogawa, Keiichiro What Molecules Are Likely or Unlikely To Undergo Pedal Motions in Crystals? Crystal Growth & Design, 2014, 14, 5182 |
4505086 | CIF | K Lu O8 W2 | C 1 2/c 1 | 10.5915; 10.2446; 7.5003 90; 130.732; 90 | 616.69 | Wang, Kunpeng; Zhang, Jianxiu; Wang, Jiyang; Yu, Wentao; Zhang, Huaijin; Wang, Zhengping; Wang, Xuping; Ba, Mingfang Predicted and Real Habits of Flux Grown Potassium Lutetium Tungstate Single Crystals Crystal Growth & Design, 2005, 5, 1555 |
4507234 | CIF | C7 H6 N2 | P n a 21 | 13.098; 6.765; 6.963 90; 90; 90 | 617 | Zieliński, Witold; Katrusiak, Andrzej Hydrogen Bonds NH···N in Compressed Benzimidazole Polymorphs Crystal Growth & Design, 2013, 13, 696 |
4505228 | CIF | C26 H28 N4 O6 | P -1 | 5.1373; 5.1989; 23.223 86.042; 88.088; 86.449 | 617.32 | Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W. A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design Crystal Growth & Design, 2005, 5, 2313 |
4501326 | CIF | C11 H12 N4 O6 | P -1 | 3.6888; 11.9356; 14.3954 77.356; 87.328; 87.862 | 617.52 | Das, Babulal; Baruah, Jubaraj B. Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids Crystal Growth & Design, 2011, 11, 5522 |
4508166 | CIF | C12 H10 N2 O4 S | P -1 | 8.0179; 8.569; 9.992 86.046; 67.054; 77.792 | 617.8 | Perlovich, German L.; Ryzhakov, Alex M.; Tkachev, Valery V.; Hansen, Lars Kr.; Raevsky, Oleg A. Sulfonamide Molecular Crystals: Structure, Sublimation Thermodynamic Characteristics, Molecular Packing, Hydrogen Bonds Networks Crystal Growth & Design, 2013, 13, 4002 |
4517121 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.91748; 12.95332; 12.19925 90; 93.2528; 90 | 618.046 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517122 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.91748; 12.95332; 12.19925 90; 93.2528; 90 | 618.046 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4511964 | CIF | C4 H9 N3 O2 | P 1 21/n 1 | 5.4857; 11.4417; 9.9624 90; 98.663; 90 | 618.16 | Braun, Doris E.; Orlova, Maria; Griesser, Ulrich J. Creatine: Polymorphs Predicted and Found Crystal Growth & Design, 2014, 14, 4895 |
4519448 | CIF HKL | C12 H14 Cl2 N2 | P n n m | 13.7562; 6.327; 7.105 90; 90; 90 | 618.39 | Abdel Rahman Al Ahmad; Thierry Maris; Christian Pellerin; James D. Wuest Adding a Pinch of Salt: Using Ionic Mixed-Crystal Seeds to Search for New Solid Forms Crystal Growth & Design, 2023, 23, 7472-7481 |
4508893 | CIF | C10 H11 Cl F2 O2 S | P 1 21 1 | 9.1588; 5.7511; 12.097 90; 103.858; 90 | 618.6 | Asensio, Gregorio; Medio-Simon, Mercedes; Alemán, Pedro; de Arellano, Carmen Ramírez The Role of Organic Fluorine in the Supramolecular Assembly of Halogenated β-Hydroxysulphoxides Diastereomers Crystal Growth & Design, 2006, 6, 2769 |
4517118 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.91837; 12.95759; 12.20622 90; 93.2678; 90 | 618.734 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517119 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.91837; 12.95759; 12.20622 90; 93.2678; 90 | 618.734 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517112 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9204; 12.9598; 12.2004 90; 93.26; 90 | 618.87 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517113 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9204; 12.9598; 12.2004 90; 93.26; 90 | 618.87 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4513224 | CIF | Ge6 La9.68 O26.51 | P 1 | 9.8949; 9.9056; 7.2865 89.46; 89.944; 60.09 | 619.03 | Fukuda, Koichiro; Asaka, Toru; Hara, Shinji; Berghout, Abid; Béchade, Emilie; Masson, Olivier; Jouin, Jenny; Thomas, Philippe Crystal Structure and Oxide-Ion Conductivity of Highly Grain-Aligned Polycrystalline Lanthanum Germanate Oxyapatite Grown by Reactive Diffusion between Solid La2GeO5and Gases [GeO + 1/2O2] Crystal Growth & Design, 2015, 15, 3435 |
4510099 | CIF | C14 H12 N2 O3 | P -1 | 7.4624; 7.7677; 10.981 91.289; 95.146; 102.19 | 619.1 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid‒Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
4501322 | CIF | C13 H11 N3 O5 | P -1 | 8.0151; 8.2236; 10.1892 97.859; 111.1; 90.847 | 619.2 | Das, Babulal; Baruah, Jubaraj B. Supramolecular Synthons and Hydrates in Stabilization of Multicomponent Crystals of Nicotinamide and Isonicotinamide with N-Containing Aromatic Dicarboxylic Acids Crystal Growth & Design, 2011, 11, 5522 |
4517103 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9228; 12.9611; 12.1996 90; 93.242; 90 | 619.28 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517104 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9228; 12.9611; 12.1996 90; 93.242; 90 | 619.28 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4513146 | CIF | C26 H24 Cu2 N6 O | P -1 | 7.6219; 9.3173; 10.5299 65.05; 85.345; 66.686 | 619.33 | Abrahams, Brendan F.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Sutton, Ashley L. New CuI2(TCNQ‒II) and CuI2(F4TCNQ‒II) Coordination Polymers Crystal Growth & Design, 2015, 15, 2437 |
4517115 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.92123; 12.96261; 12.20574 90; 93.2666; 90 | 619.402 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517116 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.92123; 12.96261; 12.20574 90; 93.2666; 90 | 619.402 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517106 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9232; 12.961; 12.2008 90; 93.232; 90 | 619.41 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517107 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9232; 12.961; 12.2008 90; 93.232; 90 | 619.41 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4519471 | CIF HKL | C12 H14 Br Cl N2 | P 1 21/c 1 | 5.8291; 8.1043; 13.1926 90; 96.133; 90 | 619.66 | Abdel Rahman Al Ahmad; Thierry Maris; Christian Pellerin; James D. Wuest Adding a Pinch of Salt: Using Ionic Mixed-Crystal Seeds to Search for New Solid Forms Crystal Growth & Design, 2023, 23, 7472-7481 |
4507233 | CIF | C7 H6 N2 | P n a 21 | 13.189; 6.7596; 6.9528 90; 90; 90 | 619.9 | Zieliński, Witold; Katrusiak, Andrzej Hydrogen Bonds NH···N in Compressed Benzimidazole Polymorphs Crystal Growth & Design, 2013, 13, 696 |
4512707 | CIF | C36 H12 F4 N4 | P -1 | 7.0039; 8.6312; 11.3183 109.504; 104.794; 90.131 | 620.69 | Yoshida, Yukihiro; Kumagai, Yoshihide; Mizuno, Motohiro; Saito, Gunzi Structure‒Property Relationship of Supramolecular Rotators of Coronene in Charge-Transfer Solids Crystal Growth & Design, 2015, 15, 1389 |
4505810 | CIF | C10 H8 Cl2 N2 O6 | P 1 21/c 1 | 9.8283; 6.1935; 10.6465 90; 106.616; 90 | 621.01 | Luo, Tzy-Jiun M.; Palmore, G. Tayhas R. Engineering Crystalline Architecture with Supramolecular Tapes: Studies on Secondary Donor−Acceptor Interactions in Cocrystals of the Cyclic Dipeptide of Glycine Crystal Growth & Design, 2002, 2, 337 |
4504233 | CIF | C24 H22 N8 O8 Zn | P -1 | 7.426; 8.957; 9.773 97.17; 105.17; 90.86 | 621.718 | Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands Crystal Growth & Design, 2007, 7, 2481 |
4504591 | CIF | C2 H6 Cl N5 | P 21 21 21 | 5.6109; 6.778; 16.3497 90; 90; 90 | 621.79 | Laus, G.; Kahlenberg, V.; Többens, D. M.; Jetti, R. K. R.; Griesser, U. J.; Schütz, J.; Kristeva, E.; Wurst, K.; Schottenberger, H. Lattice Architecture and Hydrogen-Bonding Networks ofN-Aminoazolium andN,N‘-Diaminoazolium Chlorides Crystal Growth & Design, 2006, 6, 404 |
4517097 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9241; 12.9719; 12.2347 90; 93.228; 90 | 621.8 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517098 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9241; 12.9719; 12.2347 90; 93.228; 90 | 621.8 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517100 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9264; 12.9747; 12.2334 90; 93.232; 90 | 622.23 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4517101 | CIF | C14 H10 Cl N O2 | P 1 21 1 (a,b,c-1/4) | 3.9264; 12.9747; 12.2334 90; 93.232; 90 | 622.23 | Behrnd, Norwid-Rasmus; Labat, Gaël; Venugopalan, Paloth; Hulliger, Jürg; Bürgi, Hans-Beat Orientational Disorder of (trans)-4-Chloro-4′-nitrostilbene: A Detailed Analysis by Single Crystal X-ray Diffraction Crystal Growth & Design, 2010, 10, 52 |
4504067 | CIF | C8 H15 F6 N2 P | P 1 21/m 1 | 8.9541; 8.0375; 9.6548 90; 116.416; 90 | 622.29 | Reichert, W. Matthew; Holbrey, John D.; Swatloski, Richard P.; Gutowski, Keith E.; Visser, Ann E.; Nieuwenhuyzen, Mark; Seddon, Kenneth R.; Rogers, Robin D. Solid-State Analysis of Low-Melting 1,3-Dialkylimidazolium Hexafluorophosphate Salts (Ionic Liquids) by Combined X-ray Crystallographic and Computational Analyses Crystal Growth & Design, 2007, 7, 1106 |
4512180 | CIF | C6 H6 B F O2 | P 1 21/c 1 | 5.10172; 5.5566; 22.0587 90; 94.731; 90 | 623.19 | Madura, Izabela D.; Czerwińska, Karolina; Sołdańska, Dominika Hydrogen-Bonded Dimeric Synthon of Fluoro-Substituted Phenylboronic Acids versus Supramolecular Organization in Crystals Crystal Growth & Design, 2014, 14, 5912 |
4502554 | CIF | C8 H8 Cu2 F6 N4 Nb | I m m m | 6.6144; 7.0328; 13.3998 90; 90; 90 | 623.33 | Lin, Haisheng; Maggard, Paul A. Microporosity, Optical Bandgap Sizes, and Photocatalytic Activity of M(I)-Nb(V) (M = Cu, Ag) Oxyfluoride Hybrids Crystal Growth & Design, 2010, 10, 1323 |
4506747 | CIF | C14 H10 N4 Ni O4 | P b a m | 5.3699; 10.667; 10.8909 90; 90; 90 | 623.84 | Tao, Tao; Lei, Yan-Hua; Peng, Yu-Xin; Wang, Ying; Huang, Wei; Chen, Zhao-Xu; You, Xiao-Zeng The First Observation of One-Dimensional Naphthalenediimidato-Based Transition-Metal Coordination Polymers: Syntheses, Crystal Structures and Properties Crystal Growth & Design, 2012, 12, 4580 |
4513252 | CIF | C22 H18 F4 I2 N2 S2 | P -1 | 8.1916; 8.6229; 9.6939 97.908; 93.295; 112.073 | 624.05 | Eccles, Kevin S.; Morrison, Robin E.; Sinha, Abhijeet S.; Maguire, Anita R.; Lawrence, Simon E. Investigating C═S···I Halogen Bonding for Cocrystallization with Primary Thioamides Crystal Growth & Design, 2015, 15, 3442 |
4503515 | CIF | C18 H34 N4 O10 U | P -1 | 7.001; 9.841; 10.152 109.64; 102.15; 98.93 | 624.3 | Takao, Koichiro; Noda, Kyoko; Morita, Yasuji; Nishimura, Kenji; Ikeda, Yasuhisa Molecular and Crystal Structures of Uranyl Nitrate Complexes withN-Alkylated 2-Pyrrolidone Derivatives: Design and Optimization of Promising Precipitant for Uranyl Ion Crystal Growth & Design, 2008, 8, 2364 |
4503547 | CIF | C21 H13 N3 O17 Th | P 1 | 7.9925; 9.3928; 9.4723 69.789; 84.958; 69.425 | 624.3 | Frisch, Mark; Cahill, Christopher L. Thorium(IV) Coordination Polymers in the Pyridine and Pyrazinedicarboxylic Acid Systems Crystal Growth & Design, 2008, 8, 2921 |
4513150 | CIF | C26 H18 Cu2 F4 N6 | P -1 | 7.6593; 7.6693; 11.3462 100.363; 101.345; 101.104 | 624.59 | Abrahams, Brendan F.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Sutton, Ashley L. New CuI2(TCNQ‒II) and CuI2(F4TCNQ‒II) Coordination Polymers Crystal Growth & Design, 2015, 15, 2437 |
4506846 | CIF | C4 H5 N3 O5 | P 1 21/c 1 | 5.0642; 21.9255; 6.1176 90; 113.108; 90 | 624.77 | Okoth, Maurice O.; Vrcelj, Ranko M.; Pitak, Mateusz B.; Sheen, David B.; Sherwood, John N. Polymorphism and Hydrated States in 5-Nitrouracil Crystallized from Aqueous Solution Crystal Growth & Design, 2012, 12, 5002 |
4503133 | CIF | C8 H11 N O2 | P 1 21/c 1 | 8.367; 9.9317; 7.5667 90; 96.49; 90 | 624.8 | Wood, Peter A.; Haynes, Delia A.; Lennie, Alistair R.; Motherwell, W. D. Samuel; Parsons, Simon; Pidcock, Elna; Warren, John E. The Anisotropic Compression of the Crystal Structure of 3-Aza-bicyclo(3.3.1)nonane-2,4-dione to 7.1 GPa Crystal Growth & Design, 2008, 8, 549 |
4500670 | CIF | C22 H20 Br2 N4 O6 S2 | P -1 | 8.181; 8.421; 10.25 98.774; 95.521; 114.52 | 624.9 | Goud, N. Rajesh; Babu, N. Jagadeesh; Nangia, Ashwini Sulfonamide−Pyridine-N-oxide Cocrystals Crystal Growth & Design, 2011, 11, 1930 |
4500532 | CIF | C8 H10 Ca4 Na2 O27 P4 | P -1 | 6.64; 8.7164; 11.5047 76.174; 89.574; 75.524 | 625.07 | Colodrero, Rosario M. P.; Cabeza, Aurelio; Olivera-Pastor, Pascual; Papadaki, Maria; Rius, Jordi; Choquesillo-Lazarte, Duane; García-Ruiz, Juan M.; Demadis, Konstantinos D.; Aranda, Miguel A. G. Common Structural Features in Calcium Hydroxyphosphonoacetates. A High-Throughput Screening Crystal Growth & Design, 2011, 11, 1713 |
4508861 | CIF | Ag2 Cl6 Re | R -3 :H | 6.5733; 6.5733; 16.731 90; 90; 120 | 626.07 | Martínez-Lillo, José; Armentano, Donatella; De Munno, Giovanni; Lloret, Francesc; Julve, Miguel; Faus, Juan A Two-Dimensional ReIVAgICompound: X-ray Structure and Magnetic Properties Crystal Growth & Design, 2006, 6, 2204 |
4508048 | CIF | C7 H6 O3 | P n a 21 | 20.085; 3.7591; 8.2934 90; 90; 90 | 626.16 | Clevers, Simon; Simon, Florent; Sanselme, Morgane; Dupray, Valerie; Coquerel, Gerard Monotropic Transition Mechanism ofm-Hydroxybenzoic Acid Investigated by Temperature-Resolved Second Harmonic Generation Crystal Growth & Design, 2013, 13, 3697 |
4500804 | CIF | C6 H11 Cl4 Fe N2 | P 1 21 1 | 6.1337; 14.362; 7.1111 90; 91.33; 90 | 626.3 | Bäcker, Tobias; Breunig, Oliver; Valldor, Martin; Merz, Klaus; Vasylyeva, Vera; Mudring, Anja-Verena In-Situ Crystal Growth and Properties of the Magnetic Ionic Liquid [C2mim][FeCl4] Crystal Growth & Design, 2011, 11, 2564 |
4510178 | CIF | C13 H11 N Ni O6 | P -1 | 7.067; 9.5235; 10.4625 111.73; 101.486; 96.874 | 626.38 | Liu, Bo; Wei, Lei; Li, Nan-nan; Wu, Wei-Ping; Miao, Hui; Wang, Yao-Yu; Shi, Qi-Zhen Solvent/Temperature and Dipyridyl Ligands Induced Diverse Coordination Polymers Based on 3-(2′,5′-Dicarboxylphenyl)pyridine Crystal Growth & Design, 2014, 14, 1110 |
4507644 | CIF | C4 H10 N2 S | P 1 21/n 1 | 4.9388; 11.653; 11.0955 90; 101.202; 90 | 626.4 | Näther, Christian; Jess, Inke; Jones, Peter G.; Taouss, Christina; Teschmit, Nicole Structural, Thermodynamic, and Kinetic Aspects of the Polymorphism of Trimethylthiourea: The Influence of Kinetics on the Transformations between Polymorphs Crystal Growth & Design, 2013, 13, 1676 |
4502115 | CIF | C10 H16 Ag N3 O3 P | P -1 | 6.9593; 9.8142; 10.2972 95.358; 107.925; 106.985 | 626.86 | Lis, Agnieszka; Guedes da Silva, M. Fátima C.; Kirillov, Alexander M.; Smoleński, Piotr; Pombeiro, Armando J. L. Design of Silver(I)−PTA Coordination Polymers through Controlled N,P-Coordination of 1,3,5-Triaza-7-phosphaadamantane (PTA) with Arylcarboxylates Crystal Growth & Design, 2010, 10, 5244 |
4513149 | CIF | C26 H17 Cu2 F4 N7 | P -1 | 7.5063; 9.2925; 10.7697 65.132; 84.915; 67.579 | 627.73 | Abrahams, Brendan F.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Sutton, Ashley L. New CuI2(TCNQ‒II) and CuI2(F4TCNQ‒II) Coordination Polymers Crystal Growth & Design, 2015, 15, 2437 |
4506209 | CIF | C13 H10 Co N O6 | P -1 | 7.2133; 10.076; 10.213 113.83; 99.51; 104.3 | 627.9 | Liu, Yanyan; Li, Huijun; Han, Yi; Lv, Xiaofeng; Hou, Hongwei; Fan, Yaoting Template-Assisted Synthesis of Co,Mn-MOFs with Magnetic Properties Based on Pyridinedicarboxylic Acid Crystal Growth & Design, 2012, 12, 3505 |
4503513 | CIF | C18 H34 N4 O10 U | P -1 | 7.272; 8.988; 10.467 105.6; 102.702; 98.12 | 628 | Takao, Koichiro; Noda, Kyoko; Morita, Yasuji; Nishimura, Kenji; Ikeda, Yasuhisa Molecular and Crystal Structures of Uranyl Nitrate Complexes withN-Alkylated 2-Pyrrolidone Derivatives: Design and Optimization of Promising Precipitant for Uranyl Ion Crystal Growth & Design, 2008, 8, 2364 |
4511998 | CIF | C16 H20 Br6 N6 O2 Re | P -1 | 8.1914; 8.8446; 9.7565 69.846; 71.273; 82.038 | 628.13 | Martínez-Lillo, José; Kong, John; Julve, Miguel; Brechin, Euan K. Self-Assembly of the Hexabromorhenate(IV) Anion with Protonated Benzotriazoles: X-ray Structure and Magnetic Properties Crystal Growth & Design, 2014, 14, 5985 |
4505234 | CIF | C34 H26 | P -1 | 7.5099; 9.1405; 10.2177 72.744; 72.976; 74.679 | 628.27 | Xie, Zengqi; Liu, Linlin; Yang, Bing; Yang, Guangdi; Ye, Ling; Li, Min; Ma, Yuguang Polymorphism of 2,5-Diphenyl-1,4-distyrylbenzene with Two cis Double Bonds: The Essential Role of Aromatic CH/π Hydrogen Bonds Crystal Growth & Design, 2005, 5, 1959 |
4504856 | CIF | C H16 N O13 S Zn4 | P -3 | 8.2881; 8.2881; 10.566 90; 90; 120 | 628.6 | Rujiwatra, Apinpus; Mander, Gavin J.; Kepert, Cameron J.; Rosseinsky, Matthew J. Synthesis and Characterization of Subcell−Supercell Related Ethylenediamine-Pillared Zinc Hydroxysulfates Crystal Growth & Design, 2005, 5, 183 |
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 |
4508390 | CIF | C10 H11 N3 O6 | P -1 | 6.743; 9.36; 10.654 85.739; 71.753; 80.117 | 629 | Ivanova, Bojidarka; Spiteller, Michael On the application of the organic barbiturates as NLO materials Crystal Growth and Design, 2010, 10, 2470-2474 |
4508947 | CIF | C8 H18 Cl2 N2 O2 | P 1 21/c 1 | 6.68; 10.633; 9.205 90; 105.819; 90 | 629.1 | Lu, Jianjiang; Kochi, Jay K. Charge-Modulated Associates of Anionic Donors with Cationic π-Acceptors: Crystal Structures of Ternary Synthons Leading to Molecular Wires Crystal Growth & Design, 2009, 9, 291 |
4505229 | CIF | C26 H28 N4 O6 | P -1 | 5.1801; 5.2099; 23.409 88.219; 85.486; 88.992 | 629.4 | Curtis, Sean M.; Le, Nam; Fowler, Frank W.; Lauher, Joseph W. A Rational Approach to the Preparation ofPolydipyridyldiacetylenes: An Exercise in Crystal Design Crystal Growth & Design, 2005, 5, 2313 |
4512028 | CIF | C18 H32 N4 O10 S2 | P -1 | 4.95459; 7.5581; 17.8016 92.253; 90.649; 109.029 | 629.5 | Yadav, Priyanka; Dutta, Pradip Kr.; Ballabh, Amar Combinatorial Library Approach to Realize 2-Aminothiazole-Based Two-Component Hydrogelator: A Structure‒Property Correlation Crystal Growth & Design, 2014, 14, 5966 |
4505760 | CIF | C18 H16 Br2 F16 N2 | P -1 | 5.5807; 6.1359; 18.425 92.881; 92.386; 90.412 | 629.55 | Liantonio, Rosalba; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe; Stevenazzi, Andrea Perfluorocarbon−Hydrocarbon Self-Assembly: First Crystalline Halogen-Bonded Complex Involving Bromoperfluoroalkanes Crystal Growth & Design, 2003, 3, 799 |
4512182 | CIF | C6 H5 B F2 O2 | P 1 21/n 1 | 5.02719; 5.39423; 23.2334 90; 91.897; 90 | 629.69 | Madura, Izabela D.; Czerwińska, Karolina; Sołdańska, Dominika Hydrogen-Bonded Dimeric Synthon of Fluoro-Substituted Phenylboronic Acids versus Supramolecular Organization in Crystals Crystal Growth & Design, 2014, 14, 5912 |
4508163 | CIF | C5 H5 F N3 O3 | P 1 21/c 1 | 5.261; 15.197; 7.884 90; 92.206; 90 | 629.87 | da Silva, Cecília C. P.; de Oliveira, Rebeka; Tenorio, Juan C.; Honorato, Sara B.; Ayala, Alejandro P.; Ellena, Javier The Continuum in 5-Fluorocytosine. Toward Salt Formation Crystal Growth & Design, 2013, 13, 4315 |
4504166 | CIF | C11 H12 Er O8 | P -1 | 6.7577; 10.003; 10.49 92.79; 107.95; 108.78 | 630 | Hu, De-Xin; Luo, Feng; Che, Yun-Xia; Zheng, Ji-Min Construction of Lanthanide Metal−Organic Frameworks by Flexible Aliphatic Dicarboxylate Ligands Plus a Rigidm-Phthalic Acid Ligand Crystal Growth & Design, 2007, 7, 1733 |
4500395 | CIF | C14 H8 Br2 O2 | P 21 21 2 | 6.0063; 26.006; 4.0378 90; 90; 90 | 630.7 | Felsmann, Marika; Eissmann, Frank; Schwarzer, Anke; Weber, Edwin Competitive Interactions in the Crystal Structures of Benzils Effected by Different Halogen Substitution Crystal Growth & Design, 2011, 11, 982 |
4502229 | CIF | C3.25 Cd0.13 Li0.13 N0 O | P -4 m 2 | 9.824; 9.824; 6.536 90; 90; 90 | 630.8 | Lin, Jian-Di; Long, Xi-Fa; Lin, Ping; Du, Shao-Wu A Series of Cation-Templated, Polycarboxylate-Based Cd(II) or Cd(II)/Li(I) Frameworks with Second-Order Nonlinear Optical and Ferroelectric Properties Crystal Growth & Design, 2010, 10, 146 |
4511758 | CIF | As K O3 | P b c n | 11.3246; 11.4255; 4.8816 90; 90; 90 | 631.63 | Stöger, Berthold; Dušek, Michal Complex Polymorphism and Polytypism of Potassium Metaarsenate, KAsO3 Crystal Growth & Design, 2014, 14, 4640 |
4507232 | CIF | C7 H6 N2 | P n a 21 | 13.402; 6.798; 6.9428 90; 90; 90 | 632.5 | Zieliński, Witold; Katrusiak, Andrzej Hydrogen Bonds NH···N in Compressed Benzimidazole Polymorphs Crystal Growth & Design, 2013, 13, 696 |
4508138 | CIF | C13 H12 N2 O5 | P -1 | 5.8411; 8.1695; 13.4181 96.617; 91.353; 94.753 | 633.49 | Lemmerer, Andreas; Adsmond, Daniel A.; Esterhuysen, Catharine; Bernstein, Joel Polymorphic Co-crystals from Polymorphic Co-crystal Formers: Competition between Carboxylic Acid...Pyridine and Phenol...Pyridine Hydrogen Bonds Crystal Growth & Design, 2013, 13, 3935 |
4500469 | CIF | C6 H6 N O3.5 | P 21 21 2 | 7.227; 23.701; 3.6999 90; 90; 90 | 633.7 | Matias, Elisa P.; Bernardes, Carlos E. S.; Piedade, M. Fátima M.; Minas da Piedade, Manuel E. A Robust yet Metastable New Hemihydrate of 4-Hydroxynicotinic Acid Crystal Growth & Design, 2011, 11, 2803 |
4509513 | CIF | C6 H12 N4 O8 P2 | P 1 21/c 1 | 4.9012; 17.3651; 7.7703 90; 106.61; 90 | 633.7 | Boldog, Ishtvan; Daran, Jean-Claude; Chernega, Alexander N.; Rusanov, Eduard B.; Krautscheid, Harald; Domasevitch, Konstantin V. Hydrogen Bonding Patterns and Supramolecular Structure of 4,4′-Bipyrazolium Salts Crystal Growth & Design, 2009, 9, 2895 |
4504594 | CIF | C10 H10 Cl4 N2 Pt | I 1 2/m 1 | 6.6548; 11.695; 8.146 90; 91.32; 90 | 633.8 | Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks Crystal Growth & Design, 2006, 6, 411 |
4511511 | CIF | C8 H16 Cd3 Cl6 N16 | P -1 | 9.089; 9.179; 9.24 70.89; 71.71; 62.637 | 634.5 | Zhai, Quan-Guo; Wu, Xiao-Yuan; Chen, Shu-Mei; Lu, Can-Zhong; Yang, Wen-Bin Construction of Cd/Zn(II)-1,2,4-Triazolate Coordination Complexes via Changing Substituents and Anions Crystal Growth & Design, 2006, 6, 2126 |
4519452 | CIF HKL | C12 H14 Br2 N2 | P 1 21/c 1 | 5.9183; 8.0344; 13.4237 90; 96.191; 90 | 634.57 | Abdel Rahman Al Ahmad; Thierry Maris; Christian Pellerin; James D. Wuest Adding a Pinch of Salt: Using Ionic Mixed-Crystal Seeds to Search for New Solid Forms Crystal Growth & Design, 2023, 23, 7472-7481 |
4512381 | CIF | C16 H30 Cl4 N4 O2 U | P -1 | 8.8731; 8.9844; 9.2813 73.82; 66.506; 71.928 | 634.81 | Qu, Feng; Zhu, Qian-Qian; Liu, Chun-Li Crystallization in Ionic Liquids: Synthesis, Properties, and Polymorphs of Uranyl Salts Crystal Growth & Design, 2014, 14, 6421 |
4511527 | CIF | C12 H13 Cl Cu N2 O3 | P 1 21/m 1 | 9.5269; 6.4027; 10.5813 90; 99.913; 90 | 635.8 | Das, Sunirban; Maloor, Simi Alathady; Pal, Satyanarayan; Pal, Samudranil Solvated Square-Planar Ternary Copper(II) Complexes: Solvent-Dependent Zipper and Columnar Structures Crystal Growth & Design, 2006, 6, 2103 |
4513488 | CIF | C10 H11 N O7 Zn | P 1 21 1 | 6.4078; 10.1634; 10.1735 90; 106.246; 90 | 636.09 | Karmakar, Anirban; Rúbio, Guilherme M. D. M.; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L. Solvent-Dependent Structural Variation of Zinc(II) Coordination Polymers and Their Catalytic Activity in the Knoevenagel Condensation Reaction Crystal Growth & Design, 2015, 15, 4185 |
4507560 | CIF | C7 H7 F | P 1 21/n 1 | 7.452; 5.987; 14.693 90; 104; 90 | 636.1 | Ridout, Joe; Probert, Michael R. High-Pressure and Low-Temperature Polymorphism in C‒H···F‒C Hydrogen Bonded Monofluorotoluenes Crystal Growth & Design, 2013, 13, 1943 |
4511495 | CIF | C10 H8 Br2 Cl2 Cu N2 | P 1 21/c 1 | 3.8178; 13.831; 12.05 90; 91.53; 90 | 636.1 | 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 |
4513088 | CIF | C4 H9.82 N1.82 O4.18 | P 21 21 21 | 9.779; 11.699; 5.5675 90; 90; 90 | 636.9 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513089 | CIF | C8 H19.66 N3.66 O8.34 | P 1 21 1 | 5.5675; 9.779; 11.699 90; 90.234; 90 | 636.9 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513090 | CIF | C8 H19.63 N3.63 O8.37 | P 1 21 1 | 5.5675; 11.699; 9.779 90; 90.215; 90 | 636.9 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513091 | CIF | C8 H19.64 N3.64 O8.36 | P 1 21 1 | 9.779; 5.5675; 11.699 90; 90.078; 90 | 636.9 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513092 | CIF | C16 H39.27 N7.27 O16.73 | P 1 | 5.5675; 9.779; 11.699 90.078; 90.234; 90.215 | 636.9 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4507573 | CIF | C7 H7 N O3 | P 1 21/n 1 | 3.7161; 7.3629; 23.307 90; 91.889; 90 | 637.36 | Cherukuvada, Suryanarayan; Bolla, Geetha; Sikligar, Kanishka; Nangia, Ashwini 4-Aminosalicylic Acid Adducts Crystal Growth & Design, 2013, 13, 1551 |
4519470 | CIF HKL | C12 H14 Br1.85 Cl0.15 N2 | P 1 21/c 1 | 5.9125; 8.0749; 13.4343 90; 96.173; 90 | 637.67 | Abdel Rahman Al Ahmad; Thierry Maris; Christian Pellerin; James D. Wuest Adding a Pinch of Salt: Using Ionic Mixed-Crystal Seeds to Search for New Solid Forms Crystal Growth & Design, 2023, 23, 7472-7481 |
4513084 | CIF | C8 H19.65 N3.65 O8.35 | P 1 21 1 | 5.5668; 11.706; 9.7862 90; 90.323; 90 | 637.71 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513087 | CIF | C4 H9.83 N1.83 O4.17 | P 1 | 5.5668; 9.7862; 11.706 90.048; 90.12; 90.323 | 637.71 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513083 | CIF | C4 H9.83 N1.83 O4.17 | P 21 21 21 | 5.5668; 9.7862; 11.706 90; 90; 90 | 637.72 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513085 | CIF | C8 H19.63 N3.63 O8.37 | P 1 21 1 | 5.5668; 9.7862; 11.706 90; 90.12; 90 | 637.72 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4513086 | CIF | C4 H9.82 N1.82 O4.18 | P 1 21 1 | 9.7862; 5.5668; 11.706 90; 90.048; 90 | 637.72 | Belitzky, A.; Weissbuch, I.; Posner-Diskin, Y.; Lahav, M.; Lubomirsky, I. Design of Pyroelectric Mixed Crystals Having a Varying Degree of Polarity: Thel-Asparagine·H2O/l-Aspartic Acid System Crystal Growth & Design, 2015, 15, 2445 |
4504914 | CIF | C24 H36 N4 O8 | P -1 | 5.07; 7.2081; 18.388 88.468; 85.015; 72.373 | 638.02 | Bis, Joanna A.; Zaworotko, Michael J. The 2-Aminopyridinium-carboxylate Supramolecular Heterosynthon: A Robust Motif for Generation of Multiple-Component Crystals Crystal Growth & Design, 2005, 5, 1169 |
4500292 | CIF | C13 H12 Co N4 O4 | P -1 | 7.171; 9.352; 9.55 92.794; 92.096; 91.414 | 639 | Aijaz, Arshad; Sañudo, E. Carolina; Bharadwaj, Parimal K. Construction of Coordination Polymers with a Bifurcating Ligand: Synthesis, Structure, Photoluminescence, and Magnetic Studies Crystal Growth & Design, 2011, 11, 1122 |
4512842 | CIF | C28 H28 N2 O8 | P -1 | 6.7914; 10.0137; 10.9532 113.673; 92.345; 107.5 | 639.4 | Martin, Adam D.; Britton, Joshua; Easun, Timothy L.; Blake, Alexander J.; Lewis, William; Schröder, Martin Hirshfeld Surface Investigation of Structure-Directing Interactions within Dipicolinic Acid Derivatives. Crystal growth & design, 2015, 15, 1697-1706 |
4506821 | CIF | C15 H12 N4 | P -1 | 6.8839; 8.8678; 10.965 90.466; 102.738; 101.102 | 639.8 | Deng, Dongsheng; Liu, Leilei; Ji, Bao-Ming; Yin, Guojie; Du, Chenxia Temperature, Cooling Rate, and Additive-Controlled Supramolecular Isomerism in Four Pb(II) Coordination Polymers with an in Situ Ligand Transformation Reaction Crystal Growth & Design, 2012, 12, 5338 |
4517061 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.3823; 8.4674; 10.4894 77.886; 86.838; 87.937 | 639.9 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4507887 | CIF | C17 H14 N2 O | P 1 21 1 | 4.7301; 9.5656; 14.3224 90; 98.6768; 90 | 640.62 | Gilli, Gastone; Bertolasi, Valerio; Gilli, Paola Solid-State N‒H···O/O‒H···N Tautomerism in Resonance-Assisted 1-(Arylazo)-2-Naphthols and Its Through-Spaceπ* ←πPerturbation in TCNQ Cocrystals. A Variable-Temperature X-ray Crystal Study Crystal Growth & Design, 2013, 13, 3308 |
4512850 | CIF | C15 H12 N2 O S | P -1 | 4.1718; 10.9716; 14.1852 88.491; 86.54; 81.432 | 640.76 | Phukan, Nithi; Baruah, Jubaraj B. Polymorphs of Thiazole-Derived Imines Connected to Hydroxyaromatics Crystal Growth & Design, 2015, 15, 1843 |
4509326 | CIF | C4 H23 N3 O9 P2 | P -1 | 5.6469; 9.008; 13.229 97.626; 99.857; 101.154 | 640.8 | Chen, Shuo-ping; Pan, Ling-ling; Yuan, Yi-xuan; Shi, Xi-xi; Yuan, Liang-jie A Novel Supramolecular Resin Based On an Organic Acid−Base Compound Crystal Growth & Design, 2009, 9, 2668 |
4510568 | CIF | C6 H6 N2 S | P 1 21/c 1 | 3.8217; 10.562; 15.907 90; 93.636; 90 | 640.8 | Eccles, Kevin S.; Morrison, Robin E.; Maguire, Anita R.; Lawrence, Simon E. Crystal Landscape of Primary Aromatic Thioamides Crystal Growth & Design, 2014, 14, 2753 |
4507558 | CIF | C7 H7 F | P 1 21/n 1 | 7.223; 7.623; 12.098 90; 105.67; 90 | 641.4 | Ridout, Joe; Probert, Michael R. High-Pressure and Low-Temperature Polymorphism in C‒H···F‒C Hydrogen Bonded Monofluorotoluenes Crystal Growth & Design, 2013, 13, 1943 |
4512186 | CIF | C6 H5 B F2 O2 | P 1 21/n 1 | 4.9578; 5.5256; 23.484 90; 93.974; 90 | 641.79 | Madura, Izabela D.; Czerwińska, Karolina; Sołdańska, Dominika Hydrogen-Bonded Dimeric Synthon of Fluoro-Substituted Phenylboronic Acids versus Supramolecular Organization in Crystals Crystal Growth & Design, 2014, 14, 5912 |
4501674 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.338; 5.486; 22.496 90; 103.043; 90 | 641.8 | Sarma, Bipul; Sanphui, Palash; Nangia, Ashwini Polymorphism in Isomeric Dihydroxybenzoic Acids Crystal Growth & Design, 2010, 10, 2388 |
4506340 | CIF | C11 H13 Cu N5 O4 | P -1 | 7.8705; 8.5184; 11.2615 69.155; 77.225; 65.995 | 641.99 | Pérez-Yáñez, Sonia; Beobide, Garikoitz; Castillo, Oscar; Cepeda, Javier; Luque, Antonio; Román, Pascual Directing the Formation of Adenine Coordination Polymers from Tunable Copper(II)/Dicarboxylato/Adenine Paddle-Wheel Building Units Crystal Growth & Design, 2012, 12, 3324 |
4517063 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.4063; 8.5132; 10.4515 77.693; 86.876; 87.493 | 642.53 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4504946 | CIF | C3 H7 N3 O5 | C 1 2/c 1 | 12.278; 6.6757; 8.6678 90; 115.239; 90 | 642.63 | Lewis, Thomas C.; Tocher, Derek A.; Price, Sarah L. Investigating Unused Hydrogen Bond Acceptors Using Known and Hypothetical Crystal Polymorphism Crystal Growth & Design, 2005, 5, 983 |
4504289 | CIF | C5 H3 Ag N6 | P 1 21/c 1 | 3.5465; 12.373; 14.679 90; 92.638; 90 | 643.4 | Li, Zhen; Li, Mian; Zhou, Xiao-Ping; Wu, Tao; Li, Dan; Ng, Seik Weng Metal-Directed Supramolecular Architectures: From Mononuclear to 3D Frameworks Based on In Situ Tetrazole Ligand Synthesis Crystal Growth & Design, 2007, 7, 1992 |
4517070 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.4171; 8.5537; 10.4144 77.547; 86.928; 87.005 | 643.69 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4503526 | CIF | C16 H12 K2 N4 O22 U | P -1 | 8.0517; 8.7548; 10.2542 110.274; 107.093; 90.135 | 643.71 | Masci, Bernardo; Thuéry, Pierre Pyrazinetetracarboxylic Acid as an Assembler Ligand in Uranyl−Organic Frameworks Crystal Growth & Design, 2008, 8, 1689 |
4517064 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.4235; 8.5698; 10.393 77.478; 86.938; 86.79 | 643.86 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4502413 | CIF | C6 H12 O2 | P 1 21/a 1 | 7.798; 8.9221; 9.3291 90; 96.633; 90 | 644.72 | Maria, Teresa M. R.; Castro, Ricardo A. E.; Bebiano, Suse S.; Ramos Silva, M.; Matos Beja, A.; Canotilho, João; Eusébio, M. Ermelinda S. Polymorphism oftrans-1,4-Cyclohexanediol: Conformational Isomorphism Crystal Growth & Design, 2010, 10, 1194 |
4516494 | CIF | C11 H12 N4 O5 S | P -1 | 8.0161; 9.1719; 9.6595 74.079; 86.251; 70.884 | 645.06 | Rybarczyk-Pirek, Agnieszka J.; Łukomska-Rogala, Marlena; Wojtulewski, Sławomir; Palusiak, Marcin N-Oxide as a Proton Accepting Group in Multicomponent Crystals: X-ray and Theoretical Studies on New p-Nitropyridine-N-oxide Co-Crystals Crystal Growth & Design, 2015, 15, 5802 |
4507244 | CIF | C12 H15 N7 O2 | P 1 21/m 1 | 8.2688; 6.3458; 12.8427 90; 106.785; 90 | 645.17 | Jarzembska, Katarzyna N.; Goral, Anna M.; Gajda, Roman; Dominiak, Paulina M. Hoogsteen‒Watson‒Crick 9-Methyladenine:1-Methylthymine Complex: Charge Density Study in the Context of Crystal Engineering and Nucleic Acid Base Pairing Crystal Growth & Design, 2013, 13, 239 |
4507888 | CIF | C17 H14 N2 O | P 1 21 1 | 4.7396; 9.5921; 14.3534 90; 98.4903; 90 | 645.39 | Gilli, Gastone; Bertolasi, Valerio; Gilli, Paola Solid-State N‒H···O/O‒H···N Tautomerism in Resonance-Assisted 1-(Arylazo)-2-Naphthols and Its Through-Spaceπ* ←πPerturbation in TCNQ Cocrystals. A Variable-Temperature X-ray Crystal Study Crystal Growth & Design, 2013, 13, 3308 |
4508428 | CIF | C28 H18 N6 O10 Zn2 | P -1 | 7.5009; 9.6296; 10.3322 92.856; 108.841; 111.401 | 645.6 | Yang, Yan; Du, Peng; Liu, Ying-Ying; Ma, Jian-Fang A Series of Coordination Polymers Constructed by Flexible 4-Substituted Bis(1,2,4-triazole) Ligands and Polycarboxylate Anions: Syntheses, Structures, and Photoluminescent Properties Crystal Growth & Design, 2013, 13, 4781 |
4512184 | CIF | C6 H4 B F3 O2 | P 1 21/n 1 | 5.00301; 5.33367; 24.2178 90; 90.2585; 90 | 646.23 | Madura, Izabela D.; Czerwińska, Karolina; Sołdańska, Dominika Hydrogen-Bonded Dimeric Synthon of Fluoro-Substituted Phenylboronic Acids versus Supramolecular Organization in Crystals Crystal Growth & Design, 2014, 14, 5912 |
4512705 | CIF | C38 H20 N4 O2 | P -1 | 7.1529; 9.578; 10.6022 111.166; 105.862; 90.91 | 646.23 | Yoshida, Yukihiro; Kumagai, Yoshihide; Mizuno, Motohiro; Saito, Gunzi Structure‒Property Relationship of Supramolecular Rotators of Coronene in Charge-Transfer Solids Crystal Growth & Design, 2015, 15, 1389 |
4512187 | CIF | C6 H5 B F2 O2 | P 1 21/n 1 | 3.67926; 12.2868; 14.3179 90; 93.057; 90 | 646.34 | Madura, Izabela D.; Czerwińska, Karolina; Sołdańska, Dominika Hydrogen-Bonded Dimeric Synthon of Fluoro-Substituted Phenylboronic Acids versus Supramolecular Organization in Crystals Crystal Growth & Design, 2014, 14, 5912 |
4508133 | CIF | Au2 Eu In4 | P n m a | 18.5987; 4.6616; 7.4669 90; 90; 90 | 647.38 | Sarkar, Sumanta; Gutmann, Matthias J.; Peter, Sebastian C. Crystal Structure and Magnetic Properties of Indium Flux Grown EuAu2In4and EuAuIn4 Crystal Growth & Design, 2013, 13, 4285 |
4501868 | CIF | C22 H46 N6 S2 | P -1 | 7.5087; 9.4482; 9.4581 85.891; 76.883; 82.603 | 647.42 | Paisner, Kathryn; Zakharov, Lev N.; Doxsee, Kenneth M. A Robust Thiourea Synthon for Crystal Engineering Crystal Growth & Design, 2010, 10, 3757 |
4513461 | CIF | C13 H13 N3 O2 | P 1 21 1 | 9.5379; 5.7387; 12.5211 90; 109.146; 90 | 647.44 | Kamali, Naghmeh; Aljohani, Marwah; McArdle, Patrick; Erxleben, Andrea Hydrogen Bonding Networks and Solid-State Conversions in Benzamidinium Salts Crystal Growth & Design, 2015, 15, 3905 |
4517071 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.4528; 8.6771; 10.316 77.061; 86.974; 85.713 | 647.92 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4504538 | CIF | C14 H14 N4 O2 | P 1 21/n 1 | 4.266; 15.07; 10.262 90; 100.73; 90 | 648.2 | Sarkar, Madhushree; Biradha, Kumar Amide-to-Amide Hydrogen Bonds in the Presence of a Pyridine Functionality: Crystal Structures of Bis(pyridinecarboxamido)alkanes Crystal Growth & Design, 2006, 6, 202 |
4510108 | CIF | C14 H16 N2 O3 | P -1 | 7.9027; 9.251; 9.692 70.636; 77.528; 79.727 | 648.3 | Mukherjee, Arijit; Desiraju, Gautam R. Combinatorial Exploration of the Structural Landscape of Acid‒Pyridine Cocrystals Crystal Growth & Design, 2014, 14, 1375 |
4513522 | CIF | C2 I3 N4 O2 Pb | P -1 | 4.637; 11.112; 13.46 71.462; 80.868; 84.288 | 648.33 | Eppel, Sagi; Fridman, Natalia; Frey, Gitti Amide-Templated Iodoplumbates: Extending Lead-Iodide Based Hybrid Semiconductors Crystal Growth & Design, 2015, 15, 4363 |
4504452 | CIF | C14 H14 N4 O2 | P 1 21/n 1 | 7.737; 8.129; 10.546 90; 102.05; 90 | 648.7 | Rajput, Lalit; Singha, Subhankar; Biradha, Kumar Comparative Structural Studies on Homologues of Amides and Reverse Amides: Unprecedented 4-fold Interpenetrated Quartz Network, New β-Sheet, and Two-Dimensional Layers Crystal Growth & Design, 2007, 7, 2788 |
4511528 | CIF | C12 H13 Br Cu N2 O3 | P 1 21/m 1 | 9.5793; 6.404; 10.7646 90; 100.534; 90 | 649.23 | Das, Sunirban; Maloor, Simi Alathady; Pal, Satyanarayan; Pal, Samudranil Solvated Square-Planar Ternary Copper(II) Complexes: Solvent-Dependent Zipper and Columnar Structures Crystal Growth & Design, 2006, 6, 2103 |
4519462 | CIF HKL | C12 H14 Br1.64 I0.36 N2 | P 1 21/c 1 | 5.9498; 8.0945; 13.5611 90; 96.045; 90 | 649.48 | Abdel Rahman Al Ahmad; Thierry Maris; Christian Pellerin; James D. Wuest Adding a Pinch of Salt: Using Ionic Mixed-Crystal Seeds to Search for New Solid Forms Crystal Growth & Design, 2023, 23, 7472-7481 |
4505124 | CIF | C2 H7 Co O8 P | P 1 21/c 1 | 5.678; 15.469; 7.846 90; 109.522; 90 | 649.5 | Fu, Ruibiao; Xiang, Shengchang; Zhang, Huishuang; Zhang, Jianjun; Wu, Xintao Syntheses, Characterization, and Magnetic Properties of Four New Layered Transition-Metal Hydroxyl−Carboxylate−Phosphonates: [M(CH(OH)(CO2)(PO3H))(H2O)2] (M = Mn, Fe, Co, Zn) Crystal Growth & Design, 2005, 5, 1795 |
4500480 | CIF | C7 H6 F N O | P 1 21/c 1 | 8.8715; 7.6301; 9.6077 90; 92.576; 90 | 649.69 | Hathwar, Venkatesha R.; Guru Row, Tayur N. Charge Density Analysis of Heterohalogen (Cl···F) and Homohalogen (F···F) Intermolecular Interactions in Molecular Crystals: Importance of the Extent of Polarizability Crystal Growth & Design, 2011, 11, 1338 |
4509155 | CIF | C14 H18 N2 O2 | P 1 21/c 1 | 7.566; 9.218; 10.001 90; 111.328; 90 | 649.7 | Weyna, David R.; Shattock, Tanise; Vishweshwar, Peddy; Zaworotko, Michael J. Synthesis and Structural Characterization of Cocrystals and Pharmaceutical Cocrystals: Mechanochemistry vs Slow Evaporation from Solution Crystal Growth & Design, 2009, 9, 1106 |
4514133 | CIF | C4 H7 Li O6 | P 1 21/n 1 | 5.8334; 5.9257; 18.803 90; 91.3; 90 | 649.8 | Malaspina, Lorraine A.; Edwards, Alison J.; Woińska, Magdalena; Jayatilaka, Dylan; Turner, Michael J.; Price, Jason R.; Herbst-Irmer, Regine; Sugimoto, Kunihisa; Nishibori, Eiji; Grabowsky, Simon Predicting the Position of the Hydrogen Atom in the Short Intramolecular Hydrogen Bond of the Hydrogen Maleate Anion from Geometric Correlations Crystal Growth & Design, 2017, 17, 3812 |
4500149 | CIF | C11 H11 Ca N O7 | P -1 | 8.3328; 8.6794; 9.9393 70.52; 84.459; 73.722 | 650.53 | Liang, Po-Ching; Liu, Hsin-Kuan; Yeh, Chun-Ting; Lin, Chia-Her; Zima, Vítězslav Supramolecular Assembly of Calcium Metal−Organic Frameworks with Structural Transformations Crystal Growth & Design, 2011, 11, 699 |
4500812 | CIF | C5 H15 Ga N2 O8 P2 | P -1 | 8.451; 8.777; 8.928 92.195; 95.709; 98.509 | 650.7 | Olshansky, Jacob H.; Blau, Samuel M.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J. Understanding an Order‒Disorder Phase Transition in Ionothermally Synthesized Gallium Phosphates Crystal Growth & Design, 2011, 11, 3065 |
4517067 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.4793; 8.7829; 10.2316 76.593; 86.968; 84.781 | 650.74 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4507889 | CIF | C17 H14 N2 O | P 1 21 1 | 4.7492; 9.621; 14.3919 90; 98.2103; 90 | 650.86 | Gilli, Gastone; Bertolasi, Valerio; Gilli, Paola Solid-State N‒H···O/O‒H···N Tautomerism in Resonance-Assisted 1-(Arylazo)-2-Naphthols and Its Through-Spaceπ* ←πPerturbation in TCNQ Cocrystals. A Variable-Temperature X-ray Crystal Study Crystal Growth & Design, 2013, 13, 3308 |
4517072 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.4994; 8.8416; 10.1705 76.24; 86.882; 84.146 | 651.29 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4511529 | CIF | C13 H13 Cl Cu N2 O2 | P -1 | 6.9205; 9.2257; 10.4996 100.529; 97.798; 92.593 | 651.3 | Das, Sunirban; Maloor, Simi Alathady; Pal, Satyanarayan; Pal, Samudranil Solvated Square-Planar Ternary Copper(II) Complexes: Solvent-Dependent Zipper and Columnar Structures Crystal Growth & Design, 2006, 6, 2103 |
4500123 | CIF | C10 H8 N6 O7 | P -1 | 5.9086; 8.043; 13.868 88.8722; 81.3468; 89.619 | 651.41 | Bertolasi, Valerio; Gilli, Paola; Gilli, Gastone Hydrogen Bonding and Electron Donor−Acceptor (EDA) Interactions Controlling the Crystal Packing of Picric Acid and Its Adducts with Nitrogen Bases. Their Rationalization in Terms of the pKaEqualization and Electron-Pair Saturation Concepts Crystal Growth & Design, 2011, 11, 2724 |
4512879 | CIF | C24 H16 N8 O12 | P -1 | 4.6421; 9.923; 14.773 106.135; 93.894; 91.467 | 651.5 | Ravat, Prince; SeethaLekshmi, Sunil; Biswas, Sharmita Nandy; Nandy, Purnendu; Varughese, Sunil Equivalence of Ethylene and Azo-Bridges in the Modular Design of Molecular Complexes: Role of Weak Interactions Crystal Growth & Design, 2015, 15, 2389 |
4517069 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.4924; 8.8522; 10.1725 76.232; 86.916; 84.121 | 651.55 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4502660 | CIF | C26 H28 Mn N8 O2 | P -1 | 5.6153; 9.3336; 13.3398 106.03; 93.611; 102.05 | 651.73 | Abrahams, Brendan F.; Hudson, Timothy A.; Robson, Richard A New Approach to DCNQI-Based Coordination Polymers via DCNQIH2 Crystal Growth & Design, 2010, 10, 1468 |
4517065 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.5049; 8.8598; 10.1573 76.199; 86.886; 83.941 | 651.92 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4517073 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.5078; 8.888; 10.1325 76.029; 86.784; 83.779 | 651.96 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4503527 | CIF | C16 H12 N4 O22 Rb2 U | P -1 | 8.0501; 8.7608; 10.3486 109.559; 107.331; 90.071 | 652.35 | Masci, Bernardo; Thuéry, Pierre Pyrazinetetracarboxylic Acid as an Assembler Ligand in Uranyl−Organic Frameworks Crystal Growth & Design, 2008, 8, 1689 |
4512185 | CIF | C6 H5 B F2 O2 | P 1 21/c 1 | 4.15299; 5.11382; 30.7324 90; 90.0696; 90 | 652.683 | Madura, Izabela D.; Czerwińska, Karolina; Sołdańska, Dominika Hydrogen-Bonded Dimeric Synthon of Fluoro-Substituted Phenylboronic Acids versus Supramolecular Organization in Crystals Crystal Growth & Design, 2014, 14, 5912 |
4517066 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.5175; 8.8851; 10.1345 76.054; 86.817; 83.763 | 652.78 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4517062 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.519; 8.8836; 10.1342 76.071; 86.803; 83.784 | 652.84 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4511742 | CIF | C14 H16 Mo6 N4 O19 | P -1 | 7.741; 9.604; 10.2 113.291; 107.492; 92.45 | 652.9 | Li, 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 |
4517075 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.519; 8.898; 10.122 76.022; 86.781; 83.761 | 652.9 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4505270 | CIF | C14 H9 F5 N2 O2 | P 1 21 1 | 7.3546; 6.0207; 14.7507 90; 90.568; 90 | 653.13 | Reddy, L. Sreenivas; Nangia, Ashwini; Lynch, Vincent M. Phenyl-Perfluorophenyl Synthon Mediated Cocrystallization of Carboxylic Acids and Amides Crystal Growth & Design, 2004, 4, 89 |
4517068 | CIF | C31 H26 N2 O4 S2 | P 1 | 7.5206; 8.8938; 10.1311 76.016; 86.818; 83.775 | 653.37 | Khorasani, Sanaz; Fernandes, Manuel A. Cooperativity and Feedback Mechanisms in the Single-Crystal-to-Single-Crystal Solid-State Diels‒Alder Reaction of 9-Methylanthracene with Bis(N-cyclobutylimino)-1,4-dithiin Crystal Growth & Design, 2013, 13, 5499 |
4505961 | CIF | C14 H10 Cl2 N O2 | P -1 | 8.5209; 8.8775; 9.1986 104.265; 103.337; 91.569 | 653.56 | Sanphui, Palash; Bolla, Geetha; Nangia, Ashwini High Solubility Piperazine Salts of the Nonsteroidal Anti-Inflammatory Drug (NSAID) Meclofenamic Acid Crystal Growth & Design, 2012, 12, 2023 |
4507245 | CIF | C6 H7 N5 | P 1 21/n 1 | 7.4877; 12.2678; 7.6797 90; 112.11; 90 | 653.56 | Jarzembska, Katarzyna N.; Goral, Anna M.; Gajda, Roman; Dominiak, Paulina M. Hoogsteen‒Watson‒Crick 9-Methyladenine:1-Methylthymine Complex: Charge Density Study in the Context of Crystal Engineering and Nucleic Acid Base Pairing Crystal Growth & Design, 2013, 13, 239 |
4505125 | CIF | C2 H7 O8 P Zn | P 1 21/c 1 | 5.72; 15.5327; 7.8528 90; 110.332; 90 | 654.23 | Fu, Ruibiao; Xiang, Shengchang; Zhang, Huishuang; Zhang, Jianjun; Wu, Xintao Syntheses, Characterization, and Magnetic Properties of Four New Layered Transition-Metal Hydroxyl−Carboxylate−Phosphonates: [M(CH(OH)(CO2)(PO3H))(H2O)2] (M = Mn, Fe, Co, Zn) Crystal Growth & Design, 2005, 5, 1795 |
4504227 | CIF | C24 H18 Ag2 Cl2 N6 O8 | P -1 | 8.238; 9.466; 9.944 107.55; 106.65; 105.25 | 654.5 | Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands Crystal Growth & Design, 2007, 7, 2481 |
4505600 | CIF | C14 H8 Cd N2 O4 | P -1 | 7.669; 9.5867; 10.3567 89.12; 69.859; 67.531 | 654.64 | Wen, Lili; Zhao, Jinbo; Lv, Kangle; Wu, Yuhui; Deng, Kejian; Leng, Xiaoke; Li, Dongfeng Visible-Light-Driven Photocatalysts of Metal‒Organic Frameworks Derived from Multi-Carboxylic Acid and Imidazole-Based Spacer Crystal Growth & Design, 2012, 12, 1603 |
4500811 | CIF | C5 H15 Ga N2 O8 P2 | P -1 | 8.477; 8.795; 8.929 92.248; 95.825; 98.076 | 654.7 | Olshansky, Jacob H.; Blau, Samuel M.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J. Understanding an Order‒Disorder Phase Transition in Ionothermally Synthesized Gallium Phosphates Crystal Growth & Design, 2011, 11, 3065 |
4504923 | CIF | C5 H4 N2 O4 Zn | P 1 21/c 1 | 8.4292; 9.4026; 8.276 90; 93.156; 90 | 654.93 | Lu, Jing; Zhao, Kui; Fang, Qian-Rong; Xu, Ji-Qing; Yu, Jie-Hui; Zhang, Xiao; Bie, Hai-Ying; Wang, Tie-Gang Synthesis and Characterization of Four Novel Supramolecular Compounds Based on Metal Zinc and Cadmium Crystal Growth & Design, 2005, 5, 1091 |
4501872 | CIF | C26 H38 N6 S2 | P -1 | 7.8621; 8.9516; 10.6574 71.844; 75.928; 68.33 | 655.33 | Paisner, Kathryn; Zakharov, Lev N.; Doxsee, Kenneth M. A Robust Thiourea Synthon for Crystal Engineering Crystal Growth & Design, 2010, 10, 3757 |
4513681 | CIF | C15 H12 O6 | P -1 | 7.8486; 9.7046; 10.4672 104.171; 110.512; 107.425 | 655.6 | Zhu, Bingqing; Wang, Jian-Rong; Mei, Xuefeng Insight into the Phase Transformation among Various Solid Forms of Baicalein Crystal Growth & Design, 2015, 15, 4959 |
4501211 | CIF | C10 H8 Br2 Cl2 Cu N2 | P 1 21/c 1 | 3.9041; 13.8156; 12.1585 90; 90.521; 90 | 655.77 | Awwadi, Firas; Willett, Roger D.; Twamley, Brendan Tuning Molecular Structures Using Weak Noncovalent Interactions: Theoretical Study and Structure oftrans-Bis(2-chloropyridine)dihalocopper(II) andtrans-Bis(3-chloropyridine)dibromocopper(II) Crystal Growth & Design, 2011, 11, 5316 |
4511071 | CIF | C13 H14 F I N2 | P -1 | 7.4705; 9.3362; 9.9254 74.868; 84.318; 79.366 | 655.84 | Präsang, Carsten; Whitwood, Adrian C.; Bruce, Duncan W. Halogen-Bonded Cocrystals of 4-(N,N-Dimethylamino)pyridine with Fluorinated Iodobenzenes Crystal Growth & Design, 2009, 9, 5319 |
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