Crystallography Open Database
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COD ID  |
Links | Formula |
Space group |
Cell parameters | Cell volume  |
Bibliography |
|---|---|---|---|---|---|---|
| 7054164 | CIF | C Fe N2 | P 63/m m c | 3.2689; 3.2689; 9.4008 90; 90; 120 | 86.996 | Herlitschke, M.; Tchougréeff, A. L.; Soudackov, A. V.; Klobes, B.; Stork, L.; Dronskowski, R.; Hermann, R. P. Magnetism and lattice dynamics of FeNCN compared to FeO New J. Chem., 2014, 38, 4670 |
| 7061268 | CIF | Cu H2 O5 S | P -1 | 5.0281; 5.1502; 7.5607 108.592; 108.382; 91.359 | 174.41 | Ibrahim, Mukaila A.; Boeré, René T. The copper sulfate hydration cycle. Crystal structures of CuSO4 (Chalcocyanite), CuSO4·H2O (Poitevinite), CuSO4·3H2O (Bonattite) and CuSO4·5H2O (Chalcanthite) at low temperature using non-spherical atomic scattering factors New Journal of Chemistry, 2022, 46, 5479-5488 |
| 1008258 | CIF | Co La O4 Sr | I 4/m m m | 3.796; 3.796; 12.447 90; 90; 90 | 179.4 | Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent Nouveau Journal de Chimie, 1979, 3, 171-174 |
| 1008259 | CIF | Co La O4 Sr | I 4/m m m | 3.799; 3.799; 12.454 90; 90; 90 | 179.7 | Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent Nouveau Journal de Chimie, 1979, 3, 171-174 |
| 1008260 | CIF | Co La O4 Sr | I 4/m m m | 3.806; 3.806; 12.5 90; 90; 90 | 181.1 | Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent Nouveau Journal de Chimie, 1979, 3, 171-174 |
| 1008261 | CIF | Co La O4 Sr | I 4/m m m | 3.807; 3.807; 12.52 90; 90; 90 | 181.5 | Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent Nouveau Journal de Chimie, 1979, 3, 171-174 |
| 1008262 | CIF | Co La O4 Sr | I 4/m m m | 3.811; 3.811; 12.554 90; 90; 90 | 182.3 | Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent Nouveau Journal de Chimie, 1979, 3, 171-174 |
| 1008263 | CIF | Co La O4 Sr | I 4/m m m | 3.817; 3.817; 12.6 90; 90; 90 | 183.6 | Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent Nouveau Journal de Chimie, 1979, 3, 171-174 |
| 1008264 | CIF | Co La O4 Sr | I 4/m m m | 3.824; 3.824; 12.659 90; 90; 90 | 185.1 | Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent Nouveau Journal de Chimie, 1979, 3, 171-174 |
| 7058489 | CIF | Bi Na2 S4 Sb | F m -3 m | 5.7603; 5.7603; 5.7603 90; 90; 90 | 191.13 | Alahmari, Fatimah; Dey, Somnath; Emwas, Abdul-Hamid; Davaasuren, Bambar; Rothenberger, Alexander Ultra-low thermal conductivity in Na/Sb chalcobismuthates: synthesis, crystal structures, optical properties and 23Na NMR spectroscopy New Journal of Chemistry, 2019, 43, 10814 |
| 7052608 | CIF | C2 H2 Br Cu N | P -1 | 3.9006; 6.928; 7.7307 107.693; 99.426; 94.527 | 194.49 | Pospisil, Jiri; Jess, Inke; Näther, Christian; Necas, Marek; Taborsky, Petr Luminescence properties of “double-stranded staircase” copper(i) halide coordination polymers with N-containing ligands New Journal of Chemistry, 2011, 35, 861 |
| 7054719 | CIF | C4 H4 O2 | P 1 21 1 | 3.8248; 7.0987; 7.7801 90; 101.058; 90 | 207.32 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054714 | CIF | C4 H4 O2 | P -1 | 5.0156; 6.9262; 7.0836 112.956; 97.227; 107.388 | 207.85 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054720 | CIF | C4 H4 O2 | P 1 21 1 | 3.8518; 7.0956; 7.7924 90; 100.862; 90 | 209.16 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7062967 | CIF | B4 H16 Hf | P -4 3 m | 5.946; 5.946; 5.946 90; 90; 90 | 210.2 | Burkmann, Konrad; Habermann, Franziska; Schumann, Erik; Kraus, Jakob; Störr, Bianca; Schmidt, Horst; Brendler, Erica; Seidel, Jürgen; Bohmhammel, Klaus; Kortus, Jens; Mertens, Florian Structural and thermodynamic investigations of Zr(BH4)4 and Hf(BH4)4 between 280 K and their decomposition temperatures New Journal of Chemistry, 2024, 48, 2743-2754 |
| 7054715 | CIF | C4 H4 O2 | P -1 | 5.0359; 6.9758; 7.1152 112.963; 97.033; 107.706 | 210.8 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7062966 | CIF | B4 H16 Zr | P -4 3 m | 5.955; 5.955; 5.955 90; 90; 90 | 211.2 | Burkmann, Konrad; Habermann, Franziska; Schumann, Erik; Kraus, Jakob; Störr, Bianca; Schmidt, Horst; Brendler, Erica; Seidel, Jürgen; Bohmhammel, Klaus; Kortus, Jens; Mertens, Florian Structural and thermodynamic investigations of Zr(BH4)4 and Hf(BH4)4 between 280 K and their decomposition temperatures New Journal of Chemistry, 2024, 48, 2743-2754 |
| 7058490 | CIF | Bi Na2 Sb Se4 | F m -3 m | 5.9648; 5.9648; 5.9648 90; 90; 90 | 212.22 | Alahmari, Fatimah; Dey, Somnath; Emwas, Abdul-Hamid; Davaasuren, Bambar; Rothenberger, Alexander Ultra-low thermal conductivity in Na/Sb chalcobismuthates: synthesis, crystal structures, optical properties and 23Na NMR spectroscopy New Journal of Chemistry, 2019, 43, 10814 |
| 7054721 | CIF | C4 H4 O2 | P 1 21 1 | 3.8856; 7.1138; 7.8353 90; 100.93; 90 | 212.65 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054716 | CIF | C4 H4 O2 | P -1 | 5.058; 7.0169; 7.1325 112.92; 96.962; 108.002 | 213.14 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054722 | CIF | C4 H4 O2 | P 1 21 1 | 3.8912; 7.1141; 7.8453 90; 100.8; 90 | 213.33 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054723 | CIF | C4 H4 O2 | P 1 21 1 | 3.9127; 7.1074; 7.8489 90; 100.422; 90 | 214.67 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054717 | CIF | C4 H4 O2 | P -1 | 5.0673; 7.0638; 7.163 113.064; 96.689; 108.347 | 215.3 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054718 | CIF | C4 H4 O2 | P 1 21 1 | 3.9158; 7.1104; 7.871 90; 100.59; 90 | 215.42 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054724 | CIF | C4 H4 O2 | P 1 21 1 | 3.9417; 7.1096; 7.878 90; 100.25; 90 | 217.25 | Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K. Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs? New J. Chem., 2015, 39, 3345 |
| 7054634 | CIF | Dy0.5 Mn O3 Yb0.5 | P n m a | 5.8352; 7.3473; 5.2561 90; 90; 90 | 225.34 | Zhang, Yingnan; Liu, Fuyang; Zheng, Tong; Zhang, Ziqing; Liu, Wei; Zhao, Xudong; Liu, Xiaoyang Synthesis of perovskite-type manganites Yb1−xDyxMnO3(0.1 ≤ x ≤ 0.5) via solid-state reaction and high-pressure flux methods followed by structural characterization and magnetic property studies New J. Chem., 2015, 39, 2596 |
| 7051493 | CIF | C H6 N2 O2 S | P -1 | 5.427; 5.828; 7.649 91.97; 95.84; 107.41 | 229.1 | Structure and Vibrational Spectroscopy of Methanesulfonic Acid Hydrazide: an Experimental and Theoretical Study New Journal of Chemistry, 1999 |
| 7058714 | CIF | Co2 Li3 O6 Sb | C 1 2/m 1 | 5.24111; 9.0391; 5.18179 90; 110.049; 90 | 230.61 | Stratan, Mikhail I.; Shukaev, Igor L.; Vasilchikova, Tatyana M.; Vasiliev, Alexander N.; Korshunov, Artem N.; Kurbakov, Alexander I.; Nalbandyan, Vladimir B.; Zvereva, Elena A. Synthesis, structure and magnetic properties of honeycomb-layered Li3Co2SbO6 with new data on its sodium precursor, Na3Co2SbO6 New Journal of Chemistry, 2019, 43, 13545 |
| 7060604 | CIF | C4 H10 N10 O2 | P 1 | 3.7934; 7.4317; 8.7328 105.198; 100.874; 92.381 | 232.24 | Chen, Xiang; Guo, Zhaoqi; Zhang, Cong; Zhang, Jianguo; Ma, Haixia Boosting intermolecular interactions of fused cyclic explosives: the way to thermostable and insensitive energetic materials with high density New Journal of Chemistry, 2021, 45, 9358-9367 |
| 7057771 | CIF | Ba Cl Cu H3 O3 | P 1 21/m 1 | 4.1335; 6.674; 9.1613 90; 100.43; 90 | 248.56 | Wang, Ming-Qing; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao BaCu(OH)3Cl: a new one-dimensional Mott insulator with a CuO2 chessboard layer New Journal of Chemistry, 2018, 42, 18077 |
| 7058491 | CIF | Bi Na2 Sb Te4 | F m -3 m | 6.3315; 6.3315; 6.3315 90; 90; 90 | 253.82 | Alahmari, Fatimah; Dey, Somnath; Emwas, Abdul-Hamid; Davaasuren, Bambar; Rothenberger, Alexander Ultra-low thermal conductivity in Na/Sb chalcobismuthates: synthesis, crystal structures, optical properties and 23Na NMR spectroscopy New Journal of Chemistry, 2019, 43, 10814 |
| 7060620 | CIF | C4 H6 N4 | P 1 21 1 | 4.9091; 6.622; 8.103 90; 99.75; 90 | 259.61 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
| 7061627 | CIF | C32 Cl0.29 O24 | P m -3 m | 6.3959; 6.3959; 6.3959 90; 90; 90 | 261.64 | You, Xiuli; Rao, Wenjun; Han, Keke; Wang, Lingyu; Zhang, Mengxia; Wei, Zhenhong Two quasi-spherical molecules [1,4-diazabicyclo(3.2.2)nonane]X (X = ClO4, ReO4) exhibit switchable phase transition, dielectric and second-harmonic-generation properties New Journal of Chemistry, 2022, 46, 14404-14409 |
| 7050838 | CIF | C2 H5 O4 P Zn | P m n 21 | 5.6805; 9.8101; 4.7988 90; 90; 90 | 267.419 | Menaa, Bouzid; Kariuki, Benson M.; Shannon, Ian J. Preparation using metal oxide precursors and crystal structures of the copper and zinc vinylphosphonate materials M(O3PC2H3)·H2O (M = Cu, Zn)Electronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams in CHIME format. See http://www.rsc.org/suppdata/nj/b2/b200438k/ New Journal of Chemistry, 2002, 26, 906 |
| 7061269 | CIF | Cu O4 S | P n m a | 8.3958; 6.676; 4.827 90; 90; 90 | 270.56 | Ibrahim, Mukaila A.; Boeré, René T. The copper sulfate hydration cycle. Crystal structures of CuSO4 (Chalcocyanite), CuSO4·H2O (Poitevinite), CuSO4·3H2O (Bonattite) and CuSO4·5H2O (Chalcanthite) at low temperature using non-spherical atomic scattering factors New Journal of Chemistry, 2022, 46, 5479-5488 |
| 7050634 | CIF | C6 H4 F4 I2 N2 | P -1 | 6.2536; 6.4403; 7.5067 106.843; 107.535; 93.925 | 271.87 | Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br) New Journal of Chemistry, 2003, 27, 1522 |
| 7062019 | CIF | Na Sc Se2 | R -3 m :H | 3.9191; 3.9191; 20.708 90; 90; 120 | 275.45 | Panigrahi, Gopabandhu; Yadav, Sweta; Jana, Subhendu; Ghosh, Arghya; Niranjan, Manish K.; Prakash, Jai Syntheses and characterization of two new layered ternary chalcogenides NaScQ2 (Q = Se and Te) New Journal of Chemistry, 2022, 46, 22076-22087 |
| 7061628 | CIF | C14 O4 Re | P -4 2 m | 6.8907; 6.8907; 5.8523 90; 90; 90 | 277.88 | You, Xiuli; Rao, Wenjun; Han, Keke; Wang, Lingyu; Zhang, Mengxia; Wei, Zhenhong Two quasi-spherical molecules [1,4-diazabicyclo(3.2.2)nonane]X (X = ClO4, ReO4) exhibit switchable phase transition, dielectric and second-harmonic-generation properties New Journal of Chemistry, 2022, 46, 14404-14409 |
| 7052848 | CIF | C7 H6 N2 | P 1 21 1 | 7.4285; 5.748; 7.6305 90; 118.462; 90 | 286.43 | González, J. J. L.; Ureña, F. P.; Moreno, J. R. A.; Mata, I.; Molins, E.; Claramunt, R. M.; López, C.; Alkorta, I.; Elguero, J. The chiral structure of 1H-indazoles in the solid state: a crystallographic, vibrational circular dichroism and computational study New Journal of Chemistry, 2012, 36, 749 |
| 7051298 | CIF | C6 H8 N2 | P 1 21/n 1 | 5.7021; 5.048; 10.664 90; 104.549; 90 | 297.12 | New Journal of Chemistry, 2000 |
| 7060341 | CIF | C4 H10 N12 O6 | P -1 | 6.672; 6.9096; 6.992 73.521; 89.005; 75.832 | 299.22 | Zhu, Jiaping; Xu, Jielai; Yao, Chaojian; Zhan, Tong; Liu, Weibing; Tan, Hua A new 3D Ag(i)-based high-energy metal organic frameworks (HE-MOFs): synthesis, crystal structure and explosive performance New Journal of Chemistry, 2021, 45, 3552-3558 |
| 7058776 | CIF | C3 H6 F2 N2 O3 | P -1 | 5.5333; 6.1726; 9.2437 91.249; 106.658; 92.337 | 302.03 | Chen, Jifeng; Yu, Yi; Zhang, Shujuan; Li, Yuchuan; Pang, Siping Energetic materials with fluorinated four-membered heterocyclic ring: 3,3′-difluoroazetidine (DFAZ) salts New Journal of Chemistry, 2019, 43, 15115 |
| 7057578 | CIF | C14 H10 O10 | P -1 | 4.60137; 7.6252; 9.3955 101.958; 96.9215; 103.461 | 308.669 | Tokutomi, Hisashi; Wu, JianYun; Takeda, Takashi; Hoshino, Norihisa; Akutagawa, Tomoyuki Phase transition and molecular assembly structure of ellagic acid ester derivatives New Journal of Chemistry, 2018, 42, 14700 |
| 7061653 | CIF | C4 H4 N4 O4 | P -1 | 5.0887; 7.8054; 7.906 89.639; 80.847; 89.131 | 309.98 | Zhang, Qi; He, Chunlin; Pang, Siping Synthesis of heterocyclic (triazole, furoxan, furazan) fused pyridazine di-N-oxides via hypervalent iodine oxidation New Journal of Chemistry, 2022, 46, 14324-14327 |
| 7056611 | CIF | C6 H4 F2 N4 O12 | P -1 | 6.1749; 6.3972; 9.0143 78.006; 80.204; 63.912 | 311.56 | Ma, Jinchao; Yang, Hongwei; Cheng, Guangbin Study on the synthesis of 2-fluoro-2,2-dinitroethyl esters as potential melt cast matrix in explosive charges New J. Chem., 2017 |
| 7053549 | CIF | C14 H15 N O5 | P 1 | 5.3583; 5.8497; 10.4352 88.144; 75.461; 82.331 | 313.78 | Leong, Wei Lee; Vittal, Jagadese J. Alkali metal ion directed self-assembled Ni(ii) molecular clusters New Journal of Chemistry, 2010, 34, 2145 |
| 7051495 | CIF | C5 H5 Cl2 N | P 1 21/m 1 | 4.5137; 7.925; 8.898 90; 99.173; 90 | 314.24 | Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides New Journal of Chemistry, 1999 |
| 7052662 | CIF | C8 H22 N4 O4 | P -1 | 5.1642; 7.4945; 8.4337 94.823; 96.022; 101.486 | 316.26 | Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M. Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes New Journal of Chemistry, 2011, 35, 1515 |
| 7052009 | CIF | C6 H8 N2 O2 | P -1 | 3.9193; 5.754; 14.366 100.027; 96.109; 92.374 | 316.6 | Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L. The observed and energetically feasible crystal structures of 5-substituted uracils New Journal of Chemistry, 2008, 32, 1761 |
| 7052257 | CIF | C7 H5 Cl O2 | P -1 | 14.21; 6.072; 3.747 87.68; 100.32; 93 | 317.48 | Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman Temperature dependence of proton transfer in 4-chlorobenzoic acid New Journal of Chemistry, 2006, 30, 979 |
| 7056343 | CIF | C3 H4 Li N7 O | P -1 | 3.4344; 9.898; 10.611 115.93; 92.17; 98.473 | 318.72 | Safin, Damir A.; Railliet, Antoine P.; Robeyns, Koen; Mitoraj, Mariusz P.; Kubisiak, Piotr; Sagan, Filip; Garcia, Yann Complexes and salts of the nitrogen-rich triazole‒tetrazole hybrid ligand with alkali and alkaline earth metal cations: experimental and theoretical findings New J. Chem., 2017 |
| 7052258 | CIF | C7 H5 Cl O2 | P -1 | 14.22; 6.087; 3.766 87.91; 100.22; 92.97 | 320.25 | Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman Temperature dependence of proton transfer in 4-chlorobenzoic acid New Journal of Chemistry, 2006, 30, 979 |
| 7059681 | CIF | C4 H6 Ni O6 | P 1 21/n 1 | 5.1225; 7.518; 8.6621 90; 105.242; 90 | 321.85 | Nakane, Tomohiro; Aoyagi, Shinobu; Fujita, Wataru Magnetic and thermal studies of a coordination polymer: bis(glycolato)nickel(ii) New Journal of Chemistry, 2020, 44, 10519-10524 |
| 7052259 | CIF | C7 H5 Cl O2 | P -1 | 14.209; 6.12; 3.794 88.31; 100.19; 93.03 | 324.2 | Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman Temperature dependence of proton transfer in 4-chlorobenzoic acid New Journal of Chemistry, 2006, 30, 979 |
| 7057774 | CIF | C12 H12 Cu N2 O6 | P -1 | 5.114; 7.55; 9.106 75.934; 85.21; 72.06 | 324.5 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
| 7050552 | CIF | C4 H10 N4 O2 | P 1 21/n 1 | 4.8552; 5.1714; 13.2126 90; 100.205; 90 | 326.5 | Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen Hydrogen bond patterns in aromatic and aliphatic dioximes New J. Chem., 2003, 27, 1084-1094 |
| 7052256 | CIF | C7 H5 Cl O2 | P -1 | 14.368; 6.132; 3.778 87.46; 100.5; 92.94 | 326.6 | Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman Temperature dependence of proton transfer in 4-chlorobenzoic acid New Journal of Chemistry, 2006, 30, 979 |
| 7059680 | CIF | C4 H6 Ni O6 | P 1 21/n 1 | 5.1389; 7.65; 8.618 90; 105.413; 90 | 326.61 | Nakane, Tomohiro; Aoyagi, Shinobu; Fujita, Wataru Magnetic and thermal studies of a coordination polymer: bis(glycolato)nickel(ii) New Journal of Chemistry, 2020, 44, 10519-10524 |
| 7052260 | CIF | C7 H5 Cl O2 | P -1 | 14.272; 6.141; 3.813 88.53; 100.11; 93.18 | 328.4 | Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman Temperature dependence of proton transfer in 4-chlorobenzoic acid New Journal of Chemistry, 2006, 30, 979 |
| 7062826 | CIF | C15 H20 O4 | P 1 | 7.0181; 7.1477; 7.1912 73.654; 72.829; 83.609 | 330.57 | Zhao, Peng; Xin, Ben-Song; He, Feng-Ming; Ye, Li; Ma, Zhen-Tao; Hao, Jin-Le; Shi, Rui; He, Xia-Hong; Yao, Guo-Dong; Lin, Bin; Huang, Xiao-Xiao; Song, Shao-Jiang Nine undescribed sesquiterpenoids from the aerial parts of Daphne penicillata: cyclooxygenase-2 inhibition, molecular docking, and molecular dynamics studies New Journal of Chemistry, 2023, 47, 20890-20899 |
| 7060272 | CIF | C3 H6 N4 O4 | P 1 21/m 1 | 5.7481; 5.842; 9.9504 90; 91.39; 90 | 334.04 | Gettings, Matthew L.; Byrd, Edward F. C.; Zeller, Matthias; Piercey, Davin Methyl sydnone imine and its energetic salts New Journal of Chemistry, 2021, 45, 2228-2236 |
| 7058330 | CIF | C16 H8 F4 O2 | P -1 | 6.6927; 7.6784; 7.7214 106.506; 105.114; 107.889 | 334.68 | Sharada, Durgam; Saha, Arijit; Saha, Binoy K. Charge transfer complexes as colour changing and disappearing‒reappearing colour materials New Journal of Chemistry, 2019, 43, 7562 |
| 7059362 | CIF | Cs0.36 F7 K2.64 Si | P 4/m b m | 7.768; 7.768; 5.56 90; 90; 90 | 335.5 | Huang, Shuzhao; Gao, Le; Yu, Feng K2.64Cs0.36SiF7: a new fluorosilicate with a trans-perovskite structure New Journal of Chemistry, 2020, 44, 2727-2732 |
| 7055713 | CIF | B Gd3 O3 S3 | P -1 | 3.9725; 7.5945; 11.1824 91.402; 91.093; 90.206 | 337.2 | Chi, Yang; Guo, Sheng-Ping; Kong, Hong-Jian; Xue, Huai-Guo Crystal and electronic structures, and optical and magnetic properties of novel rare-earth sulfide borates RE3S3BO3(RE = Sm, Gd) New J. Chem., 2016, 40, 6720 |
| 7051359 | CIF | C10 H24 N4 O4 | P -1 | 7.559; 4.997; 10.293 116.96; 91.55; 100.31 | 338.3 | Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms New J. Chem., 2000, 24, 959-966 |
| 7058317 | CIF | C14 H20 N2 O2 | P -1 | 5.0286; 7.66; 9.751 105.952; 95.479; 106.19 | 340.7 | Teotia, Meenu; Tarannum, Nazia; Chauhan, Mohit; Soni, Rakesh Kumar Structure-based rational design, synthesis, crystal structure, DFT and molecular docking of 1,4-benzene dicarboxamide isomers with application as hardeners New Journal of Chemistry, 2019, 43, 7972 |
| 7056954 | CIF | C12 H8 F4 N2 O6 Zn | P -1 | 6.5421; 6.9212; 8.7493 97.521; 101.906; 114.749 | 341.35 | Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study New Journal of Chemistry, 2018 |
| 7051496 | CIF | C5 H5 Br2 N | P 1 21/m 1 | 4.4705; 8.253; 9.398 90; 98.945; 90 | 342.49 | Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides New Journal of Chemistry, 1999 |
| 7059402 | CIF | Li Mg O P | P 1 21/m 1 | 4.5941; 8.419; 8.95 90; 98.307; 90 | 342.53 | Qian, Zhen; Wu, Hongping; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng Synthesis, structure and characterization of three new Mg-containing phosphates with deep-UV cut-off edges New Journal of Chemistry, 2020, 44, 6771-6777 |
| 7062548 | CIF | Bi0.75 O1.75 V0.25 | P -1 | 5.7337; 7.1029; 9.298 80.334; 78.576; 68.557 | 343.58 | Shvanskaya, Larisa; Krikunova, Polina; Nikolaeva, Irina; Lyssenko, Konstantin; Pokryshkin, Nikolay; Timoshenko, Victor Novel bismuth oxosalts, β-Bi3O3(VO4) and KBi5O5(PO4)2: synthesis and effect of hydrothermal pressure on the crystal structure New Journal of Chemistry, 2023, 47, 13911-13917 |
| 7055970 | CIF | C6 H8 N10 O10 | P -1 | 6.7135; 6.7702; 8.1378 80.267; 76.307; 74.335 | 343.82 | Tian, Jiawei; Xiong, Hualin; Lin, Qiuhan; Cheng, Guangbin; Yang, Hongwei Energetic compounds featuring bi(1,3,4-oxadiazole): a new family of insensitive energetic materials New J. Chem., 2017, 41, 1918 |
| 7058318 | CIF | C14 H18 N2 O2 | P -1 | 5.0619; 5.1565; 13.593 100.634; 96.239; 95.839 | 343.94 | Teotia, Meenu; Tarannum, Nazia; Chauhan, Mohit; Soni, Rakesh Kumar Structure-based rational design, synthesis, crystal structure, DFT and molecular docking of 1,4-benzene dicarboxamide isomers with application as hardeners New Journal of Chemistry, 2019, 43, 7972 |
| 7055443 | CIF | Al4.68 B8 La2 O22 | P -6 2 m | 4.6149; 4.6149; 18.72 90; 90; 120 | 345.27 | Guo, Shu; Liu, Lijuan; Xia, Mingjun; Wang, Xiaoyang; Bai, Lei; Xu, Bo; Huang, Qian; Chen, Chuangtian Crystal growth, structure and optical properties of a new acentric crystal La2Al4.68B8O22with a short UV absorption edge New J. Chem., 2016, 40, 4870 |
| 7059604 | CIF | C3 H3 N7 O3 | P -1 | 5.1255; 7.7153; 9.3101 99.722; 96.581; 103.924 | 347.55 | Yang, Rui; Dong, Zhen; Ye, Zhiwen Exploration of low-melting energetic compounds: influence of substituents on melting points New Journal of Chemistry, 2020, 44, 13576-13583 |
| 7062020 | CIF | Na Sc Te2 | R -3 m :H | 4.2217; 4.2217; 22.5344 90; 90; 120 | 347.82 | Panigrahi, Gopabandhu; Yadav, Sweta; Jana, Subhendu; Ghosh, Arghya; Niranjan, Manish K.; Prakash, Jai Syntheses and characterization of two new layered ternary chalcogenides NaScQ2 (Q = Se and Te) New Journal of Chemistry, 2022, 46, 22076-22087 |
| 7062526 | CIF | Ba O17 U4 | P -1 | 4.232; 8.199; 10.649 87.4; 78.53; 75.01 | 349.79 | Lu, Kimbal T.; Zhang, Yingjie; Wei, Tao; Ablott, Timothy A.; Plášil, Jakub; Karatchevtseva, Inna; Zheng, Rongkun Investigation of uranium oxide hydrates with barium(ii) ions: structural diversity, uranium valences and implications New Journal of Chemistry, 2023, 47, 13286-13296 |
| 7055094 | CIF | F2 Mg5 O8 Si2 | P 1 21/c 1 | 7.774; 4.6585; 10.254 90; 109.516; 90 | 350.02 | Zhen, Ni; Wu, Kui; Li, Qiang; Pan, Shilie; Gao, Wenhui; Yang, Zhihua Synthesis, structures, and properties of two magnesium silicate fluorides Mg5(SiO4)2F2and Mg3SiO4F2 New J. Chem., 2015, 39, 8866 |
| 7052012 | CIF | C5 H6 F N3 O3 | P 1 21/m 1 | 6.827; 6.111; 8.424 90; 90.313; 90 | 351.4 | Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L. The observed and energetically feasible crystal structures of 5-substituted uracils New Journal of Chemistry, 2008, 32, 1761 |
| 7051677 | CIF | C4 H16 N16 O4 | P -1 | 4.563; 7.362; 11.334 105.125; 90.933; 102.871 | 357.19 | Klapötke, Thomas M.; Sabaté, Carles Miró New energetic compounds based on the nitrogen-rich 5,5′-azotetrazolate anion ([C2N10]2−) New Journal of Chemistry, 2009, 33, 1605 |
| 7057339 | CIF | H16 N4 Ni O16 Pt | P 1 | 5.9377; 7.7854; 8.7147 110.031; 104.303; 96.242 | 358.39 | Zadesenets, Andrey V.; Filatov, Evgeniy Yu.; Plyusnin, Pavel E.; Asanova, Tatyana I.; Korolkov, Ilya V.; Baidina, Iraida A.; Shlyakhova, Elena V.; Asanov, Igor P.; Korenev, Sergey V. Complex salts of Pd(ii) and Pt(ii) with Co(ii) and Ni(ii) aqua-cations as single-source precursors for bimetallic nanoalloys and mixed oxides New Journal of Chemistry, 2018, 42, 8843 |
| 7061270 | CIF | Cu H10 O9 S | P -1 | 5.9676; 6.0957; 10.6366 77.224; 82.387; 72.434 | 358.85 | Ibrahim, Mukaila A.; Boeré, René T. The copper sulfate hydration cycle. Crystal structures of CuSO4 (Chalcocyanite), CuSO4·H2O (Poitevinite), CuSO4·3H2O (Bonattite) and CuSO4·5H2O (Chalcanthite) at low temperature using non-spherical atomic scattering factors New Journal of Chemistry, 2022, 46, 5479-5488 |
| 7057340 | CIF | Co H16 N4 O16 Pt | P 1 | 5.9125; 7.8201; 8.7149 110.076; 103.908; 96.272 | 359.15 | Zadesenets, Andrey V.; Filatov, Evgeniy Yu.; Plyusnin, Pavel E.; Asanova, Tatyana I.; Korolkov, Ilya V.; Baidina, Iraida A.; Shlyakhova, Elena V.; Asanov, Igor P.; Korenev, Sergey V. Complex salts of Pd(ii) and Pt(ii) with Co(ii) and Ni(ii) aqua-cations as single-source precursors for bimetallic nanoalloys and mixed oxides New Journal of Chemistry, 2018, 42, 8843 |
| 7050579 | CIF | B2 H4 O4 | P 1 21/c 1 | 7.409; 7.666; 7.0421 90; 116.04; 90 | 359.37 | Baber, R. Angharad; Norman, Nicholas C.; Orpen, A. Guy; Rossi, Jean The solid-state structure of diboronic acid, B2(OH)4 New Journal of Chemistry, 2003, 27, 773 |
| 9016429 | CIF | B H2 O2 | P 1 21/c 1 | 7.409; 7.666; 7.0421 90; 116.04; 90 | 359.371 | Baber, R. A.; Norman, N. C.; Orpen, A. G.; Rossi, J. The solid-state structure of diboronic acid, B2(OH)4 New Journal of Chemistry, 2003, 27, 772-775 |
| 7058327 | CIF | C16 H14 F4 O2 | P -1 | 6.6907; 6.9985; 8.7933 110.856; 105.889; 96.533 | 359.7 | Sharada, Durgam; Saha, Arijit; Saha, Binoy K. Charge transfer complexes as colour changing and disappearing‒reappearing colour materials New Journal of Chemistry, 2019, 43, 7562 |
| 7061910 | CIF | C5 H4 Br N3 O2 | P 1 21 1 | 4.26356; 5.3334; 15.8471 90; 93.394; 90 | 359.72 | Ghosh, Priyanka; Panda, Subhra Jyoti; Purohit, Chandra Shekhar A new short synthesis route for favipiravir and its analogue: Their tautomerization behaviour New Journal of Chemistry, 2022, 46, 18824-18831 |
| 7057341 | CIF | H16 N4 Ni O16 Pd | P 1 | 5.9834; 7.8788; 8.6406 110.211; 105.344; 95.988 | 359.9 | Zadesenets, Andrey V.; Filatov, Evgeniy Yu.; Plyusnin, Pavel E.; Asanova, Tatyana I.; Korolkov, Ilya V.; Baidina, Iraida A.; Shlyakhova, Elena V.; Asanov, Igor P.; Korenev, Sergey V. Complex salts of Pd(ii) and Pt(ii) with Co(ii) and Ni(ii) aqua-cations as single-source precursors for bimetallic nanoalloys and mixed oxides New Journal of Chemistry, 2018, 42, 8843 |
| 7051360 | CIF | C10 H22 Br2 N4 O2 | P -1 | 5.2851; 8.0718; 9.5424 109.126; 104.189; 97.989 | 362.03 | Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms New J. Chem., 2000, 24, 959-966 |
| 7060242 | CIF | C4 H17 N5 O12 Zn | P -1 | 7.0956; 7.2718; 7.8386 64.685; 84.284; 86.291 | 363.69 | Lemes, Maykon Alves; do Nascimento Neto, José Antônio; Fernandes Guimarães, Freddy; Maia, Lauro June Queiroz; de Santana, Ricardo Costa; Terra Martins, Felipe Secondary ligands and the intramolecular hydrogen bonds drive photoluminescence quantum yields from aminopyrazine coordination polymers New Journal of Chemistry, 2020, 44, 20259-20266 |
| 7050422 | CIF | C10 H5 F | P 1 21/c 1 | 3.878; 5.947; 15.8 90; 93.46; 90 | 363.72 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
| 7057342 | CIF | Co H16 N4 O16 Pd | P 1 | 6.0051; 7.8865; 8.6872 110.055; 105.1; 96.203 | 364.18 | Zadesenets, Andrey V.; Filatov, Evgeniy Yu.; Plyusnin, Pavel E.; Asanova, Tatyana I.; Korolkov, Ilya V.; Baidina, Iraida A.; Shlyakhova, Elena V.; Asanov, Igor P.; Korenev, Sergey V. Complex salts of Pd(ii) and Pt(ii) with Co(ii) and Ni(ii) aqua-cations as single-source precursors for bimetallic nanoalloys and mixed oxides New Journal of Chemistry, 2018, 42, 8843 |
| 7050462 | CIF | C7 H5 N O5 | P -1 | 5.201; 8.8753; 9.2841 62.449; 75.388; 81.657 | 367.47 | Senthil Kumar, V. S.; Nangia, Ashwini; Kirchner, Michael T.; Boese, Roland Supramolecular synthesis of brick wall and honeycomb networks from the T-shaped molecule 5-nitrosalicylic acid New Journal of Chemistry, 2003, 27, 224 |
| 7050423 | CIF | C10 H4 F2 | P 1 21/c 1 | 3.8535; 5.906; 16.221 90; 95.23; 90 | 367.63 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
| 7055524 | CIF | C12 H12 N2 O8 U | P -1 | 5.6911; 7.4024; 9.8667 106.561; 105.897; 99.948 | 368.73 | Gao, Xue; Song, Jian; Sun, Li Xian; Xing, Yong Heng; Bai, Feng Ying; Shi, Zhan A family of uranium‒carboxylic acid hybrid materials: synthesis, structure and mixed-dye selective adsorption New J. Chem., 2016, 40, 6077 |
| 7052072 | CIF | C7 H6 B F O3 | P -1 | 7.2136; 7.6191; 8.101 102.96; 106.797; 111.387 | 368.76 | Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles New Journal of Chemistry, 2007, 31, 144 |
| 7061152 | CIF | C5 H7 N3 O4 | P -1 | 4.8238; 7.3029; 11.0533 76.643; 78.988; 87.455 | 371.87 | Zhang, Qi; Zhao, Cheng; Zhang, Xun; He, Chunlin; Pang, Siping Oxidation of o-dioxime by (diacetoxyiodo)benzene: green and mild access to furoxans New Journal of Chemistry, 2022, 46, 1489-1493 |
| 7058294 | CIF | C10 H22 Cu2 N2 O6 | P -1 | 4.6397; 8.8879; 10.1789 114.963; 97.981; 92.26 | 374.6 | Ahamad, M. Naqi; Shahid, M.; Ansari, Azaj; Kumar, Manjeet; Khan, Ishaat M.; Ahmad, Musheer; Rahisuddin, Rahisuddin; Arif, Rizwan A combined experimental and theoretical approach to investigate the structure, magnetic properties and DNA binding affinity of a homodinuclear Cu(ii) complex New Journal of Chemistry, 2019, 43, 7511 |
| 7055885 | CIF | C14 H10 N4 O6 Zn | P -1 | 5.019; 6.4793; 12.6014 91.545; 99.276; 110.23 | 377.97 | Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study New J. Chem., 2017, 41, 735 |
| 7052107 | CIF | C5 H9 N3 O4 | P 1 21/m 1 | 3.696; 18.824; 5.496 90; 94.76; 90 | 381.1 | Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates New Journal of Chemistry, 2007, 31, 287 |
| 7056845 | CIF | C2 H3 N3 O2 | C 1 c 1 | 9.386; 3.5384; 12.154 90; 109.139; 90 | 381.34 | Kumar, A. Sudheer; Sasidharan, Nimesh; Ganguly, Rakesh; Leow, Dasheng; Hng, Huey Hoon 3-Amino-1,2,4(4H)-oxadiazol-5-one (AOD) and its nitrogen-rich salts: a class of insensitive energetic materials New Journal of Chemistry, 2018, 42, 1840 |
| 7059794 | CIF | C5 H6 Cu I N2 O | P -1 | 4.1928; 8.2514; 11.4846 84.065; 89.98; 76.69 | 384.47 | Xu, Chanchan; Lv, Le; Luo, Dawei; Liu, Wei Synthesis, structure and photoluminescence properties of three copper(i) iodide based inorganic‒organic hybrid structures with pyrazine derivatives New Journal of Chemistry, 2020, 44, 14103-14107 |
| 7062804 | CIF | C9 H7 F N2 O | P -1 | 4.2581; 8.4237; 10.9697 94.118; 98.142; 94.746 | 386.776 | Ramkumar, Nagarajan; Plantus, Ketrina; Ozola, Melita; Mishnev, Anatoly; Nikolajeva, Vizma; Senkovs, Maris; Ošeka, Maksim; Veliks, Janis Photoredox-catalyzed direct C–H monofluoromethylation of heteroarenes New Journal of Chemistry, 2023, 47, 20642-20652 |
| 7051608 | CIF | C14 H4 N6 S4 | P -1 | 6.0656; 7.8452; 8.6868 86.475; 75.29; 75.507 | 387.1 | Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K. Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer New Journal of Chemistry, 2009, 33, 545 |
| 7051805 | CIF | C3 H5 N7 O5 | P 1 21 1 | 7.6156; 4.9837; 10.3119 90; 95.53; 90 | 389.55 | Ye, Chengfeng; Gao, Haixiang; Twamley, Brendan; Shreeve, Jean’ne M. Dense energetic salts of N,N′-dinitrourea (DNU) New Journal of Chemistry, 2008, 32, 317 |
| 7051226 | CIF | C6 O6 Rb2 | C 1 2/m 1 | 12.522; 8.354; 3.761 90; 96.93; 90 | 390.6 | Braga, Dario; Cojazzi, Gianna; Maini, Lucia; Grepioni, Fabrizia Reversible solid-state interconversion of rhodizonic acid H2C6O6 into H6C6O8 and the solid-state structure of the rhodizonate dianion C6O62‒ (aromatic or non-aromatic?) New Journal of Chemistry, 2001, 25, 1221 |
| 7052926 | CIF | C2 H4 N12 | P 1 21/n 1 | 6.485; 5.583; 10.854 90; 90.786; 90 | 392.9 | Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao 1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound New Journal of Chemistry, 2012, 36, 1953 |
| 7060927 | CIF | Ba Cl N O3 | P n m a | 8.9108; 5.2991; 8.3414 90; 90; 90 | 393.87 | Chen, Zhen; Zeng, Hao; Han, Shujuan; Yang, Zhihua; Pan, Shilie From BaCl2 to Ba(NO3)Cl: significantly enhanced birefringence derived from π-conjugated [NO3] New Journal of Chemistry, 2021, 45, 17544-17550 |
| 7060198 | CIF | C5 H5 B N3 Na O | P -1 | 7.3884; 7.7824; 8.0923 82.094; 71.472; 63.968 | 396.426 | Schopper, Nils; Sprenger, Jan A. P.; Zapf, Ludwig; Reiss, Guido J.; Ignat’ev, Nikolai V.; Finze, Maik Alkoxycyanoborates: metal salts and low-viscosity ionic liquids New Journal of Chemistry, 2021, 45, 14973-14987 |
| 7051329 | CIF | C4 H14 Br N3 | P -4 21 m | 8.6698; 8.6698; 5.2977 90; 90; 90 | 398.2 | New Journal of Chemistry, 2000 |
| 7050424 | CIF | C10 H2 F4 | P 1 21/a 1 | 5.7642; 11.4632; 6.112 90; 99.27; 90 | 398.58 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
| 7061414 | CIF | C4 H11 N3 O4 | P -1 | 6.3021; 7.696; 9.4542 68.842; 87.792; 70.083 | 400.18 | Liu, Tingting; Lan, Youshi; Liu, Qian; Ma, Fuqiu; Xue, Yun; Yang, Suliang; Tian, Guoxin Complexation of uranyl(vi) with succinimidedioxime in comparison with glutarimidedioxime New Journal of Chemistry, 2022, 46, 8053-8061 |
| 7057546 | CIF | B3 Ba Li O9 Zn3 | P 1 2/c 1 | 6.583; 4.933; 12.34 90; 90.968; 90 | 400.7 | Chen, Yanna; Zhang, Min; Pan, Shilie BaLiZn3(BO3)3: a new member of the KBe2BO3F2 family possessing dense BO3 triangles and the smallest interlayer distance New Journal of Chemistry, 2018, 42, 12365 |
| 7057460 | CIF | C6 H4 B F3 N2 Se | P -1 | 6.2428; 8.2197; 8.6827 98.535; 107.446; 103.743 | 401.12 | Lee, Jiwon; Lee, Lucia Myongwon; Arnott, Zachary; Jenkins, Hilary; Britten, James F.; Vargas-Baca, Ignacio Sigma-hole interactions in the molecular and crystal structures of N-boryl benzo-2,1,3-selenadiazoles New Journal of Chemistry, 2018, 42, 10555 |
| 7056615 | CIF | C12 H10.4 Fe N8 O1.2 Pt | P 1 2/m 1 | 7.2727; 7.4681; 7.4416 90; 95.939; 90 | 402.008 | Polyzou, Christina D.; Lalioti, Nikolia; Psycharis, Vassilis; Tangoulis, Vassilis Guest Induced Hysteretic Tristability in 3D Pillared Hofmann-type Microporous Metal-Organic Framework New J. Chem., 2017 |
| 7056616 | CIF | C12 H10.4 Fe N8 O1.2 Pd | P 1 2/m 1 | 7.28; 7.47; 7.4387 90; 95.88; 90 | 402.4 | Polyzou, Christina D.; Lalioti, Nikolia; Psycharis, Vassilis; Tangoulis, Vassilis Guest Induced Hysteretic Tristability in 3D Pillared Hofmann-type Microporous Metal-Organic Framework New J. Chem., 2017 |
| 7051604 | CIF | C H N5 O2 | P 1 21 1 | 5.3358; 9.4799; 8.319 90; 106.989; 90 | 402.44 | Klapötke, Thomas M.; Sabaté, Carles Miró; Stierstorfer, Jörg Neutral 5-nitrotetrazoles: easy initiation with low pollution New Journal of Chemistry, 2009, 33, 136 |
| 7051153 | CIF | C2 H2 Cl N3 | P c a 21 | 10.849; 3.7618; 9.863 90; 90; 90 | 402.5 | Claramunt, Rosa M.; Lopez, Concepcion; Garcia, M. Angeles; Otero, M. Dolores; Torres, M. Rosario; Pinilla, Elena; Alarcon, Sergio H.; AlKorta, Ibon; Elguero, Jose The structure of halogeno-1,2,4-triazoles in the solid state and in solution. New Journal of Chemistry, 2001 |
| 1000191 | CIF | Ag0.5 Cr0.5 P S3 | P 1 2/a 1 | 5.892; 10.632; 6.745 90; 105.88; 90 | 406.4 | Colombet, P; Leblanc, A; Danot, M; Rouxel, J Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~ Nouveau Journal de Chimie, 1983, 7, 333-338 |
| 1000192 | CIF | Ag0.5 Cr0.5 P S3 | P 1 2/a 1 | 5.892; 10.632; 6.745 90; 105.88; 90 | 406.4 | Colombet, P; Leblanc, A; Danot, M; Rouxel, J Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~ Nouveau Journal de Chimie, 1983, 7, 333-338 |
| 7055154 | CIF | C8 H22 N8 Ni O10 | P -1 | 6.881; 7.283; 9.541 105.601; 102.526; 109.834 | 407.4 | Selvakumar, Rajendran; Geib, Steven J.; Premkumar, Thathan; Vairam, Sundararajan; Govindarajan, Subbiah Isomorphic metal malonates with N-aminoguanidine: MCo2O4(M = Ni & Zn) nanoparticle synthesis via a (AmgH)2[M1/3Co2/3(mal)2(H2O)2] precursor solid solution New J. Chem., 2016, 40, 257 |
| 7062806 | CIF | C9 H6 Cl F N2 | P -1 | 6.7276; 7.3697; 9.4118 72.213; 73.348; 69.557 | 407.8 | Ramkumar, Nagarajan; Plantus, Ketrina; Ozola, Melita; Mishnev, Anatoly; Nikolajeva, Vizma; Senkovs, Maris; Ošeka, Maksim; Veliks, Janis Photoredox-catalyzed direct C–H monofluoromethylation of heteroarenes New Journal of Chemistry, 2023, 47, 20642-20652 |
| 7061377 | CIF | C5 H6 N4 O7 | P 1 21 1 | 7.2036; 7.0213; 8.3381 90; 104.364; 90 | 408.55 | Wang, Qian; Lu, Ming Carbon skeleton: route to investigate high-performance insensitive energetic materials New Journal of Chemistry, 2022, 46, 6690-6693 |
| 7061376 | CIF | C5 H5 N3 O7 | C 1 2 1 | 7.259; 7.067; 8.126 90; 101.221; 90 | 408.9 | Wang, Qian; Lu, Ming Carbon skeleton: route to investigate high-performance insensitive energetic materials New Journal of Chemistry, 2022, 46, 6690-6693 |
| 7054445 | CIF | C8 H11 N O3 | P -1 | 6.2079; 7.7139; 8.6278 82.686; 88.718; 89.279 | 409.68 | Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J. Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy New J. Chem., 2014, 38, 5905 |
| 7061190 | CIF | C3 K0.5 N8 O Rb1.5 | P -1 | 4.4887; 7.571; 12.714 97.31; 92.74; 106.32 | 409.7 | Li, Haibo; Wang, Yanna; Wei, Zhenghe; Xia, Lianghong; Li, Zhimin; Zhang, Tonglai Alkaline metal and alkaline earth metal salts of di(1H-tetrazol-5-yl)methanone (DTO): energetic catalysts for ammonium perchlorate decomposition New Journal of Chemistry, 2022, 46, 4462-4469 |
| 7055155 | CIF | C8 H22 Co0.5 N8 Ni0.5 O10 | P -1 | 6.9096; 7.3355; 9.5299 105.577; 102.494; 110.156 | 410.52 | Selvakumar, Rajendran; Geib, Steven J.; Premkumar, Thathan; Vairam, Sundararajan; Govindarajan, Subbiah Isomorphic metal malonates with N-aminoguanidine: MCo2O4(M = Ni & Zn) nanoparticle synthesis via a (AmgH)2[M1/3Co2/3(mal)2(H2O)2] precursor solid solution New J. Chem., 2016, 40, 257 |
| 7053722 | CIF | C6 H5 Cl N6 | P 1 c 1 | 4.2896; 5.4645; 17.528 90; 91.449; 90 | 410.73 | Casarin, Maurizio; Garau, Federica; Monari, Magda; Pandolfo, Luciano; Pettinari, Claudio; Venzo, Alfonso An experimental and theoretical investigation of the molecular and electronic structure of 2-amino-4-chloro-6-pyrazolyl-[1,3,5]triazine, forming supramolecular linear tapes in the solid state New Journal of Chemistry, 2008, 32, 358 |
| 7055153 | CIF | C8 H22 Co N8 O10 | P -1 | 6.9244; 7.3583; 9.5353 105.537; 102.545; 110.219 | 412.65 | Selvakumar, Rajendran; Geib, Steven J.; Premkumar, Thathan; Vairam, Sundararajan; Govindarajan, Subbiah Isomorphic metal malonates with N-aminoguanidine: MCo2O4(M = Ni & Zn) nanoparticle synthesis via a (AmgH)2[M1/3Co2/3(mal)2(H2O)2] precursor solid solution New J. Chem., 2016, 40, 257 |
| 7054472 | CIF | C9 H8 N4 | P 1 21 1 | 7.3136; 4.5404; 12.823 90; 103.9; 90 | 413.34 | Goswami, Shyamaprosad; Chakraborty, Shampa; Adak, Monoj Kumar; Halder, Sandipan; Quah, Ching Kheng; Fun, Hoong-Kun; Pakhira, Bholanath; Sarkar, Sabyasachi A highly selective ratiometric chemosensor for Ni2+in a quinoxaline matrix New J. Chem., 2014, 38, 6230 |
| 7060196 | CIF | C4 H5 B N3 Na O2 | P -1 | 6.2298; 8.0256; 8.9101 105.478; 101.298; 97.248 | 413.44 | Schopper, Nils; Sprenger, Jan A. P.; Zapf, Ludwig; Reiss, Guido J.; Ignat’ev, Nikolai V.; Finze, Maik Alkoxycyanoborates: metal salts and low-viscosity ionic liquids New Journal of Chemistry, 2021, 45, 14973-14987 |
| 7052664 | CIF | C12 H30 N4 O4 | P -1 | 5.1899; 7.4045; 11.2621 99.469; 96.754; 101.269 | 413.61 | Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M. Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes New Journal of Chemistry, 2011, 35, 1515 |
| 7055095 | CIF | F2 Mg3 O4 Si | P n m a | 10.268; 8.694; 4.65 90; 90; 90 | 415.1 | Zhen, Ni; Wu, Kui; Li, Qiang; Pan, Shilie; Gao, Wenhui; Yang, Zhihua Synthesis, structures, and properties of two magnesium silicate fluorides Mg5(SiO4)2F2and Mg3SiO4F2 New J. Chem., 2015, 39, 8866 |
| 7059796 | CIF | C6 H8 Cu I N2 | P -1 | 7.749; 7.7769; 8.1453 72.597; 66.733; 70.721 | 417.52 | Xu, Chanchan; Lv, Le; Luo, Dawei; Liu, Wei Synthesis, structure and photoluminescence properties of three copper(i) iodide based inorganic‒organic hybrid structures with pyrazine derivatives New Journal of Chemistry, 2020, 44, 14103-14107 |
| 7062379 | CIF | B6 O12 Sr Zn2 | P -1 | 6.5206; 6.5408; 11.4026 79.29; 83.151; 61.048 | 417.89 | Long, Xiangyu; Lv, Yan; Wu, Xueyan Discovery of SrZn2B6O12 with an unprecedented quadruple-layered configuration New Journal of Chemistry, 2023, 47, 6041-6044 |
| 7054439 | CIF | C8 H13 N O3 | P -1 | 5.2735; 8.6164; 9.3766 97.6974; 93.5064; 95.8677 | 418.8 | Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J. Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy New J. Chem., 2014, 38, 5905 |
| 7050959 | CIF | C8 H14 O4 | P 1 21/n 1 | 5.687; 11.0509; 6.8521 90; 102.624; 90 | 420.22 | Chen, Wang; Lam, Yu-Lin; Wong, Ming Wah; Huang, Hsing Hua; Liang, Eping Gauche/trans equilibria of 2,2'-bi-1,3-dioxolanyl, 2,2'-dimethyl-2,2'-bi-1,3-dioxolanyl, 2,2'-bi-1,3-dithiolanyl and 2,2'-dimethyl-2,2'-bi-1,3-dithiolanyl in different media–theory and experiment New Journal of Chemistry, 2002, 26, 1686-1692 |
| 7061215 | CIF | C7 H6 N2 O S Se | P -1 | 6.6599; 7.4329; 8.7949 87.367; 75.419; 87.06 | 420.55 | Makarov, Alexander Yu.; Volkova, Yulia M.; Zikirin, Samat B.; Irtegova, Irina G.; Bagryanskaya, Irina Yu.; Gatilov, Yuri V.; Nefedov, Andrey A.; Zibarev, Andrey V. New 3,1,2,4-benzothiaselenadiazines, related π-heterocycles including Herz cations, radicals and molecular complexes, and Bunte salts New Journal of Chemistry, 2022, 46, 3687-3696 |
| 7055518 | CIF | C4 H6 N6 O5 | P 1 21 1 | 6.761; 5.5064; 11.3925 90; 97.072; 90 | 420.9 | Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines New J. Chem., 2016, 40, 6059 |
| 7052196 | CIF | C6 H11 N3 O3 | P 3 c 1 | 8.25; 8.25; 7.15 90; 90; 120 | 421.45 | Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study New Journal of Chemistry, 2007, 31, 1935 |
| 7050083 | CIF | C3 H7 N O2 | P 21 21 21 | 5.942; 12.261; 5.785 90; 90; 90 | 421.5 | Wilson, Chick C.; Myles, Dean; Ghosh, Minakshi; Johnson, Louise N.; Wang, Wenging Neutron diffraction investigations of l- and d-alanine at different temperatures: the search for structural evidence for parity violation New Journal of Chemistry, 2005, 29, 1318 |
| 7062386 | CIF | H4 Li2 N O8 Rb S2 | P n a 21 | 8.751; 9.112; 5.291 90; 90; 90 | 421.9 | Xu, Junxin; Sha, Hongyuan; Shang, Yanran; Wang, Zujian; Su, Rongbing; He, Chao; Yang, Xiaoming; Long, Xifa Tetrahedron-based deep-ultraviolet nonlinear optical crystal with optimized KBe2BO3F2-like structure and disordered cations New Journal of Chemistry, 2023, 47, 7521-7526 |
| 7050084 | CIF | C3 H7 N O2 | P 21 21 21 | 5.94; 12.274; 5.806 90; 90; 90 | 423.3 | Wilson, Chick C.; Myles, Dean; Ghosh, Minakshi; Johnson, Louise N.; Wang, Wenging Neutron diffraction investigations of l- and d-alanine at different temperatures: the search for structural evidence for parity violation New Journal of Chemistry, 2005, 29, 1318 |
| 7050964 | CIF | C8 H24 F6 N7 Ni P | P -1 | 6.385; 8.841; 9.102 116.77; 91.86; 109.07 | 424 | Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia; Helen Stoeckli-Evans Four new NiII antiferromagnetic complexes with azido bridges New J. Chem., 2002, 26, 1601-1606 |
| 7054438 | CIF | B3 Cd4 O10 Yb | C 1 m 1 | 7.938; 15.794; 3.4414 90; 99.992; 90 | 424.9 | Zou, Guohong; Huang, Ling; Cai, Huaqiang; Wang, Shichao; Ye, Ning Synthesis and characterization of Cd4YbO(BO3)3‒ a congruent melting cadmium‒ytterbium oxyborate with large nonlinear optical properties New J. Chem., 2014, 38, 6186 |
| 7053286 | CIF | C6 H18 Mg N4 O12 S2 | P -1 | 7.0543; 7.7307; 8.6389 72.572; 74.37; 76.045 | 426.22 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
| 7060770 | CIF | Na4 S4 Sn | P -4 21 c | 7.8419; 7.8419; 6.9522 90; 90; 90 | 427.53 | Gao, Lihua; Bian, Gang; Yang, Ya; Zhang, Bingbing; Wu, Xiaowen; Wu, Kui Na4SnS4 and Na4SnSe4 exhibiting multifunctional physicochemical performances as potential infrared nonlinear optical crystals and sodium ion conductors New Journal of Chemistry, 2021, 45, 12362-12366 |
| 7050550 | CIF | C8 H10 N4 O2 | P 1 21/c 1 | 8.401; 4.985; 10.714 90; 107.41; 90 | 428.1 | Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen Hydrogen bond patterns in aromatic and aliphatic dioximes New J. Chem., 2003, 27, 1084-1094 |
| 7052108 | CIF | C6 H13 N3 O4 | P -1 | 5.284; 8.501; 10.466 69.1; 77.91; 89.42 | 428.4 | Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates New Journal of Chemistry, 2007, 31, 287 |
| 7055511 | CIF | C4 H7 N7 O4 | P -1 | 6.3027; 6.8628; 10.6253 72.876; 87.968; 77.54 | 428.68 | Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines New J. Chem., 2016, 40, 6059 |
| 7050081 | CIF | C3 H7 N O2 | P 21 21 21 | 6.036; 12.342; 5.788 90; 90; 90 | 431.18 | C. Wilson; Minakshi Ghosh; L. Johnson; Dean Myles; Wenging Wang. Neutron diffraction investigations of L- and D-alanine at different temperatures: The search for structural evidence for parity violation New J.Chem.(Nouv.J.Chim.), 2005 |
| 7050082 | CIF | C3 H7 N O2 | P 21 21 21 | 6.043; 12.337; 5.784 90; 90; 90 | 431.21 | C. Wilson; Minakshi Ghosh; L. Johnson; Dean Myles; Wenging Wang. Neutron diffraction investigations of L- and D-alanine at different temperatures: The search for structural evidence for parity violation New J.Chem.(Nouv.J.Chim.), 2005 |
| 7062228 | CIF | C12 H20 Mg N2 O12 | P -1 | 7.5814; 7.6005; 7.6221 88.9529; 80.0769; 88.2066 | 432.38 | Balakrishnan, Prabha Devi; Arunadevi, Natarajan; Rath, Nigam P.; Kanchana, Ponnusamy; Premkumar, Thathan A one-pot solid-state synthesis of MgO nanoparticles and their catalytic, biological, and electrochemical sensor activities: hexaaquamagnesium(ii) bis(6-oxo-1,6-dihydropyridine-3-carboxylate) as a tool New Journal of Chemistry, 2023, 47, 3880-3891 |
| 7062433 | CIF | C10 H14 Cu3 N4 O14 | P -1 | 5.1649; 6.8991; 12.568 96.615; 94.583; 102.134 | 432.41 | Klongdee, Fatima; Sasada, Yuto; Nakano, Motohiro; Chainok, Kittipong; Youngme, Sujittra; Boonmak, Jaursup Synthesis, X-ray structures, and magnetic properties of seven polynuclear Cu(ii) complexes containing pyrazole-3,5-dicarboxylate with various ancillary ligands New Journal of Chemistry, 2023, 47, 9669-9680 |
| 7062810 | CIF | B2 Mg3.17 Ni6.83 | R -3 m :H | 4.9496; 4.9496; 20.48 90; 90; 120 | 434.511 | Zhang, Weidong; Zhou, Juanfang; Zhang, Chao; Liu, Xinliang Aggregation-induced emission and reversible mechanoresponsive behavior of boryl substituted phenothiazine New Journal of Chemistry, 2023, 47, 20510-20516 |
| 7058774 | CIF | C4 H6 F2 N4 O6 | P -1 | 5.7184; 8.2861; 9.6182 100.379; 103.018; 92.979 | 434.72 | Chen, Jifeng; Yu, Yi; Zhang, Shujuan; Li, Yuchuan; Pang, Siping Energetic materials with fluorinated four-membered heterocyclic ring: 3,3′-difluoroazetidine (DFAZ) salts New Journal of Chemistry, 2019, 43, 15115 |
| 7061962 | CIF | C4 H12 N2 O6 S | P -1 | 5.7797; 6.3309; 12.8187 76.647; 78.32; 74.621 | 435.01 | Lesnikov, Vladislav K.; Nelyubina, Yulia V.; Sukhorukov, Alexey Yu. Piperazine-1,4-diol (PipzDiol): synthesis, stereodynamics and assembly of supramolecular hydrogen-bonded 2D networks New Journal of Chemistry, 2022, 46, 20386-20394 |
| 7062788 | CIF | C21 H25 N O3 | P 1 | 5.8887; 8.3187; 9.4843 108.948; 94.92; 93.497 | 435.86 | Shukla, Jyoti; Gangwar, Manoj Kumar; Koley, Dipankar Total synthesis of (−)-δ-lycorane New Journal of Chemistry, 2023, 47, 18900-18904 |
| 7058496 | CIF | C18 H18 N8 Pd | P -1 | 4.5732; 9.8193; 10.5527 71.2; 86.444; 76.934 | 436.95 | Zakharchenko, Borys V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Raspertova, Ilona V.; Starova, Viktoriia S.; Trachevsky, Volodymyr V.; Shova, Sergiu; Severynovska, Olga V.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.; Arion, Vladimir B.; Lampeka, Rostyslav D. New palladium(ii) complexes with 3-(2-pyridyl)-5-alkyl-1,2,4-triazole ligands as recyclable C‒C coupling catalysts New Journal of Chemistry, 2019, 43, 10973 |
| 7055972 | CIF | C10 H8 N14 O10 | P -1 | 7.6518; 7.7243; 9.0083 95.49; 106.941; 117.039 | 437.09 | Tian, Jiawei; Xiong, Hualin; Lin, Qiuhan; Cheng, Guangbin; Yang, Hongwei Energetic compounds featuring bi(1,3,4-oxadiazole): a new family of insensitive energetic materials New J. Chem., 2017, 41, 1918 |
| 7062914 | CIF | C4 H3 N9 O5 | P 1 21 1 | 8.078; 6.215; 8.92 90; 102.188; 90 | 437.7 | Li, Jingwen; Zhang, Xun; Wang, Yaxi; Su, Dongshuai; Pang, Siping; He, Chunlin Towards improved comprehensive energetic properties by skeleton modification New Journal of Chemistry, 2024, 48, 1067-1070 |
| 7050458 | CIF | C Cl2 O S | P 1 21/c 1 | 6.034; 10.311; 7.226 90; 99.72; 90 | 443.1 | Romano, Rosana M.; Della Védova, Carlos O.; Downs, Anthony J.; Parsons, Simon; Smith, Caroline Structural and vibrational properties of ClC(O)SY compounds with Y = Cl and CH3 New Journal of Chemistry, 2003, 27, 514 |
| 7055225 | CIF | B3 Cd4 Nd O10 | C 1 m 1 | 8.0536; 15.872; 3.5364 90; 100.268; 90 | 444.81 | Wang, Xing; Xia, Mingjun; Li, R. K. Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties New J. Chem., 2016, 40, 2057 |
| 7052294 | CIF | C14 H14 B2 N2 O12 Pt | P -1 | 3.659; 10.172; 12.576 103.24; 96.89; 98.1 | 445.42 | Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J. Pyridinium boronic acid salts in crystal synthesis New Journal of Chemistry, 2006, 30, 1461 |
| 7055831 | CIF | Eu S3 Zr | P n m a | 8.465; 3.8075; 13.823 90; 90; 90 | 445.5 | Guo, Sheng-Ping; Chi, Yang; Zou, Jian-Ping; Xue, Huai-Guo Crystal and electronic structures, and photoluminescence and photocatalytic properties of α-EuZrS3 New J. Chem., 2016, 40, 10219 |
| 7050316 | CIF | C7 H9 Co N O7 | P -1 | 7.1111; 7.8561; 9.031 75.614; 68.57; 76.107 | 448.63 | Jingyang Niu; Dong-jie Guo; Jingping Wang; Jun-wei Zhao Controlled assembly of polyoxometalate-based composite materials containing zero- and one-dimensional structures New J.Chem.(Nouv.J.Chim.), 2004, 28, 980-987 |
| 7052511 | CIF | C7 H9 Co N O7 | P -1 | 7.1111; 7.8561; 9.031 75.614; 68.57; 76.107 | 448.63 | Zhou, You-Fu; Yuan, Da-Qiang; Wu, Ben-Lai; Wang, Rui-Hu; Hong, Mao-Chun Design of metal-organic NLO materials: complexes derived from pyridine-3,4-dicarboxylate New Journal of Chemistry, 2004, 28, 1590 |
| 7052290 | CIF | C14 H14 B2 N2 O12 Pt | P -1 | 3.6754; 10.5135; 12.215 102.091; 96.403; 98.557 | 451.4 | Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J. Pyridinium boronic acid salts in crystal synthesis New Journal of Chemistry, 2006, 30, 1461 |
| 7061850 | CIF | C10 H6 Cl2 Cu I4 N2 | P -1 | 6.679; 8.508; 8.869 70.54; 72.42; 88.46 | 451.5 | Alwahsh, Manal I.; Awwadi, Firas F.; Kailani, Mohammed H. Polymorphism and isomorphism in trans-bis(2,5-diiodopyridine)dihalocopper(ii) complexes: theoretical and crystallographic studies New Journal of Chemistry, 2022, 46, 19024-19035 |
| 7058577 | CIF | B4 H6 K2 O10 | P -1 | 7.1689; 7.8464; 8.9736 68.583; 88.338; 74.86 | 452.36 | Shi, Tingting; Zhang, Fangfang; Tudi, Abudukadi; Yang, Zhihua; Pan, Shilie K2[B4O5(OH)4]·H2O and K2[B4O5(OH)4]: two new hydrated potassium borates with isolated [B4O5(OH)4]2− units and different structural frameworks New Journal of Chemistry, 2019, 43, 11660 |
| 7059452 | CIF | C10 H8 N2 Se | P -1 | 5.7164; 8.4317; 10.384 105.276; 105.188; 98.713 | 452.69 | Chaudhari, K. R.; Kunwar, A.; Bhuvanesh, N.; Dey, S. Synthesis and anti-proliferative activities of amine capped Pd and Pt macrocycles of 4,4′-dipyridylselenides New Journal of Chemistry, 2020, 44, 7329-7337 |
| 7063166 | CIF | C8 H15 N3 O | P 1 21 1 | 4.9628; 12.4177; 7.5022 90; 100.98; 90 | 453.871 | Podjed, Nina; Košmrlj, Janez; Modec, Barbara Piperidine and piperazine analogs in action: zinc(II)-mediated formation of amidines New Journal of Chemistry, 2024 |
| 7061849 | CIF | C10 H6 Br2 Cu I4 N2 | P -1 | 6.6977; 8.5845; 8.6691 71.645; 74.675; 89.946 | 454.41 | Alwahsh, Manal I.; Awwadi, Firas F.; Kailani, Mohammed H. Polymorphism and isomorphism in trans-bis(2,5-diiodopyridine)dihalocopper(ii) complexes: theoretical and crystallographic studies New Journal of Chemistry, 2022, 46, 19024-19035 |
| 7062337 | CIF | C4 H7 N5 Na2 O4 | P -1 | 6.845; 7.2316; 10.2686 71.886; 71.147; 82.079 | 456.79 | Xu, Ze; Jiang, Shuaijie; Hou, Tianyang; Zhang, Xiaopeng; Lu, Ming; Xu, Yuangang Why does the cyclic pentazolate anion fail to undergo N-oxidization in oxone solution? New Journal of Chemistry, 2023, 47, 5616-5620 |
| 7054106 | CIF | C12 H18 Mg N4 O14 | P -1 | 4.7079; 7.0524; 14.1691 94.124; 91.235; 102.963 | 456.92 | Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C. Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes New Journal of Chemistry, 2014, 38, 2135 |
| 7052618 | CIF | C20 H18 N4 Ni O6 | P -1 | 6.6139; 6.9872; 10.4414 79.736; 82.999; 75.092 | 457.35 | Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks New Journal of Chemistry, 2011, 35, 865 |
| 7060634 | CIF | C4 H6 Cu N10 | P -1 | 5.587; 6.9121; 13.09 96.426; 99.436; 110.441 | 459.38 | Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles New Journal of Chemistry, 2021, 45, 11042-11050 |
| 7061323 | CIF | C8 H9 Fe N O6 | P -1 | 7.394; 8.345; 8.843 62.78; 71.92; 80.61 | 461.1 | Robles-Marín, Elvis; Flores-Alamo, Marcos; Garcia, Juventino J. Electrochemical activation of CO2 by MOF-(Fe, Ni, Mn) derivatives of 5-aminoisophthalic acid and the thiazole group influence on its catalytic activity New Journal of Chemistry, 2022, 46, 6060-6067 |
| 7052665 | CIF | C14 H34 N4 O4 | P -1 | 5.1986; 7.4194; 12.423 88.755; 79.063; 78.612 | 461.13 | Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M. Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes New Journal of Chemistry, 2011, 35, 1515 |
| 7050457 | CIF | C2 H3 Cl O S | P n m a | 6.1174; 6.6674; 11.3145 90; 90; 90 | 461.49 | Romano, Rosana M.; Della Védova, Carlos O.; Downs, Anthony J.; Parsons, Simon; Smith, Caroline Structural and vibrational properties of ClC(O)SY compounds with Y = Cl and CH3 New Journal of Chemistry, 2003, 27, 514 |
| 7057719 | CIF | C5 H9 Br2 Cd N O3 | P 1 21 1 | 7.8799; 7.4837; 8.0522 90; 102.935; 90 | 462.8 | Boopathi, K.; Babu, S. Moorthy; Jagan, R.; Athimoolam, S.; Ramasamy, P. Synthesis, crystal growth, physio-chemical characterization and quantum chemical calculations of NLO active metal‒organic crystal: dibromo(4-hydroxy-l-proline)cadmium(ii) for non-linear optical applications New Journal of Chemistry, 2018, 42, 17464 |
| 7054158 | CIF | C10 H7 N O6 | P -1 | 7.189; 7.5; 9.557 82.788; 87.499; 64.972 | 463.2 | Loots, Leigh; Haynes, Delia A.; Roex, Tanya le Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions New Journal of Chemistry, 2014, 38, 2778 |
| 7055270 | CIF | C12 H20 Au F6 N4 Sb | P -1 | 7.45; 7.938; 8.481 89.041; 84.027; 68.263 | 463.2 | Chou, Chang-Chuan; Yang, Chia-Chi; Chang, Hao-Ching; Lee, Way-Zen; Kuo, Ting-Shen Weaving an infinite 3-D supramolecular network via AuI⋯AuIIIaurophilicity and C‒H⋯Cl hydrogen bonding New J. Chem., 2016, 40, 1944 |
| 7058949 | CIF | C2 H5 N5 | P 21 21 21 | 5.7191; 7.7483; 10.4586 90; 90; 90 | 463.46 | Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions New Journal of Chemistry, 2019 |
| 7056585 | CIF | C22 H14 N4 O4 | P -1 | 4.4715; 6.6057; 16.7243 101.339; 91.268; 105.658 | 464.89 | Farfán, Norberto; Santillan, Rosa; Garcia Ortega, Héctor; Guerrero, Tomas; Morales-Saavedra, O. G.; Lacroix, Pascal Georges Bis(4-nitroanilines) in interaction through a π-conjugated bridge: conformational effects and potential molecular switches New J. Chem., 2017 |
| 7057486 | CIF | C11 H11 N O3 | P -1 | 8.0084; 8.1626; 8.5962 63.646; 69.49; 73.138 | 465.51 | Kumar, K. Shiva; Ramulu, Meesa Siddi; Kumar, N. Praveen Unexpected C‒N bond formation via Smiles rearrangement: one pot synthesis of N-arylated coumarin/pyran derivatives New Journal of Chemistry, 2018, 42, 11276 |
| 7054789 | CIF | C3 H6 N8 O6 | P -1 | 6.4007; 7.6439; 10.1075 70.985; 87.798; 85.279 | 465.92 | Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia 3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties New J. Chem., 2015, 39, 5265 |
| 7057358 | CIF | C18 H14 F4 I2 N2 | P -1 | 6.2409; 8.4295; 9.1751 80.934; 84.467; 78.592 | 466.17 | Bedeković, Nikola; Stilinović, Vladimir; Friščić, Tomislav; Cinčić, Dominik Comparison of isomericmeta- andpara-diiodotetrafluorobenzene as halogen bond donors in crystal engineering New Journal of Chemistry, 2018, 42, 10584 |
| 7053335 | CIF | C9 H14 O3 | P -1 | 7.5561; 8.1977; 8.3331 88.322; 79.154; 67.174 | 466.71 | Clausen, Henrik F.; Chevallier, Marie S.; Spackman, Mark A.; Iversen, Bo B. Three new co-crystals of hydroquinone: crystal structures and Hirshfeld surface analysis of intermolecular interactions New Journal of Chemistry, 2010, 34, 193 |
| 7054108 | CIF | C12 H18 Mg N4 O14 | P -1 | 6.1279; 8.1151; 9.4126 89.443; 86.609; 88.628 | 467.11 | Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C. Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes New Journal of Chemistry, 2014, 38, 2135 |
| 7052197 | CIF | C7 H13 N3 O3 | P 1 21 1 | 8.42266; 6.97215; 8.06305 90; 98.6845; 90 | 468.066 | Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study New Journal of Chemistry, 2007, 31, 1935 |
| 7051663 | CIF | C2 H8 Li2 N10 O3 | P -1 | 6.7522; 7.788; 10.0091 83.827; 75.925; 66.539 | 468.3 | Ebespächer, Moritz; Klapötke, Thomas M.; Miró Sabaté, Carles Nitrogen-rich alkali metal 5,5′-hydrazinebistetrazolate salts: environmentally friendly compounds in pyrotechnic mixtures New Journal of Chemistry, 2009, 33, 517 |
| 7057668 | CIF | C10 H12 N2 O2 | P 1 n 1 | 6.5125; 5.9722; 12.1029 90; 95.656; 90 | 468.438 | Roy, Ankana; Das, Partha Jyoti; Diskin-Posner, Yael; Firer, Michael; Grynszpan, Flavio; Montag, Michael Quenching of syn-bimane fluorescence by Na+ complexation New Journal of Chemistry, 2018, 42, 15541 |
| 7055022 | CIF | C2 H Ag N4 O2 | P 1 21/c 1 | 3.6019; 11.273; 11.6 90; 93.389; 90 | 470.19 | Qu, Xiaoni; Zhang, Sheng; Yang, Qi; Su, Zhiyong; Wei, Qing; Xie, Gang; Chen, Sanping Silver(i)-based energetic coordination polymers: synthesis, structure and energy performance New J. Chem., 2015, 39, 7849 |
| 7061749 | CIF | C4 H8 Cl2 N4 O4 | P 1 21/c 1 | 5.8212; 11.9073; 7.3664 90; 112.794; 90 | 470.72 | Gribov, Pavel S.; Suponitsky, Kyrill Yu.; Sheremetev, Aleksei B. Efficient synthesis of N-(chloromethyl)nitramines via TiCl4-catalyzed chlorodeacetoxylation New Journal of Chemistry, 2022, 46, 17548-17553 |
| 7062775 | CIF | C7 H6 Cu I N4 | P -1 | 7.8402; 8.1337; 9.0972 107.503; 101.344; 113.872 | 471.01 | Mishra, Shivendu; Pandey, Dilip; Mishra, Kulbhushan; Viau, Lydie; Raghuvanshi, Abhinav Copper(i) iodide coordination polymers with triazole substituted pyridine ligands: photophysical and electrical conductivity properties New Journal of Chemistry, 2023, 47, 19751-19759 |
| 7054187 | CIF | C6 H8 Cu N8 | P -1 | 6.9212; 8.2733; 9.9826 67.059; 72.775; 65.514 | 472.84 | Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide New Journal of Chemistry, 2014, 38, 3529 |
| 7050524 | CIF | C16 H20 Cu N14 | P -1 | 6.5873; 8.4512; 9.2834 67.977; 81.207; 84.901 | 473.19 | Mohamadou, Aminou; van Albada, Gerard A.; Kooijman, Huub; Wieczorek, Birgit; Spek, Anthony L.; Reedijk, Jan The binding mode of the ambidentate ligand dicyanamide to transition metal ions can be tuned by bisimidazoline ligands with H-bonding donor property at the rear side of the ligandElectronic supplementary information (ESI) available: atomic displacement plot of structure 2. See http://www.rsc.org/suppdata/nj/b2/b212059c/ New Journal of Chemistry, 2003, 27, 983 |
| 7058636 | CIF | C12 H22 Co N8 O12 | P -1 | 7.594; 7.8777; 9.2102 98.868; 101.319; 114.712 | 473.22 | Parveen, Sheikdawood; Premkumar, Thathan; Nguyen, Hung Huy; Govindarajan, Subbiah Facile template synthesis of water-soluble triazine-based Schiff base ligand bridged-coordination polymers of Co(ii), Ni(ii), and Cu(ii): structure, biomolecular interactions, and cytotoxic activity New Journal of Chemistry, 2019, 43, 13371 |
| 7057110 | CIF | C14 H26 N4 Ni S4 | P -1 | 6.5759; 8.4895; 8.8346 84.185; 78.947; 80.038 | 475.57 | Gervas, Charles; Mlowe, Sixberth; Akerman, Matthew P.; Revaprasadu, Neerish Phase pure Ni3S2 and NiS from bis(N′-ethyl-N-piperazinylcarbodithioato-S,S′)‒nickel(ii) via solvent thermolysis and aerosol assisted chemical vapour deposition New Journal of Chemistry, 2018, 42, 6203 |
| 7053950 | CIF | C12 H8 Fe2 N6 O8 S2 | P -1 | 6.6056; 8.1991; 9.6416 75.649; 71.705; 78.569 | 476.19 | Sanina, N. A.; Krivenko, A. G.; Manzhos, R. A.; Emel'yanova, N. S.; Kozub, G. I.; Korchagin, D. V.; Shilov, G. V.; Kondrat'eva, T. A.; Ovanesyan, N. S.; Aldoshin, S. M. Influence of aromatic ligand on the redox activity of neutral binuclear tetranitrosyl iron complexes [Fe2(μ-SR)2(NO)4]: experiments and quantum-chemical modeling New Journal of Chemistry, 2014, 38, 292 |
| 7058881 | CIF | C8 H12 Cl N S | P -1 | 4.387; 5.6906; 19.2566 86.981; 85.06; 85.181 | 476.76 | Das, Suman; Bhattacharjee, Jayeeta; Panda, Tarun K. An imidazolin-2-iminato ligand organozinc complex as a catalyst for hydroboration of organic nitriles New Journal of Chemistry, 2019, 43, 16812 |
| 7051205 | CIF | C26 H10 F8 | P -1 | 6.725; 8.864; 9.488 107.51; 105.23; 106.82 | 476.9 | Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B. Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons New Journal of Chemistry, 2001, 25, 1410-1417 |
| 7050525 | CIF | C16 H20 Co N14 | P -1 | 6.7844; 8.097; 9.462 67.89; 82.44; 86.531 | 477.34 | Mohamadou, Aminou; van Albada, Gerard A.; Kooijman, Huub; Wieczorek, Birgit; Spek, Anthony L.; Reedijk, Jan The binding mode of the ambidentate ligand dicyanamide to transition metal ions can be tuned by bisimidazoline ligands with H-bonding donor property at the rear side of the ligandElectronic supplementary information (ESI) available: atomic displacement plot of structure 2. See http://www.rsc.org/suppdata/nj/b2/b212059c/ New Journal of Chemistry, 2003, 27, 983 |
| 7057319 | CIF | C16 H18 N8 O8 Zn | P -1 | 7.424; 7.953; 8.914 84.268; 75.599; 69.632 | 477.8 | Yan, Yang-Tian; Cao, Feng; Zhang, Wen-Yan; Zhang, Si-Si; Zhang, Fang; Wang, Yao-Yu Seven luminescent metal‒organic frameworks constructed from 5-(triazol-1-yl)nicotinic acid: luminescent sensors for CrVI and MnO4− ions in an aqueous medium New Journal of Chemistry, 2018, 42, 9865 |
| 7050194 | CIF | C10 H10 O6 | P -1 | 6.7348; 7.0518; 11.256 75.3; 73.98; 71.04 | 478 | Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/ New Journal of Chemistry, 2004, 28, 425 |
| 7058902 | CIF | C5 H10 Gd O10 | P -1 | 6.0605; 7.7412; 10.4334 96.583; 97.241; 95.907 | 478.95 | Zheng, Teng-Fei; Tian, Xue-Mei; Wu, Lin-Hui; Liu, Sui-Jun; Yao, Shu-Li; He, Kun-Huan; Huang, Hai-Ping; Liao, Jinsheng; Chen, Jing-Lin; Wen, He-Rui Two GdIII complexes with different structures and magnetocaloric properties induced by metal ion sources New Journal of Chemistry, 2019 |
| 7056279 | CIF | C2 H8 Cd2 N2 O7 V2 | P n n m | 14.598; 5.208; 6.304 90; 90; 90 | 479.3 | Li, Ning; Zhao, Jian-Guo; Xu, Li; Zhang, Zhong; Huang, Liping; Liu, Yiwei; Lu, Ying; Liu, Shuxia A 3D cadmium−vanadium bimetallic framework with luminescence properties New J. Chem., 2017 |
| 7057457 | CIF | C4 H9 Cl O5 S2 | P 1 21 1 | 9.4479; 5.5001; 10.065 90; 112.633; 90 | 482.74 | Galván, J. E.; Defonsi Lestard, M. E.; Piro, O. E.; Echeverria, G.; Molina, R. D. I.; Arena, M. E.; Ulic, S. E.; Tuttolomondo, M. E.; Ben Altabef, A. Synthesis, characterization and crystal structure of 2-chloroethyl(methylsulfonyl)methanesulfonate New Journal of Chemistry, 2018, 42, 11073 |
| 7060769 | CIF | Na4 Se4 Sn | P -4 21 c | 8.1674; 8.1674; 7.2665 90; 90; 90 | 484.72 | Gao, Lihua; Bian, Gang; Yang, Ya; Zhang, Bingbing; Wu, Xiaowen; Wu, Kui Na4SnS4 and Na4SnSe4 exhibiting multifunctional physicochemical performances as potential infrared nonlinear optical crystals and sodium ion conductors New Journal of Chemistry, 2021, 45, 12362-12366 |
| 7058495 | CIF | C20 H22 N8 Pd | P -1 | 5.4343; 8.4913; 10.9739 88.134; 80.55; 76.336 | 485.36 | Zakharchenko, Borys V.; Khomenko, Dmytro M.; Doroshchuk, Roman O.; Raspertova, Ilona V.; Starova, Viktoriia S.; Trachevsky, Volodymyr V.; Shova, Sergiu; Severynovska, Olga V.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.; Arion, Vladimir B.; Lampeka, Rostyslav D. New palladium(ii) complexes with 3-(2-pyridyl)-5-alkyl-1,2,4-triazole ligands as recyclable C‒C coupling catalysts New Journal of Chemistry, 2019, 43, 10973 |
| 7053157 | CIF | C14 H16 Cu2 N8 S4 | P -1 | 7.668; 8.251; 8.861 111.221; 93.978; 108.043 | 486.4 | Gil-García, Rubén; Fraile, Roberto; Donnadieu, Bruno; Madariaga, Gotzon; Januskaitis, Vaidas; Rovira, Jordi; González, Lucía; Borrás, Joaquín; Arnáiz, Francisco Javier; García-Tojal, Javier Desulfurization processes of thiosemicarbazonecopper(ii) derivatives in acidic and basic aqueous media New Journal of Chemistry, 2013, 37, 3568 |
| 7057442 | CIF | Cs K Mo3 O10 | P -1 | 8.195; 8.224; 8.36 63.93; 85.769; 74.33 | 486.6 | Han, Shujuan; Zhang, Bingbing; Tong, Tinghao; Yang, Zhihua; Pan, Shilie Four alkali metal molybdates with two types of Mo‒O chains, ABMo3O10 (A = Li, B = Rb; A = Li, Na, K, B = Cs): synthesis, structure comparison and optical properties New Journal of Chemistry, 2018, 42, 10879 |
| 7051845 | CIF | C10 H10 N2 O3 | P 1 21 1 | 4.6354; 10.4827; 10.2152 90; 101.112; 90 | 487.07 | Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F. The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids New Journal of Chemistry, 2008, 32, 1394 |
| 7060701 | CIF | C4 H13 N11 O2 | P 1 21 1 | 3.668; 12.731; 10.435 90; 90.672; 90 | 487.3 | Yin, Zhaoyang; Dong, Yaqun; Zeng, Zhiwei; Huang, Wei; Tang, Yongxing Crystal Structures and Properties of High-nitrogen Energetic Salts Based on (Z)-1,1-diamino-2-nitro-2-(1H-tetrazol-5-yl)ethene New Journal of Chemistry, 2021 |
| 7056248 | CIF | C26 H16 N4 O4 | P -1 | 5.588; 7.545; 11.984 77.113; 88.392; 87.412 | 491.9 | Li, Guo-bi; Yang, Qing Yuan; Pan, Rongkai; Liu, Sheng-Gui; xu, yaowei Supramolecular structural transformation of N, N´-bis(4-pyridylmethyl)-naphthalene diimide and fluorescence water sensing New J. Chem., 2017 |
| 7058070 | CIF | C3 H2 N6 | P 21 21 21 | 5.4334; 6.5582; 13.8317 90; 90; 90 | 492.87 | Wang, Guilong; Lu, Tian; Fan, Guijuan; Yin, Hongquan; Chen, Fu-Xue Synthesis and properties of insensitive [1,2,4]triazolo[4,3-b]-1,2,4,5-tetrazine explosives New Journal of Chemistry, 2019, 43, 1663 |
| 7050701 | CIF | C13 H11 N | P 1 21/c 1 | 5.817; 7.528; 11.274 90; 93.26; 90 | 492.9 | Cariati, Elena; Galli, Simona; Macchi, Piero; Roberto, Dominique; Sironi, A.; Srdanov, Vojislav I.; Ugo, Renato New Journal of Chemistry, 2002 |
| 7050702 | CIF | C13 H11 N | P 1 c 1 | 5.817; 7.528; 11.274 90; 93.26; 90 | 492.9 | Cariati, Elena; Galli, Simona; Macchi, Piero; Roberto, Dominique; Sironi, A.; Srdanov, Vojislav I.; Ugo, Renato New Journal of Chemistry, 2002 |
| 7062908 | CIF | C5 H7 N7 O6 | P 1 21/m 1 | 9.2737; 6.2094; 9.4529 90; 114.864; 90 | 493.88 | Shi, Haichuan; Wang, Yuqing; Wang, Xinyu; Zhang, Xiaotian; Huang, Ming; Yang, Haijun; Luo, Zhenghang Concise synthesis of a fused energetic pyrazolotriazine with good performance New Journal of Chemistry, 2024, 48, 1212-1216 |
| 7061401 | CIF | C12 H9 N3 O | P -1 | 6.3852; 7.1557; 11.6848 93.971; 93.665; 111.132 | 494.52 | SD, Anwarhussaini; Mohitkar, Anuradha; Jayanty, Subbalakshmi Unprecedented transformation from cyclized zwitterionic oxazolidine derivatives to corresponding non-zwitterionic aromatic amides via Vilsmeier reagent in a one-pot reaction: optical property and crystallography New Journal of Chemistry, 2022, 46, 8069-8078 |
| 7061032 | CIF | C16 H10 N8 O8 Zn | P -1 | 7.054; 7.9485; 9.4149 90.829; 110.004; 93.622 | 494.68 | Gurskiy, Stanislav I.; Maklakov, Sergey S.; Dmitrieva, Natalia E.; Tafeenko, Viktor A. Effects of transition metal cations and temperature on the luminescence of a 3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1H-pyrrole-2-olate anion New Journal of Chemistry, 2021, 45, 21684-21691 |
| 7052902 | CIF | C4 H7 N7 O6 | P -1 | 5.9153; 9.196; 9.4344 93.949; 90.503; 104.609 | 495.25 | Klapötke, Thomas M.; Nordheider, Andreas; Stierstorfer, Jörg Synthesis and reactivity of an unexpected highly sensitive 1-carboxymethyl-3-diazonio-5-nitrimino-1,2,4-triazole New Journal of Chemistry, 2012, 36, 1463 |
| 7061189 | CIF | C3 H6 N8 Na2 O4 | P -1 | 6.5949; 8.7129; 9.1609 102.33; 90.26; 105.15 | 495.36 | Li, Haibo; Wang, Yanna; Wei, Zhenghe; Xia, Lianghong; Li, Zhimin; Zhang, Tonglai Alkaline metal and alkaline earth metal salts of di(1H-tetrazol-5-yl)methanone (DTO): energetic catalysts for ammonium perchlorate decomposition New Journal of Chemistry, 2022, 46, 4462-4469 |
| 7052220 | CIF | C11 H11 N3 O | P -1 | 7.7873; 8.113; 8.84 77.6614; 74.4604; 68.3976 | 496.14 | Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John How robust is the hydrogen-bonded amide ‘ladder’ motif? New Journal of Chemistry, 2007, 31, 2044 |
| 7058921 | CIF | C16 H8 Cl4 I2 N4 | P -1 | 4.0145; 10.8241; 12.3534 111.476; 92.043; 94.58 | 496.71 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7051392 | CIF | C10 H8 Ag N3 O2 | P 1 2/n 1 | 7.2931; 6.087; 11.481 90; 102.871; 90 | 496.8 | New Journal of Chemistry, 1999 |
| 7060602 | CIF | C3 H2 N6 O | C 1 c 1 | 12.6514; 5.2884; 7.4471 90; 92.903; 90 | 497.61 | Chen, Xiang; Guo, Zhaoqi; Zhang, Cong; Zhang, Jianguo; Ma, Haixia Boosting intermolecular interactions of fused cyclic explosives: the way to thermostable and insensitive energetic materials with high density New Journal of Chemistry, 2021, 45, 9358-9367 |
| 7051401 | CIF | C6 H4 O4 W | P 1 21/c 1 | 7.0387; 12.447; 6.376 90; 116.938; 90 | 498 | New Journal of Chemistry, 1999 |
| 7058920 | CIF | C16 H8 Cl4 I2 N4 | P -1 | 4.02352; 10.8276; 12.3666 111.499; 92.051; 94.643 | 498.38 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7051438 | CIF | C10 H6 Cr O5 | P -1 | 7.0349; 7.2332; 11.1518 88.71; 81.733; 63.012 | 499.82 | pi-Bonded organometallic building blocks for supramolecular chemistry. New Journal of Chemistry, 1999 |
| 7058919 | CIF | C16 H8 Cl4 I2 N4 | P -1 | 4.0326; 10.8287; 12.379 111.495; 92.054; 94.675 | 500.03 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7061978 | CIF | C13 H7 N3 O | P -1 | 6.6879; 8.0843; 9.8873 93.253; 106.352; 100.812 | 500.43 | Kumar, Loveneesh; Verma, Nishant; Kumar, Neeraj; Sehrawat, Hitesh; Kumar, Rupesh; Chandra, Ramesh Microwave-assisted catalyst-free multicomponent one-pot green synthesis of highly functionalized aminocyanopyridines and (4-hydroxy)quinolines in aqueous medium and its in silico studies New Journal of Chemistry, 2022, 46, 20580-20591 |
| 7061626 | CIF | C7 H15 Cl N2 O4 | P 1 | 6.7331; 8.6522; 8.8761 77.838; 88.7; 81.931 | 500.46 | You, Xiuli; Rao, Wenjun; Han, Keke; Wang, Lingyu; Zhang, Mengxia; Wei, Zhenhong Two quasi-spherical molecules [1,4-diazabicyclo(3.2.2)nonane]X (X = ClO4, ReO4) exhibit switchable phase transition, dielectric and second-harmonic-generation properties New Journal of Chemistry, 2022, 46, 14404-14409 |
| 7058145 | CIF | C10 H10 Br6 Cl2 N2 Te | P -1 | 7.3223; 8.3339; 9.0497 74.694; 70.263; 83.031 | 501.05 | Shayapov, Vladimir R.; Usoltsev, Andrey N.; Adonin, Sergey A.; Sokolov, Maxim N.; Samsonenko, Denis G.; Fedin, Vladimir P. Thermochromism of bromotellurates(iv): experimental insights New Journal of Chemistry, 2019, 43, 3927 |
| 7057830 | CIF | C8 H12 N2 Ni O4 S | P 21 m a | 9.6973; 10.6875; 4.8399 90; 90; 90 | 501.61 | Luberda-Durnaś, K.; Konieczny, P.; Pełka, R.; Oszajca, M.; Gonzalez Guillen, A.; Korecki, J.; Ciesielska, Z.; Łasocha, W. Two-step magnetic transition in hybrid organic‒inorganic materials of the (m-xylylenediamine)MeSO4 (Me ‒ Mn, Fe, Co, Ni) type New Journal of Chemistry, 2018, 42, 18225 |
| 7058935 | CIF | C16 H8 Cl4 I2 N4 | P -1 | 4.04169; 10.8302; 12.3901 111.496; 92.077; 94.678 | 501.66 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7060126 | CIF | C12 H10 Hg2 N16 | P -1 | 7.1276; 7.872; 9.358 89.837; 82.547; 74.782 | 502.1 | Mahmoudi, Ghodrat; Lawrence, Simon E.; Cisterna, Jonathan; Cárdenas, Alejandro; Brito, Iván; Frontera, Antonio; Safin, Damir A. A new spodium bond driven coordination polymer constructed from mercury(ii) azide and 1,2-bis(pyridin-2-ylmethylene)hydrazine New Journal of Chemistry, 2020, 44, 21100-21107 |
| 7058929 | CIF | C18 H8 Cl4 I2 N2 | P -1 | 4.0179; 11.1807; 12.1538 111.505; 90.519; 97.616 | 502.51 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7050438 | CIF | C12 H30 N2 O14 | P -1 | 7.465; 7.8137; 9.6921 73.16; 68.71; 87.818 | 502.73 | Calleja, Maria; Mason, Sax A.; Prince, Paul D.; Steed, Jonathan W.; Wilkinson, Clive Anisotropic thermal expansion in 18-crown-6·2 H2O·2 HNO3 New Journal of Chemistry, 2003, 27, 28 |
| 7058925 | CIF | C18 H10 Cl4 I2 N2 | P -1 | 4.0344; 10.8835; 12.2968 110.424; 92.656; 94.579 | 502.782 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7058922 | CIF | C16 H8 Cl4 I2 N4 | P -1 | 4.05043; 10.8317; 12.4043 111.501; 92.105; 94.666 | 503.36 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7058933 | CIF | C18 H8 Cl4 I2 N2 | P -1 | 4.0263; 11.1831; 12.1654 111.501; 90.558; 97.549 | 504.23 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7058924 | CIF | C18 H10 Cl4 I2 N2 | P -1 | 4.04426; 10.88792; 12.30931 110.477; 92.6533; 94.588 | 504.543 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7058923 | CIF | C16 H8 Cl4 I2 N4 | P -1 | 4.05852; 10.8342; 12.4194 111.498; 92.143; 94.631 | 505.12 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7058934 | CIF | C18 H8 Cl4 I2 N2 | P -1 | 4.0336; 11.1825; 12.1732 111.496; 90.599; 97.48 | 505.53 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7058928 | CIF | C18 H10 Cl4 I2 N2 | P -1 | 4.05144; 10.90047; 12.32575 110.558; 92.6207; 94.63 | 506.406 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7059116 | CIF | C3 H8 N8 O7 | P -1 | 7.588; 7.666; 10.104 105.941; 91.695; 114.65 | 506.6 | Huang, Haifeng; Li, Ying; Yang, Jun; Pan, Renming; Lin, Xiangyang Materials with good energetic properties resulting from the smart combination of nitramino and dinitromethyl group with furazan New Journal of Chemistry, 2017, 41, 7697 |
| 7058930 | CIF | C18 H8 Cl4 I2 N2 | P -1 | 4.0413; 11.1833; 12.1828 111.489; 90.637; 97.409 | 507.03 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7052666 | CIF | C16 H38 N4 O4 | P -1 | 5.2049; 7.4169; 13.6376 95.676; 97.552; 101.479 | 507.21 | Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M. Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes New Journal of Chemistry, 2011, 35, 1515 |
| 7058926 | CIF | C18 H10 Cl4 I2 N2 | P -1 | 4.06096; 10.91085; 12.34281 110.66; 92.5824; 94.7301 | 508.363 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7054480 | CIF | C4 K2 N10 O4 | P -1 | 7.1412; 7.2056; 11.498 89.658; 73.514; 64.814 | 508.88 | Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R. Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles New J. Chem., 2015, 39, 1619 |
| 7058931 | CIF | C18 H8 Cl4 I2 N2 | P -1 | 4.0502; 11.186; 12.1964 111.492; 90.671; 97.332 | 508.92 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7056613 | CIF | C19 H23 F4 N O5 | P 1 | 6.0766; 9.436; 9.7318 73.389; 72.298; 84.89 | 509.4 | Bilska-Markowska, Monika; Siodła, Tomasz; Patyk, Ewa; Katrusiak, Andrzej; Koroniak, Henryk The conformations of new CF3 and CF3-CHF containing amides derived from carbohydrates: NMR, crystallographic and DFT study New J. Chem., 2017 |
| 7058927 | CIF | C9 H5 Cl2 I N | P -1 | 4.07136; 10.92294; 12.36101 110.782; 92.53; 94.8692 | 510.46 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7052292 | CIF | C14 H14 B2 N2 Ni O8 S4 | P -1 | 3.905; 10.22; 13.302 101.79; 95.13; 98.09 | 510.7 | Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J. Pyridinium boronic acid salts in crystal synthesis New Journal of Chemistry, 2006, 30, 1461 |
| 7058918 | CIF | C18 H8 Cl4 I2 N2 | P -1 | 4.0598; 11.1929; 12.2066 111.485; 90.699; 97.282 | 510.94 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7057828 | CIF | C8 H12 Co N2 O4 S | P 21 m a | 9.7312; 10.785; 4.8799 90; 90; 90 | 512.15 | Luberda-Durnaś, K.; Konieczny, P.; Pełka, R.; Oszajca, M.; Gonzalez Guillen, A.; Korecki, J.; Ciesielska, Z.; Łasocha, W. Two-step magnetic transition in hybrid organic‒inorganic materials of the (m-xylylenediamine)MeSO4 (Me ‒ Mn, Fe, Co, Ni) type New Journal of Chemistry, 2018, 42, 18225 |
| 7058932 | CIF | C18 H10 Cl4 I2 N2 | P -1 | 4.08394; 10.93443; 12.37987 110.926; 92.4643; 95.0316 | 512.735 | Juneja, Navkiran Kaur; Unruh, Daniel K.; Bosch, Eric; Groeneman , Ryan; Hutchins, Kristin M. Effects of dynamic pedal motion and static disorder on thermal expansion within halogen bonded co-crystals New Journal of Chemistry, 2019 |
| 7052291 | CIF | C14 H14 B2 Cu N2 O8 S4 | P -1 | 3.8956; 10.119; 13.447 100.74; 94.97; 97.65 | 512.8 | Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J. Pyridinium boronic acid salts in crystal synthesis New Journal of Chemistry, 2006, 30, 1461 |
| 7054645 | CIF | C22 H22 N6 O4 | P -1 | 4.8468; 9.2594; 12.245 69.536; 89.567; 85.993 | 513.51 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7051605 | CIF | C2 H3 N5 O2 | P 1 21/c 1 | 6.3305; 4.9929; 16.388 90; 97.13; 90 | 513.98 | Klapötke, Thomas M.; Sabaté, Carles Miró; Stierstorfer, Jörg Neutral 5-nitrotetrazoles: easy initiation with low pollution New Journal of Chemistry, 2009, 33, 136 |
| 7054756 | CIF | C8 H11 Cd N O7 | P -1 | 7.7683; 8.6089; 8.6695 84.04; 76.23; 66.04 | 514.6 | Wang, Fengqin; Dong, Caifu; Wang, Chengmiao; Yu, Zongchao; Guo, Shukun; Wang, Zechuan; Zhao, Yongnan; Li, Guodong Fluorescence detection of aromatic amines and photocatalytic degradation of rhodamine B under UV light irradiation by luminescent metal‒organic frameworks New J. Chem., 2015, 39, 4437 |
| 7056847 | CIF | C2 H6 N4 O3 | P 1 21/c 1 | 7.0644; 6.1129; 12.3876 90; 105.656; 90 | 515.1 | Kumar, A. Sudheer; Sasidharan, Nimesh; Ganguly, Rakesh; Leow, Dasheng; Hng, Huey Hoon 3-Amino-1,2,4(4H)-oxadiazol-5-one (AOD) and its nitrogen-rich salts: a class of insensitive energetic materials New Journal of Chemistry, 2018, 42, 1840 |
| 7054487 | CIF | C9 H16 N2 O3 | P -1 | 6.9516; 8.1294; 9.6234 74.586; 80.157; 83.657 | 515.35 | Maton, C.; Van Hecke, K.; Stevens, C. V. Peralkylated imidazolium carbonate ionic liquids: synthesis using dimethyl carbonate, reactivity and structure New J. Chem., 2015, 39, 461 |
| 7062972 | CIF | F3 K2 Nb O2 | P n a 21 | 7.6269; 11.8526; 5.70105 90; 90; 90 | 515.37 | Belokoneva, Elena L.; Stefanovich, Sergey Yu.; Volkov, Anatoly S.; Dimitrova, Olga V.; Mozgova, Alexandra New nonlinear optical oxyfluoride K2NbO2F3 with strong pseudo-centrosymmetry, obtained by mild hydrothermal synthesis New Journal of Chemistry, 2024, 48, 2569-2575 |
| 7051333 | CIF | C4 H16 Cl3 N3 | P m m n :2 | 5.1016; 21.343; 4.744 90; 90; 90 | 516.54 | New Journal of Chemistry, 2000 |
| 7050439 | CIF | C12 H30 N2 O14 | P -1 | 7.56; 7.9619; 9.7801 73.314; 67.323; 87.935 | 518.44 | Calleja, Maria; Mason, Sax A.; Prince, Paul D.; Steed, Jonathan W.; Wilkinson, Clive Anisotropic thermal expansion in 18-crown-6·2 H2O·2 HNO3 New Journal of Chemistry, 2003, 27, 28 |
| 7061606 | CIF | C10 H9 N3 O3 | P -1 | 6.3645; 7.7209; 11.7329 94.916; 97.452; 113.275 | 519.19 | Opačak, Saša; Perić, Berislav; Gojšić, Tomislav; Čikoš, Ana; Vikić-Topić, Dražen; Kirin, Srećko I. Tandem amide coupling and hydroamination: unexpected benzotriazole oxide addition to the propiolic acid triple bond New Journal of Chemistry, 2022, 46, 13275-13285 |
| 7052293 | CIF | C14 H14 B2 N2 O8 Pd S4 | P -1 | 3.9415; 10.164; 13.431 100.46; 94.77; 98.41 | 520.1 | Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J. Pyridinium boronic acid salts in crystal synthesis New Journal of Chemistry, 2006, 30, 1461 |
| 7051129 | CIF | C5 H15 N O7 P2 | P -1 | 7.167; 7.535; 10.052 98.14; 99.1; 99.59 | 520.6 | Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids New J. Chem., 2001, 25, 1447-1457 |
| 7057831 | CIF | C8 H12 Fe N2 O4 S | P 21 m a | 9.76; 10.8769; 4.9043 90; 90; 90 | 520.63 | Luberda-Durnaś, K.; Konieczny, P.; Pełka, R.; Oszajca, M.; Gonzalez Guillen, A.; Korecki, J.; Ciesielska, Z.; Łasocha, W. Two-step magnetic transition in hybrid organic‒inorganic materials of the (m-xylylenediamine)MeSO4 (Me ‒ Mn, Fe, Co, Ni) type New Journal of Chemistry, 2018, 42, 18225 |
| 7060098 | CIF | C3 H5 N7 | P 1 21/n 1 | 10.5503; 3.56337; 14.313 90; 103.468; 90 | 523.29 | Tang, Yongxing; An, Ziwei; Chinnam, Ajay Kumar; Staples, Richard J.; Shreeve, Jean'ne M. Very thermostable energetic materials based on a fused-triazole: 3,6-diamino-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole New Journal of Chemistry, 2021, 45, 85-91 |
| 7052013 | CIF | C4 H3 Cl N2 O2 | P 1 21/n 1 | 8.4393; 6.8412; 9.3679 90; 104.201; 90 | 524.33 | Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L. The observed and energetically feasible crystal structures of 5-substituted uracils New Journal of Chemistry, 2008, 32, 1761 |
| 7057638 | CIF | C12 H20 Cl6 Cu N4 O2 | P -1 | 7.1563; 8.0445; 9.1508 94.831; 90.917; 91.361 | 524.7 | Kersen, Ülo; Wojtczak, Andrzej; Bienko, Alina; Jezierska, Julia The effects of protonated heterocyclic cations on the structural and magnetic properties of tetrachlorocuprate(ii) anions; X-ray, magnetochemical and EPR studies New Journal of Chemistry, 2018, 42, 15705 |
| 7062630 | CIF | C12 H12 N2 O | P -1 | 7.1562; 8.1948; 9.4259 102.299; 97.775; 99.273 | 524.71 | Yuan, Zi-Yi; Zhang, Zheng-Qian; Liang, Jun-Rong; Lin, Chu-Yan; Peng, Dan-Li; Cui, Bao-Dong; Mou, Xue-Qing; Zhang, Yun; Chen, Yong-Zheng A facile one-pot synthesis of N-acyl-1-cyano-1,2,3,4-tetrahydroisoquinoline via a photoredox and Reissert-type reaction from 1,2,3,4-tetrahydroisoquinolines New Journal of Chemistry, 2023, 47, 15847-15851 |
| 7053028 | CIF | C22 H16 N2 O10 Zn | P -1 | 7.4062; 9.136; 9.415 110.466; 98.32; 111.664 | 526.5 | Hong, Xu-Jia; Wang, Ming-Fang; Jia, Hong-Yang; Li, Wei-Xing; Li, Jing; Liu, Yi-Ting; Jin, Hong-Guang; Cai, Yue-Peng Assemblies of several supramolecular networks containing quinoline-2,3-dicarboxylic acid New Journal of Chemistry, 2013, 37, 933 |
| 7061657 | CIF | C14 H6 N2 O4 | P -1 | 7.6356; 8.2211; 9.0033 90.202; 107.895; 100.224 | 528.26 | Wei, Tai-Bao; Dang, Li-Rong; Hu, Jian-Peng; Jia, Yu; Lin, Qi; Yao, Hong; Shi, Bingbing; Zhang, You-Ming; Qu, Wen-Juan A simple phenazine derivative fluorescence sensor for detecting formaldehyde New Journal of Chemistry, 2022, 46, 20658-20663 |
| 7060275 | CIF | C3 H4 N4 O2 | C m c 21 | 6.1158; 9.1928; 9.3984 90; 90; 90 | 528.39 | Gettings, Matthew L.; Byrd, Edward F. C.; Zeller, Matthias; Piercey, Davin Methyl sydnone imine and its energetic salts New Journal of Chemistry, 2021, 45, 2228-2236 |
| 7059060 | CIF | C9 H6 N6 | P -1 | 6.7736; 8.6454; 10.235 67.666; 72.808; 83.739 | 529.63 | Nimax, Patrick R.; Zoller, Florian; Blockhaus, Tobias; Küblböck, Teresa; Fattakhova-Rohlfing, Dina; Sünkel, Karlheinz An aminotetracyanocyclopentadienide system: light-induced formation of a thermally stable cyclopentadienyl radical New Journal of Chemistry, 2020, 44, 72-78 |
| 7057348 | CIF | C10 H9 F2 I N | P -1 | 8.2478; 8.7243; 8.9978 88.673; 64.626; 66.878 | 529.73 | Bedeković, Nikola; Stilinović, Vladimir; Friščić, Tomislav; Cinčić, Dominik Comparison of isomericmeta- andpara-diiodotetrafluorobenzene as halogen bond donors in crystal engineering New Journal of Chemistry, 2018, 42, 10584 |
| 7061267 | CIF | Cu H6 O7 S | C 1 c 1 | 5.5708; 12.9751; 7.3754 90; 96.45; 90 | 529.73 | Ibrahim, Mukaila A.; Boeré, René T. The copper sulfate hydration cycle. Crystal structures of CuSO4 (Chalcocyanite), CuSO4·H2O (Poitevinite), CuSO4·3H2O (Bonattite) and CuSO4·5H2O (Chalcanthite) at low temperature using non-spherical atomic scattering factors New Journal of Chemistry, 2022, 46, 5479-5488 |
| 7060256 | CIF | C7 H6 Cl2 Mn N2 O3 | P -1 | 5.9147; 9.6733; 9.9806 74.397; 77.06; 79.148 | 531.02 | Dutta, Debajit; Sharma, Pranay; Frontera, Antonio; Gogoi, Anshuman; Verma, Akalesh K.; Dutta, Diksha; Sarma, Bipul; Bhattacharyya, Manjit K. Oxalato bridged coordination polymer of manganese(iii) involving unconventional O⋯π-hole(nitrile) and antiparallel nitrile⋯nitrile contacts: antiproliferative evaluation and theoretical studies New Journal of Chemistry, 2020, 44, 20021-20038 |
| 7052073 | CIF | C7 H7 B Br2 O4 | P -1 | 7.0559; 8.3747; 9.656 89.986; 99.607; 108.329 | 533.2 | Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles New Journal of Chemistry, 2007, 31, 144 |
| 7057829 | CIF | C8 H12 Mn N2 O4 S | P 21 m a | 9.8032; 10.9845; 4.9528 90; 90; 90 | 533.33 | Luberda-Durnaś, K.; Konieczny, P.; Pełka, R.; Oszajca, M.; Gonzalez Guillen, A.; Korecki, J.; Ciesielska, Z.; Łasocha, W. Two-step magnetic transition in hybrid organic‒inorganic materials of the (m-xylylenediamine)MeSO4 (Me ‒ Mn, Fe, Co, Ni) type New Journal of Chemistry, 2018, 42, 18225 |
| 7055074 | CIF | C6 H6 I2 O4 | P 1 21/c 1 | 8.6795; 7.5937; 8.552 90; 108.798; 90 | 533.59 | Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin Halogen bonding in the crystal structures of 1,2-diiodo alkenes New J. Chem., 2015, 39, 8522 |
| 7060767 | CIF | C8 H23 B20 N O2 S | P 1 | 6.9661; 7.0272; 11.414 105.946; 91.131; 95.61 | 534 | Ol'shevskaya, Valentina A.; Alpatova, Victoria M.; Makarenkov, Anton V.; Kononova, Elena G.; Smol’yakov, Alexander F.; Peregudov, Alexander S.; Rys, Evgeny G. Synthesis of maleimide-functionalized carboranes and their utility in Michael addition reactions New Journal of Chemistry, 2021, 45, 12159-12167 |
| 7055614 | CIF | C16 H24 Br2 N4 O2 S2 | P -1 | 7.5072; 8.4305; 9.1386 73.216; 85.375; 74.943 | 534.72 | Phukan, Nithi; Baruah, Jubaraj B. Solvent and anion facilitated conformational changes in benzylamine substituted thiazolamine New J. Chem., 2016, 40, 6899 |
| 7062431 | CIF | C14 H22 Cu3 N8 O10 | P -1 | 7.1285; 8.7861; 9.739 114.032; 94.776; 101.957 | 535.33 | Klongdee, Fatima; Sasada, Yuto; Nakano, Motohiro; Chainok, Kittipong; Youngme, Sujittra; Boonmak, Jaursup Synthesis, X-ray structures, and magnetic properties of seven polynuclear Cu(ii) complexes containing pyrazole-3,5-dicarboxylate with various ancillary ligands New Journal of Chemistry, 2023, 47, 9669-9680 |
| 7062829 | CIF | C4 H7 N3 O | P -1 | 6.8785; 8.749; 9.943 106.629; 97.777; 106.062 | 535.8 | Sheremetev, Aleksei B.; Kozeev, Andrei S.; Palysaeva, Nadezhda V.; Suponitsky, Kyrill Yu. A mild and efficient synthesis of aminofurazans New Journal of Chemistry, 2023, 47, 21091-21097 |
| 7059428 | CIF | C14 H16 N10 O8 S2 | P -1 | 6.5043; 8.5821; 10.4247 67.98; 87.727; 84.136 | 536.64 | Yan, Tingou; Cheng, Guangbin; Yang, Hongwei 1,3,4-Oxadiazole based thermostable energetic materials: synthesis and structure‒property relationship New Journal of Chemistry, 2020, 44, 6643-6651 |
| 7055863 | CIF | C20 H20 Br2 Cu N4 O4 | P -1 | 7.9693; 8.4129; 9.1302 68.058; 85.402; 71.258 | 537.13 | Czekański, Łukasz; Hoffmann, Stanisław K.; Barczyński, Piotr; Gąsowska, Anna; Bregier-Jarzębowska, Romualda; Zalewska, Alina; Goslar, Janina; Ratajczak-Sitarz, Małgorzata; Katrusiak, Andrzej Crystal structure and physical properties of 1-methyl-3-(carboxymethyl)benzimidazolium betaine·CuBr2 in crystal and water solution New J. Chem., 2016, 40, 10526 |
| 7057945 | CIF | C12 H11 N O2 | P -1 | 7.4403; 7.5372; 10.8823 100.819; 96.705; 113.459 | 537.32 | Jain, Kavita; Chaudhuri, Saikat; Pal, Kuntal; Das, Kalpataru The Knoevenagel condensation using quinine as an organocatalyst under solvent-free conditions New Journal of Chemistry, 2019, 43, 1299 |
| 7057680 | CIF | C10 H12 N2 O4 | P -1 | 6.1091; 8.281; 11.0256 74.836; 87.904; 88.263 | 537.87 | Castells-Gil, Javier; Padial, Natalia M.; Martí-Gastaldo, Carlos Structural reorganization in a hydrogen-bonded organic framework New Journal of Chemistry, 2018, 42, 16138 |
| 7062071 | CIF | C12 H14 O2 | P -1 | 7.8281; 8.1444; 8.5668 81.284; 88.323; 85.455 | 538.09 | Sarkar, Fillip Kumar; Gajurel, Sushmita; Kyndiah, Lenida; Sarkar, Rajib; Devan, Rupesh S.; Pal, Amarta Kumar Palladium incorporated MIL-101(Cr): a heterogeneous and reusable catalyst for the C–H functionalization of unactivated arenes New Journal of Chemistry, 2022, 46, 23102-23111 |
| 7056848 | CIF | C2 H7 N5 O2 | P n a 21 | 13.3609; 10.8742; 3.7046 90; 90; 90 | 538.24 | Kumar, A. Sudheer; Sasidharan, Nimesh; Ganguly, Rakesh; Leow, Dasheng; Hng, Huey Hoon 3-Amino-1,2,4(4H)-oxadiazol-5-one (AOD) and its nitrogen-rich salts: a class of insensitive energetic materials New Journal of Chemistry, 2018, 42, 1840 |
| 7054159 | CIF | C10 H9 N O7 | P -1 | 7.344; 7.851; 9.78 91.428; 94.012; 106.401 | 539 | Loots, Leigh; Haynes, Delia A.; Roex, Tanya le Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions New Journal of Chemistry, 2014, 38, 2778 |
| 7053659 | CIF | C16 H12 Eu2 N2 O16 | P -1 | 8.275; 8.484; 9.092 111.475; 112.789; 90.191 | 539.7 | Zhang, Lijuan; Xu, Donghua; Zhou, Yunshan; Jiang, Fei Design of 3-D europium(iii)‒organic frameworks based on pyridine carboxylate N-oxide and acyclic binary carboxylate: syntheses, structures, and luminescence properties New Journal of Chemistry, 2010, 34, 2470 |
| 7053222 | CIF | C3 H11 N11 O3 | P -1 | 6.5764; 9.2377; 9.8647 105.849; 100.993; 103.37 | 539.86 | Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee Energetic salts based on 1-methoxy-5-nitroiminotetrazole New Journal of Chemistry, 2013, 37, 1180 |
| 7052010 | CIF | C5 H3 N3 O2 | P 1 21/n 1 | 9.0098; 6.6035; 9.1805 90; 98.124; 90 | 540.72 | Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L. The observed and energetically feasible crystal structures of 5-substituted uracils New Journal of Chemistry, 2008, 32, 1761 |
| 7062356 | CIF | C31 H20 N2 | P 1 | 5.181; 9.6048; 11.9887 67.824; 85.664; 78.436 | 541.24 | Younes, Eyad A.; Aljaar, Nayyef; Abdollahi, Maryam F.; Shtaiwi, Majed; Issa, Maram J.; Zhao, Yuming N-Cyanomethylmethanimine tethered anthracene dimer: concise synthesis, conformational properties and photoinduced configurational isomerization New Journal of Chemistry, 2023, 47, 6708-6720 |
| 7055216 | CIF | C10 H8 Cl N3 O2 | P -1 | 7.642; 7.933; 9.511 98.77; 104.53; 98.06 | 541.945 | Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Zarate, Ximena; Schott, Eduardo A family of substituted hydrazonoisoxazolones with potential biological properties New J. Chem., 2016, 40, 2156 |
| 7058369 | CIF | Ca F K2 O4 P | P n m a | 12.661; 5.8589; 7.325 90; 90; 90 | 543.4 | Chai, Kun; Cheng, Shichao; Li, Hongyi; Dai, Bin Modulation of perovskite-related frameworks induced by alkaline earth metals in phosphate fluorides A2MPO4F (A = K, Rb; M = Ba, Ca) New Journal of Chemistry, 2019, 43, 7839 |
| 7053133 | CIF | C18 H26 N10 O4 | P -1 | 6.928; 8.2326; 10.864 74.659; 74.897; 68.18 | 545.56 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Shamshina, Julia L.; Beasley, Preston A.; McCrary, Parker D.; Kelley, Steven P.; Rogers, Robin D. Azolium azolates from reactions of neutral azoles with 1,3-dimethyl-imidazolium-2-carboxylate, 1,2,3-trimethyl-imidazolium hydrogen carbonate, and N,N-dimethyl-pyrrolidinium hydrogen carbonate New Journal of Chemistry, 2013, 37, 1461 |
| 7053976 | CIF | C H6 N4 O4 | P 1 21/n 1 | 3.701; 13.875; 10.753 90; 98.833; 90 | 545.6 | Joo, Young-Hyuk; Min, Byoung Sun Denitration of hydrazinium nitroformate to form hydrazinium dinitromethanide New Journal of Chemistry, 2014, 38, 50 |
| 7054646 | CIF | C24 H26 N6 O4 | P -1 | 5.5146; 6.81; 15.254 79.288; 85.259; 75.952 | 545.62 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7061950 | CIF | C12 H12 N2 O3 | P -1 | 5.632; 8.3085; 12.2276 85.953; 80.093; 75.863 | 546.33 | Zhao, Lan; Xu, Jun; Ma, Jun; Yin, Guangwei; Li, Fangyi; Suo, Tongchuan; Wang, Chunhua Formal [4+1] cyclization of (thio/imido)hydrazides and ethyl 3,3,3-trifluoropropanoate: unified synthesis of 1,3,4-oxadiazoles, 1,3,4-thiadiazoles and 1,2,4-triazoles New Journal of Chemistry, 2022, 46, 20755-20759 |
| 7053363 | CIF | C12 H9 N3 O2 S | P -1 | 7.273; 8.8712; 9.7087 81.238; 70.799; 67.737 | 547.19 | Semeniuc, Radu F.; Reamer, Thomas J.; Smith, Mark D. 8-Quinoline based ligands and their metallic derivatives: A structural and statistical investigation of quinoline π‒π stacking interactions New Journal of Chemistry, 2010, 34, 439 |
| 7052667 | CIF | C18 H42 N4 O4 | P -1 | 5.1973; 7.3964; 15.0141 103.295; 92.698; 101.711 | 547.33 | Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M. Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes New Journal of Chemistry, 2011, 35, 1515 |
| 7050837 | CIF | C2 H5 Cu O4 P | P 1 21/c 1 | 9.8699; 7.6192; 7.3171 90; 95.803; 90 | 547.432 | Menaa, Bouzid; Kariuki, Benson M.; Shannon, Ian J. Preparation using metal oxide precursors and crystal structures of the copper and zinc vinylphosphonate materials M(O3PC2H3)·H2O (M = Cu, Zn)Electronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams in CHIME format. See http://www.rsc.org/suppdata/nj/b2/b200438k/ New Journal of Chemistry, 2002, 26, 906 |
| 7050633 | CIF | C18 H14 F4 I2 N2 S2 | P -1 | 6.916; 7.7021; 10.6364 80.528; 78.781; 85.991 | 547.75 | Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br) New Journal of Chemistry, 2003, 27, 1522 |
| 7063201 | CIF | C28 H20 N4 O2 | P -1 | 6.4328; 9.342; 9.841 105.347; 105.02; 91.233 | 548.2 | Baskar, Shyamvarnan; Kole, Goutam Kumar 3-Pyridylvinyl benzoxazole derived multifunctional organic materials - from solid state photoreactivity to photophysical and electrochemical properties New Journal of Chemistry, 2024 |
| 7062599 | CIF | C14 H16 Cd Cl2 N4 O10 | P -1 | 7.931; 8.7815; 9.6095 102.03; 108.05; 112.01 | 548.5 | Notash, Behrouz; Barzegar Tilenoie, Ommolbanin; Naghavi, S. Shahab Anion-induced structural diversity in cadmium coordination polymers of 4-aminobenzonitrile: a structural and DFT study New Journal of Chemistry, 2023, 47, 15209-15218 |
| 7050960 | CIF | C8 H14 S4 | P -1 | 6.486; 7.358; 12.386 101.2; 95.68; 106.4 | 548.8 | Chen, Wang; Lam, Yu-Lin; Wong, Ming Wah; Huang, Hsing Hua; Liang, Eping Gauche/trans equilibria of 2,2'-bi-1,3-dioxolanyl, 2,2'-dimethyl-2,2'-bi-1,3-dioxolanyl, 2,2'-bi-1,3-dithiolanyl and 2,2'-dimethyl-2,2'-bi-1,3-dithiolanyl in different media–theory and experiment New Journal of Chemistry, 2002, 26, 1686-1692 |
| 7052014 | CIF | C4 H3 Br N2 O2 | P 1 21/n 1 | 8.568; 6.8823; 9.5715 90; 103.44; 90 | 548.95 | Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L. The observed and energetically feasible crystal structures of 5-substituted uracils New Journal of Chemistry, 2008, 32, 1761 |
| 7056162 | CIF | C12 H22 Cl8 Mo2 N2 | P -1 | 6.6315; 7.648; 11.839 106.915; 96.903; 102.798 | 549.1 | Bartalucci, Niccolò; Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Schoch, Silvia; Zacchini, Stefano Unusual activation pathways of amines in the reactions with molybdenum pentachloride New J. Chem., 2017 |
| 7062616 | CIF | C10 H8 Cl2 Cu2 N2 | P 1 21/c 1 | 3.7727; 12.743; 11.4596 90; 94.32; 90 | 549.36 | Yang, Shaolong; Chen, Yuhuan; Li, Shixiong; Chen, Huijun Efficient photocatalytic performance and the mechanism of copper(i) metal–organic framework nanosheets New Journal of Chemistry, 2023, 47, 15348-15356 |
| 7050288 | CIF | C8 H14 F3 P S | P -1 | 6.6533; 8.881; 9.771 82.31; 74.07; 86.98 | 550.09 | Alan Brisdon; Nicholas A. Barnes; F.R.William, Brown; Wendy Cross; Ian R. Crossley; Cheryl Fish; James V. Morey; Robin G. Pritchard; Lakhdar Sekhri The synthesis and chemistry of fluorovinyl-containing phosphines, and the single crystal X-ray structure of SPPri2(CF=CF2). New J.Chem.(Nouv.J.Chim.), 2004 |
| 7058115 | CIF | C10 H18 Cl6 Fe2 N4 O | P -1 | 7.3221; 7.5071; 10.4916 102.996; 100.472; 92.433 | 550.47 | Scé, Fabio; Cano, Israel; Martin, Carmen; Beobide, Garikoitz; Castillo, Óscar; de Pedro, Imanol Comparing conventional and microwave-assisted heating in PET degradation mediated by imidazolium-based halometallate complexes New Journal of Chemistry, 2019, 43, 3476 |
| 7053223 | CIF | C3 H12 N12 O3 | P -1 | 6.9336; 7.9708; 10.6766 103.98; 97.668; 100.985 | 552.023 | Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee Energetic salts based on 1-methoxy-5-nitroiminotetrazole New Journal of Chemistry, 2013, 37, 1180 |
| 7059606 | CIF | C3 H4 N4 O3 | P 1 21/n 1 | 8.6101; 6.402; 10.0437 90; 93.826; 90 | 552.39 | Yang, Rui; Dong, Zhen; Ye, Zhiwen Exploration of low-melting energetic compounds: influence of substituents on melting points New Journal of Chemistry, 2020, 44, 13576-13583 |
| 7050100 | CIF | C6 H18 N4 O4 | P 1 21/c 1 | 5.2046; 7.3638; 14.6064 90; 98.604; 90 | 553.5 | Lee, Sang-Ok; Kariuki, Benson M.; Harris, Kenneth D. M. Hydrogen-bonded chains of α,ω-diaminoalkane and α,ω-dihydroxyalkane guest molecules lead to disrupted tunnel structures in urea inclusion compounds New Journal of Chemistry, 2005, 29, 1266 |
| 7061031 | CIF | C16 H14 Mn N8 O10 | P -1 | 6.963; 8.591; 10.532 105.2; 97.89; 109.8 | 554 | Gurskiy, Stanislav I.; Maklakov, Sergey S.; Dmitrieva, Natalia E.; Tafeenko, Viktor A. Effects of transition metal cations and temperature on the luminescence of a 3-cyano-4-dicyanomethylene-5-oxo-4,5-dihydro-1H-pyrrole-2-olate anion New Journal of Chemistry, 2021, 45, 21684-21691 |
| 7061233 | CIF | C10 H8 Hg N2 S2 | C 1 2 1 | 15.0093; 4.0809; 11.0604 90; 125.104; 90 | 554.24 | Lobana, Tarlok S.; Sandhu, Amanpreet K.; Hundal, Geeta; Jasinski, Jerry P. Heterocyclic-2-thione derivatives of metals incorporating cyclopalladated azobenzenes of variable nuclearity and N,S-bridged 1D polymer of [bis(pyridine-2-thiolato)mercury(ii)] New Journal of Chemistry, 2022, 46, 2722-2729 |
| 7051515 | CIF | C8 H10 N4 O4 S | P 1 21 1 | 8.4703; 7.9; 8.9145 90; 111.568; 90 | 554.75 | Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Smiglak, Marcin; Holbrey, John D.; Reichert, W. Matthew; Rogers, Robin D. Strategies toward the design of energetic ionic liquids: nitro- and nitrile-substituted N,N′-dialkylimidazolium salts New Journal of Chemistry, 2006, 30, 349 |
| 7062709 | CIF | C6 H8 Ag Cl N4 O7 | P 1 21/m 1 | 5.0231; 10.8971; 10.2026 90; 96.6; 90 | 554.76 | Zhang, Chao; Wang, Ting-wei; Lu, Zu-jia; Yi, Zhen-xin; Kuang, Bao-long; Xie, Zhi-ming; Li, Yan; Zhang, Jian-guo Constructing a graphene-like structure to lower friction sensitivity: Ag(i) complexes based on furan-2,5-dicarbohydrazide New Journal of Chemistry, 2023, 47, 17592-17598 |
| 7057343 | CIF | Ba H6 N4 O11 Pt | P -1 | 8.3841; 8.422; 9.5643 81.036; 71.001; 60.479 | 555.65 | Zadesenets, Andrey V.; Filatov, Evgeniy Yu.; Plyusnin, Pavel E.; Asanova, Tatyana I.; Korolkov, Ilya V.; Baidina, Iraida A.; Shlyakhova, Elena V.; Asanov, Igor P.; Korenev, Sergey V. Complex salts of Pd(ii) and Pt(ii) with Co(ii) and Ni(ii) aqua-cations as single-source precursors for bimetallic nanoalloys and mixed oxides New Journal of Chemistry, 2018, 42, 8843 |
| 7052403 | CIF | C22 H16 Cu N10 O6 | P -1 | 7.03; 9.039; 9.806 76.783; 75.962; 68.6 | 556 | Sumby, Christopher J.; Steel, Peter J. An investigation of the coordination chemistry of the hexadentate ligand di-2-pyridylketone azine; the formation of a discrete tetranuclear complex with silver nitrate New Journal of Chemistry, 2005, 29, 1077 |
| 7059941 | CIF | C10 H5 Cl F3 N3 O2 | P -1 | 6.6403; 8.1037; 11.1004 106.45; 101.623; 93.168 | 557.1 | Espitia Cogollo, E.; Piro, O. E.; Echeverría, G. A.; Tuttolomondo, M. E.; Pérez, H.; Jios, J. L.; Ulic, S. E. Hydrogen bonding interactions in fluorinated 1,2,3-triazole derivatives New Journal of Chemistry, 2020, 44, 16006-16019 |
| 7058407 | CIF | C9 H12 Cl N5 O2 | P -1 | 5.739; 9.8258; 10.4109 72.819; 85.079; 85.218 | 557.77 | García-Raso, Angel; Terrón, Angel; López-Zafra, Adela; García-Viada, Andrés; Barta, Agostina; Frontera, Antonio; Lorenzo, Julia; Rodríguez-Calado, Sergi; Vázquez-López, Ezequiel M.; Fiol, Juan J. Crystal structures of N6-modified-amino acid related nucleobase analogs (II): hybrid adenine-β-alanine and adenine-GABA molecules New Journal of Chemistry, 2019, 43, 9680 |
| 7051019 | CIF | Cl9 H4 K O2 Re6 Se5 | R -3 :R | 8.892; 8.892; 8.892 65.63; 65.63; 65.63 | 557.92 | Santiago Uriel; Kamal Boubekeur; Patrick Batail; Jesus Orduna; André Perrin Inertness of the [Re6Se5Cl3]5+ cluster core to substitution by OH− in organic solutions: synthesis, structural and liquid secondary ion mass spectroscopy characterization of K(H2O)2[Re6Se5Cl9] and (n-Bu4N)[Re6Se5Cl9] and the crystal structure of (n-Bu4N)2[Re6Se6Cl8] New J. Chem., 2001, 25, 737-740 |
| 7055495 | CIF | C4 H8 N16 O2 | P -1 | 7.972; 8.1923; 10.269 90.378; 110.218; 115.52 | 558.28 | Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Wu, Le Energetic salts based on 3-hydrazino-4-amino-1,2,4-triazole (HATr): synthesis and properties New J. Chem., 2016, 40, 5414 |
| 7062430 | CIF | C16 H18 Cu3 N8 O12 | P -1 | 5.3873; 6.9457; 15.7187 90.039; 90.275; 108.287 | 558.46 | Klongdee, Fatima; Sasada, Yuto; Nakano, Motohiro; Chainok, Kittipong; Youngme, Sujittra; Boonmak, Jaursup Synthesis, X-ray structures, and magnetic properties of seven polynuclear Cu(ii) complexes containing pyrazole-3,5-dicarboxylate with various ancillary ligands New Journal of Chemistry, 2023, 47, 9669-9680 |
| 7058954 | CIF | C6 H10 Br10 Cu3 N6 | P -1 | 3.9511; 12.1653; 12.6022 67.66; 89.706; 86.172 | 558.89 | Berezin, Alexey Sergeevich; Komarovskikh, Andrey; Syrokvashin, Mikhail M.; Sheven, Dmitry G.; Komarov, Vladislav Trinuclear Copper(II) Bromide Complex [C3H5N3Br]2n[Cu3Br8]n. Structure, Magnetic Properties and DFT calculations. New Journal of Chemistry, 2019 |
| 7056204 | CIF | C4 H5 N7 O10 | P 1 21 1 | 7.1401; 7.804; 10.6428 90; 109.113; 90 | 560.34 | Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Yang, Hongwei An interesting ring cleavage of 1,2,4-oxadiazole ring New J. Chem., 2017 |
| 7054652 | CIF | C24 H26 N6 O4 | P -1 | 5.0121; 7.8964; 15.1589 78.403; 88.333; 72.636 | 560.62 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7050559 | CIF | C8 H10 Cu N4 O6 | P -1 | 6.9893; 9.2227; 9.8112 102.266; 106.779; 103.527 | 561.45 | José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes New J. Chem., 2003, 27, 1775-1783 |
| 7062445 | CIF | C2 H6 Cu O6 | P 1 21/c 1 | 8.4955; 7.0739; 9.4178 90; 97.021; 90 | 561.73 | Trivedi, Manoj; Singh, Gurmeet; Sharma, Raj Kishore; Rath, Nigam P.; Husain, Ahmad Synthetic, spectral, structural and catalytic activities of 3-D metal format/acetate framework materials for CO2 conversion New Journal of Chemistry, 2023, 47, 10585-10592 |
| 7054114 | CIF | Mo3 O12 Y2 | P -4 21 m | 7.2927; 7.2927; 10.5726 90; 90; 90 | 562.29 | Laufer, Sonja; Strobel, Sabine; Schleid, Thomas; Cybinska, Joanna; Mudring, Anja-Verena; Hartenbach, Ingo Yttrium(iii) oxomolybdates(vi) as potential host materials for luminescence applications: an investigation of Eu3±doped Y2[MoO4]3 and Y2[MoO4]2[Mo2O7] New Journal of Chemistry, 2013, 37, 1919 |
| 7057566 | CIF | C9 H12 N6 O4 | P 1 21 1 | 4.7539; 11.6942; 10.3125 90; 100.378; 90 | 563.92 | García-Raso, Angel; Terrón, Angel; Bauzá, Antonio; Frontera, Antonio; Molina, Jhon J.; Vázquez-López, Ezequiel M.; Fiol, Juan J. Crystal structures of N6-modified-aminoacid/peptide nucleobase analogs: hybrid adenine‒glycine and adenine‒glycylglycine molecules New Journal of Chemistry, 2018, 42, 14742 |
| 7054189 | CIF | C12 H16 Cu3 N22 | P -1 | 7.4717; 8.9361; 9.391 76.781; 75.283; 71 | 566.1 | Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide New Journal of Chemistry, 2014, 38, 3529 |
| 7050263 | CIF | C12 H8 Cu I N2 | P -1 | 7.6507; 9.0871; 9.1094 96.74; 104.05; 109.21 | 566.55 | Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand New J.Chem.(Nouv.J.Chim.), 2004 |
| 7050289 | CIF | C9 H13 Cl Cu N2 O3 | P 1 21 1 | 4.0185; 19.4997; 7.2382 90; 92.118; 90 | 566.79 | N.Tounsi; L.Dupont; C.Cadiou; A.Mohamadou; R.Plantier-Royon; F.Massicot; C.Portella; M.Aplincourt Complexes of amidic ligands derived from lactic acid: Equilibrium, synthesis and crystal structure of copper(II) complexes. New J.Chem.(Nouv.J.Chim.), 2004 |
| 7050383 | CIF | C9 H17 N O2 S | P 1 21 1 | 5.764; 16.888; 6.447 90; 115.2; 90 | 567.8 | Lech Kozerski; Brunon Kwiecień; Robert Kawęcki; Zofia Urbańczyk-Lipkowska; Wojciech Bocian; Elżbieta Bednarek; Jerzy Sitkowski; Jan Maurin; Leszek Pazderski; Poul E. Hansen Hydrogen bonds in “push-pull” enamines New J. Chem., 2004, 28, 1562-1567 |
| 7056072 | CIF | Mg5 Na7 O28 P8 | P -1 | 6.3932; 9.4219; 10.9116 64.711; 80.374; 73.543 | 569.13 | Ma, Ruru; Yang, Yun; Pan, Shilie; Sun, Yanzhou; Yang, Zhihua Structure comparison and optical properties of Na7Mg4.5(P2O7)4: a sodium magnesium phosphate with isolated P2O7 units New J. Chem., 2017, 41, 3399 |
| 7050507 | CIF | C16 H28 O2 S2 Si4 | P -1 | 6.7411; 8.2744; 11.4404 72.939; 72.984; 73.38 | 569.18 | Audrey Moores; Christian Defieber; Nicolas Mézailles; Nicole Maigrot; Louis Ricard; Pascal Le Floch Siloxa-bridged-cyclophanes featuring benzene, thiophene and pyridine units New J. Chem., 2003, 27, 994-999 |
| 7059101 | CIF | C5 H14 Cl2 N2 O2 Pt S | P -1 | 7.795; 8.6094; 9.4837 99.166; 91.628; 114.355 | 569.27 | Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu. Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity New Journal of Chemistry, 2017, 41, 6840 |
| 7053541 | CIF | C6 H4 Ag N O2 | P 1 21/c 1 | 3.6484; 10.844; 14.425 90; 93.79; 90 | 569.45 | Kalf, Irmgard; Mathieu, Patrick; Englert, Ulli From crystal to crystal: a new polymorph of (4-carboxylatopyridine)silver(i) by topotactic dehydration of its monohydrate New Journal of Chemistry, 2010, 34, 2491 |
| 7050989 | CIF | C8 H10 Co0.5 N7 S | P -1 | 8.6002; 9.6688; 7.8745 107.718; 112.927; 77.416 | 570.77 | Qihua Zhao; Haifang Li; Xiaofeng Wang; Zhida Chen Synthesis and structure of a one-dimensional cobalt(II) coordination polymer with 1,3-bis(1,2,4-triazol-1-yl)propane New Journal of Chemistry, 2002 |
| 7051335 | CIF | C5 H19 Br2 N3 O | P 1 21 1 | 4.8037; 11.005; 10.871 90; 95.63; 90 | 571.9 | New Journal of Chemistry, 2000 |
| 7059036 | CIF | C24 H34 N4 O2 | P -1 | 6.0163; 7.4951; 13.488 105.57; 100.446; 93.766 | 571.97 | Rocha, Mariana; Ruiz, María Carolina; Echeverría, Gustavo A.; Piro, Oscar E.; Leon, Ignacio; Di Virgilio, Ana Laura; Frontera, Antonio; Gil, Diego Mauricio Diethylaminophenyl-based Schiff base Cu(II) and V(IV) complexes: experimental and theoretical study and cytotoxicity assays New Journal of Chemistry, 2019 |
| 7058370 | CIF | Ca F O4 P Rb2 | P n m a | 12.895; 5.97; 7.436 90; 90; 90 | 572.4 | Chai, Kun; Cheng, Shichao; Li, Hongyi; Dai, Bin Modulation of perovskite-related frameworks induced by alkaline earth metals in phosphate fluorides A2MPO4F (A = K, Rb; M = Ba, Ca) New Journal of Chemistry, 2019, 43, 7839 |
| 7050784 | CIF | C6 H6 Br2 | P 32 2 1 | 8.721; 8.721; 8.701 90; 90; 120 | 573.1 | Vasilyev, Alexandr V.; Lindeman, Sergey V.; Kochi, Jay K. Molecular structures of the metastable charge-transfer complexes of benzene (and toluene) with bromine as the pre-reactive intermediates in electrophilic aromatic bromination New Journal of Chemistry, 2002, 26, 582 |
| 7060278 | CIF | C6 H6 N10 O5 | P -1 | 7.206; 9.3911; 9.4448 71.6516; 85.772; 71.196 | 574 | Gettings, Matthew L.; Byrd, Edward F. C.; Zeller, Matthias; Piercey, Davin Methyl sydnone imine and its energetic salts New Journal of Chemistry, 2021, 45, 2228-2236 |
| 7053601 | CIF | C14 H28 Cu N8 O14 | P -1 | 7.4582; 9.4917; 9.6997 113.399; 106.638; 98.603 | 576.1 | Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W. Metal-induced gelation in dipyridyl ureas New Journal of Chemistry, 2010, 34, 2261 |
| 7060570 | CIF | C22 H18 Cu N12 O4 | P -1 | 5.543; 9.8667; 10.8819 86.805; 82.711; 77.543 | 576.19 | Melnic, Elena; Kravtsov, Victor Ch.; Lucenti, Elena; Cariati, Elena; Forni, Alessandra; Siminel, Nikita; Fonari, Marina S. Regulation of π⋯π stacking interactions between triimidazole luminophores and comprehensive emission quenching by coordination to Cu(ii) New Journal of Chemistry, 2021, 45, 9040-9052 |
| 7062145 | CIF | C13 H9 F N2 Se | P -1 | 6.9606; 7.423; 12.516 74.399; 77.913; 68.957 | 576.72 | Turcio-García, Luis Ángel; Valdés, Hugo; Arenaza-Corona, Antonino; Hernández-Ortega, Simón; Morales-Morales, David Electronic properties and supramolecular study of selenoureas with fluorinated-NHC ligands derived from imidazo[1,5-a]pyridines New Journal of Chemistry, 2023, 47, 2090-2095 |
| 7061425 | CIF | C11 H10 Cl2 N O3 | P -1 | 7.3335; 8.027; 10.9917 95.693; 95.999; 114.74 | 577.07 | Li, Jiulong; Li, Chang; Ji, Xu; Sun, Qin; Li, Zhi; Liu, He; Zhou, Lina; Jing, Dingding; Gong, Junbo; Chen, Wei Combined virtual and experimental screening of multicomponent crystals of 2,4-dichlorophenoxyacetic acid New Journal of Chemistry, 2022, 46, 8708-8719 |
| 7052498 | CIF | C12 H11 N3 O3 | P -1 | 7.126; 7.635; 11.337 102.33; 103.28; 96.74 | 577.4 | George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones New Journal of Chemistry, 2003, 27, 568 |
| 7054625 | CIF | C2 H8 O8 Zn | P 31 2 1 | 7.42; 7.42; 12.11 90; 90; 120 | 577.41 | Mei, Hong-Xin; Zhang, Ting; Wang, Dan-Feng; Huang, Rong-Bin; Zheng, Lan-Sun A Zn-oxalate helix linked by a water helix: spontaneous chiral resolution of a Zn helical coordination polymer New J. Chem., 2015, 39, 2075 |
| 7054626 | CIF | C2 H8 O8 Zn | P 32 2 1 | 7.42; 7.42; 12.11 90; 90; 120 | 577.41 | Mei, Hong-Xin; Zhang, Ting; Wang, Dan-Feng; Huang, Rong-Bin; Zheng, Lan-Sun A Zn-oxalate helix linked by a water helix: spontaneous chiral resolution of a Zn helical coordination polymer New J. Chem., 2015, 39, 2075 |
| 7056941 | CIF | C12 H9 Fe N3 O3 | P -1 | 5.875; 7.3536; 14.1683 76.132; 79.333; 79.249 | 577.47 | Erb, William; Levanen, Gael; Roisnel, Thierry; Dorcet, Vincent Application of the Curtius rearrangement to the synthesis of 1′-aminoferrocene-1-carboxylic acid derivatives New Journal of Chemistry, 2018, 42, 3808 |
| 7054745 | CIF | C10 H8 N3 O6 V | C 1 2 1 | 9.3492; 12.426; 6.436 90; 129.421; 90 | 577.59 | Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives New J. Chem., 2015, 39, 4265 |
| 7057747 | CIF | C14 H12 N2 O2 | P 1 21/c 1 | 4.9045; 11.022; 10.913 90; 101.589; 90 | 577.9 | Biancalana, Lorenzo; Fulignati, Sara; Antonetti, Claudia; Zacchini, Stefano; Provinciali, Giacomo; Pampaloni, Guido; Raspolli Galletti, Anna Maria; Marchetti, Fabio Ruthenium p-cymene complexes with α-diimine ligands as catalytic precursors for the transfer hydrogenation of ethyl levulinate to γ-valerolactone New Journal of Chemistry, 2018, 42, 17574 |
| 7050290 | CIF | C9 H13 Br Cu N2 O3 | P 1 21 1 | 4.0535; 19.3293; 7.3828 90; 92.357; 90 | 577.96 | N.Tounsi; L.Dupont; C.Cadiou; A.Mohamadou; R.Plantier-Royon; F.Massicot; C.Portella; M.Aplincourt Complexes of amidic ligands derived from lactic acid: Equilibrium, synthesis and crystal structure of copper(II) complexes. New J.Chem.(Nouv.J.Chim.), 2004 |
| 7055600 | CIF | C13 H5 F5 O2 | P 1 21 1 | 6.634; 4.733; 18.468 90; 92.01; 90 | 579.5 | Faurie, Alexandre; Mallet, Charlotte; Allain, Magali; Skene, W. G.; Frère, Pierre Topological and packing mode modification for solid-state emission enhancement of bis(perfluorostyryl)furan derivatives New J. Chem., 2016, 40, 6728 |
| 7051214 | CIF | C12 H8 Br Cu N2 | P -1 | 7.2313; 8.9917; 9.4175 84.667; 81.705; 73.315 | 579.57 | Bosch, Eric; Barnes, Charles L. Crystal structure of kinetic and thermodynamic coordination networks formed between 3,3′-dipyridylethyne and copper bromide New Journal of Chemistry, 2001, 25, 1376 |
| 1549208 | CIF | C9 H16 O5 S | P 1 21 1 | 7.7445; 7.536; 9.9477 90; 92.123; 90 | 580.17 | Pisareva, A. V.; Shilov, G. V.; Karelin, A. I.; Pisarev, R. V.; Shilova, I. A.; Dobrovolsky, Yu A.; Aldoshin, S. M. Synthesis, structure and proton conductivity of 2,4,5-trimethylbenzenesulfonic acid dihydrate New Journal of Chemistry, 2018, 42, 7428 |
| 7053471 | CIF | C19 H21 Cu N7 O3 S2 | P -1 | 7.3067; 8.9226; 9.7407 76.265; 88.597; 70.435 | 580.21 | Rajput, Lalit; Biradha, Kumar Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion New Journal of Chemistry, 2010, 34, 2415 |
| 7052714 | CIF | C11 H14 N4 O2 | P 1 | 7.7765; 8.343; 9.3377 91.786; 106.387; 90.049 | 580.9 | Jozak, Thomas; Sun, Yu; Thiel, Werner R. Synthesis, characterization and co-ordination chemistry of dioxolanedipyrazoles New Journal of Chemistry, 2011, 35, 2114 |
| 7054484 | CIF | C4 H10 N14 O3 | P -1 | 3.7659; 11.0046; 14.3912 97.056; 95.04; 98.978 | 581.14 | Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R. Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles New J. Chem., 2015, 39, 1619 |
| 7055913 | CIF | C6 H10 N10 O4 | P -1 | 8.0321; 8.2137; 10.1222 73.271; 80.987; 65.449 | 581.19 | Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Lin, Qiuhan; Yang, Hongwei Compounds based on 3-amino-4-(5-methyl-1,2,4-oxadiazol-3-yl)furazan as insensitive energetic materials New J. Chem., 2017, 41, 1202 |
| 7061322 | CIF | C12 H10 N2 O4 S | P -1 | 5.4648; 10.4074; 10.6121 82.244; 81.501; 78.883 | 582.19 | Robles-Marín, Elvis; Flores-Alamo, Marcos; Garcia, Juventino J. Electrochemical activation of CO2 by MOF-(Fe, Ni, Mn) derivatives of 5-aminoisophthalic acid and the thiazole group influence on its catalytic activity New Journal of Chemistry, 2022, 46, 6060-6067 |
| 7055429 | CIF | C14 H9 F4 N O | P -1 | 5.353; 6.963; 16.666 80.519; 88.584; 71.932 | 582.3 | Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids New J. Chem., 2016, 40, 4981 |
| 7056437 | CIF | C3 H N5 O3 | P 1 21/n 1 | 5.5357; 9.1337; 11.5261 90; 91.852; 90 | 582.47 | Du, Yao; Zhang, Ji-Chuan; peng, Panpan; Su, Hui; Li, Sheng-Hua; Pang, Si-Ping Synthesis and characterization of three pyrazolate inner diazonium salts: green, powerful and stable primary explosives New J. Chem., 2017 |
| 7056911 | CIF | C8 H12 N6 O6 | P 1 21/c 1 | 6.9409; 5.1266; 16.585 90; 98.805; 90 | 583.19 | Ma, Qing; Gu, Hao; Huang, Jinglun; Nie, Fude; Fan, Guijuan; Liao, Longyu; Yang, Wei Formation of trinitromethyl functionalized 1,2,4-triazole-based energetic ionic salts and a zwitterionic salt directed by an intermolecular and intramolecular metathesis strategy New Journal of Chemistry, 2018, 42, 2376 |
| 7052494 | CIF | C12 H11 Br N2 O | P -1 | 7.1084; 7.4863; 11.923 99.788; 107.055; 98.477 | 584.51 | George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones New Journal of Chemistry, 2003, 27, 568 |
| 7051167 | CIF | C12 H16 N2 | P 1 21/n 1 | 7.3831; 8.2193; 9.7902 90; 100.292; 90 | 584.55 | Yu-Lin Lam; Ming Wah Wong; Hsing Hua Huang; Eping Liang Conformational Analysis of Meso- and (±)- 2,3-Dicyano-2,3-Dicyclopropylbutane and 1,2-Dicyanotetracyclopropylethane New Journal of Chemistry, 2001 |
| 7062434 | CIF | C20 H20 Cu2 N8 O10 | P -1 | 6.338; 7.373; 13.513 76.802; 82.568; 72.681 | 585.6 | Klongdee, Fatima; Sasada, Yuto; Nakano, Motohiro; Chainok, Kittipong; Youngme, Sujittra; Boonmak, Jaursup Synthesis, X-ray structures, and magnetic properties of seven polynuclear Cu(ii) complexes containing pyrazole-3,5-dicarboxylate with various ancillary ligands New Journal of Chemistry, 2023, 47, 9669-9680 |
| 7054584 | CIF | C2 H8 B3 N2 O9 Zn4 | P 1 21/c 1 | 8.398; 4.9346; 14.205 90; 95.64; 90 | 585.8 | Jiang, Xiangzhan; Yang, Yun; Pan, Shilie; Han, Jian; Dong, Xiaoyu; Zhang, Fangyuan; Yu, Hongwei; Wang, Ying Zn4B3O9C2H8N2: an organic‒inorganic hybrid borate with a novel graphene-like layer New J. Chem., 2014, 38, 6025 |
| 7062240 | CIF | C15 H12 O3 | P 1 21 1 | 8.3998; 5.6694; 12.814 90; 106.089; 90 | 586.32 | Jeong, Taejoo; Okanishi, Yusuke; Yotsui, Sora; Kim, In Su; Yoshimitsu, Takehiko Organic redox cascade cyclization of 2-alkynylquinones by ascorbic acid in combination with a copper catalyst and its application to formal synthesis of liphagal New Journal of Chemistry, 2023, 47, 3425-3429 |
| 7061384 | CIF | C13 H13 N O4 | P -1 | 8.283; 8.309; 9.834 81.847; 84.967; 61.229 | 587.1 | Sarkar, Rumpa; Samanta, Surya Kanta; Hasija, Avantika; Chopra, Deepak; Ganguly, Debabani; Bera, Mrinal K. A practical route to arylated dihydroacridine derivatives via nickel boride mediated intramolecular reductive cyclization-concomitant dehydration New Journal of Chemistry, 2022, 46, 7168-7176 |
| 7051557 | CIF | C18 H24 N6 O6 S2 | P -1 | 6.814; 8.759; 11.015 67.536; 76.657; 79.036 | 587.32 | Wallace, Karl J.; Morey, Jeroni; Lynch, Vincent M.; Anslyn, Eric V. Colorimetric detection of chemical warfare simulants New Journal of Chemistry, 2005, 29, 1469 |
| 7054111 | CIF | C14 H28 Mg2 N2 O19 | P -1 | 7.0638; 8.9852; 9.6628 83.104; 75.593; 83.597 | 587.58 | Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C. Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes New Journal of Chemistry, 2014, 38, 2135 |
| 7058570 | CIF | C4 H3 N3 O4 | P 21 21 21 | 6.5935; 7.7118; 11.559 90; 90; 90 | 587.75 | Thaltiri, Vikranth; Chavva, Kurumurthy; Kumar, B. Sathish; Panda, Pradeepta K. Efficient synthesis of N-methyltetranitropyrrole: A stable, insensitive and high energy melt-castable material New Journal of Chemistry, 2019, 43, 12318 |
| 7054647 | CIF | C26 H30 N6 O4 | P -1 | 5.6196; 6.7825; 16.078 87.236; 82.669; 75.451 | 588.2 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7062333 | CIF | Ba Ce Cu S3 | P n m a | 10.674; 4.12; 13.409 90; 90; 90 | 589.69 | Shahid, Omair; Yadav, Sweta; Maity, Debanjan; Deepa, Melepurath; Niranjan, Manish K.; Prakash, Jai Synthesis, crystal structure, DFT, and photovoltaic studies of BaCeCuS3 New Journal of Chemistry, 2023, 47, 5378-5389 |
| 7051297 | CIF | C6 H8 N2 | P 1 21/c 1 | 7.8108; 6.5509; 12.164 90; 108.613; 90 | 589.9 | New Journal of Chemistry, 2000 |
| 7057780 | CIF | C20 H16 Cl2 Cu2 N4 S0.55 Se3.45 | P -1 | 8.0642; 8.671; 9.5068 82.409; 73.892; 67.818 | 591.11 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
| 7051146 | CIF | C13 H11 N S Se | P -1 | 8.6112; 8.8243; 9.2589 75.17; 71.033; 63.78 | 591.64 | Boryczka, Stanisław; Rozenberg, Mark S.; Schreurs, Antoine M. M.; Kroon, Jan; Starikov, Evgeni B.; Steiner, Thomas A short C‒H···N hydrogen bond with a very strong IR spectroscopic effect New Journal of Chemistry, 2001, 25, 1111 |
| 7052140 | CIF | C8 H5 F3 N2 | P 32 | 12.5397; 12.5397; 4.3463 90; 90; 120 | 591.87 | Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles New Journal of Chemistry, 2007, 31, 936 |
| 7059772 | CIF | C5 H7 Au Br4 N2 | P -1 | 7.8576; 8.7084; 9.563 110.766; 92.548; 102.567 | 591.87 | Jääskeläinen, Sirpa; Koshevoy, Igor O.; Suvanto, Sari; Ryhänen, Tiina; Hirva, Pipsa Vinylimidazole coordination modes to Pt and Au metal centers New Journal of Chemistry, 2020, 44, 12762-12770 |
| 7051958 | CIF | C15 H11 N O4 | P -1 | 7.553; 8.305; 10.514 68.89; 80.78; 75.12 | 592.9 | Altamura, Maria; Dapporto, Paolo; Guidi, Antonio; Harmat, Nicholas J. S.; Jierry, Loïc; Libralesso, Elisa; Paoli, Paola; Rossi, Patrizia Investigation on the flexibility of chiral tricyclic derivatives New Journal of Chemistry, 2008, 32, 1617 |
| 7062142 | CIF | C13 H7 F3 N2 Se | P -1 | 7.2127; 7.3918; 12.6208 89.679; 84.022; 62.497 | 592.9 | Turcio-García, Luis Ángel; Valdés, Hugo; Arenaza-Corona, Antonino; Hernández-Ortega, Simón; Morales-Morales, David Electronic properties and supramolecular study of selenoureas with fluorinated-NHC ligands derived from imidazo[1,5-a]pyridines New Journal of Chemistry, 2023, 47, 2090-2095 |
| 7058270 | CIF | C26 H24 Cu N2 O4 S2 | P -1 | 5.2558; 10.5965; 11.1192 99.818; 91.255; 102.935 | 593.54 | Rodríguez, María R.; Del Plá, Julián; Balsa, Lucía M.; León, Ignacio E.; Piro, Oscar E.; Echeverría, Gustavo A.; García-Tojal, Javier; Pis-Diez, Reinaldo; Parajón-Costa, Beatriz S.; González-Baró, Ana C. Cu(ii) and Zn(ii) complexes with a poly-functional ligand derived from o-vanillin and thiophene. Crystal structure, physicochemical properties, theoretical studies and cytotoxicity assays against human breast cancer cells New Journal of Chemistry, 2019, 43, 7120 |
| 7052221 | CIF | C13 H15 N3 O | P -1 | 8.0162; 8.0603; 10.4542 97.253; 106.06; 109.335 | 594.57 | Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John How robust is the hydrogen-bonded amide ‘ladder’ motif? New Journal of Chemistry, 2007, 31, 2044 |
| 7051045 | CIF | C16 H40 N6 Ni O4 | P -1 | 7.4721; 7.531; 11.0761 93.4149; 102.042; 100.486 | 596.29 | Rahaman Laskar, Inamur; Das, Debasis; Mostafa, Golam; Lu, Tian-Huey; Keng, Tai-Chiun; Wang, Ju-Chun; Ghosh, Ashutosh; Ray Chaudhuri, Nirmalendu First report on thermally induced nitro→nitrito(O,O) linkage isomerization in diamine complexes of nickel(II) in the solid state: X-ray single crystal structural analyses of nitro and nitrito isomers New Journal of Chemistry, 2001, 25, 764 |
| 7059719 | CIF | C11 H15 N5 O2 | P -1 | 7.159; 9.126; 9.472 102.47; 91.989; 98.392 | 596.4 | García-Raso, Angel; Terrón, Angel; Balle, Bartomeu; López-Zafra, Adela; Frontera, Antonio; Barceló-Oliver, Miquel; Fiol, Juan J. Crystal structures of N6-modified-amino acid nucleobase analogs(iii): adenine‒valeric acid, adenine‒hexanoic acid and adenine‒gabapentine New Journal of Chemistry, 2020, 44, 12236-12246 |
| 7055226 | CIF | B5 Ca3 Nd3 O15 | P 63 m c | 10.4864; 10.4864; 6.2665 90; 90; 120 | 596.772 | Wang, Xing; Xia, Mingjun; Li, R. K. Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties New J. Chem., 2016, 40, 2057 |
| 7060106 | CIF | C13 H12 F N3 O2 | P -1 | 7.2126; 7.7988; 11.6303 108.895; 99.835; 97.095 | 598.52 | Wilde, Myron; Arzur, Danielle; Baratte, Blandine; Lefebvre, Dorian; Robert, Thomas; Roisnel, Thierry; Le Jossic-Corcos, Catherine; Bach, Stéphane; Corcos, Laurent; Erb, William Regorafenib analogues and their ferrocenic counterparts: synthesis and biological evaluation New Journal of Chemistry, 2020, 44, 19723-19733 |
| 7053287 | CIF | C6 H6 N4 O6 S2 Sr | P -1 | 6.027; 7.243; 14.186 92.491; 101.383; 97.471 | 600.4 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
| 7059814 | CIF | C6 H14 Cl2 N2 O4 Pd | P 1 21/c 1 | 9.0537; 12.166; 5.4933 90; 96.599; 90 | 601.06 | Jiménez-Cruz, Juan C.; Guzmán-Mejía, Ramón; Juaristi, Eusebio; Sánchez-Antonio, Omar; García-Revilla, Marco A.; González-Campos, J. Betzabe; Aviña-Verduzco, Judit Preparation of aromatic γ-hydroxyketones by means of Heck coupling of aryl halides and 2,3-dihydrofuran, catalyzed by a palladium(ii) glycine complex under microwave irradiation New Journal of Chemistry, 2020, 44, 13382-13392 |
| 7051303 | CIF | C22 H30 Fe N4 O7 | P -1 | 5.799; 9.962; 11.54 102.12; 104; 103.66 | 602.8 | New Journal of Chemistry, 2000 |
| 7055871 | CIF | C3 H5 N5 O2 | P 1 21/n 1 | 3.8235; 16.595; 9.641 90; 99.676; 90 | 603 | Zhou, Tianhong; Li, Yanfeng; Xu, Kangzhen; Song, Jirong; Zhao, Fengqi The new role of 1,1-diamino-2,2-dinitroethylene (FOX-7): two unexpected reactions New J. Chem., 2017, 41, 168 |
| 7052935 | CIF | Cu H4.8 N6.8 O1.2 | P n m a | 6.3808; 7.4452; 12.7044 90; 90; 90 | 603.54 | Tommasino, Jean-Bernard; Chastanet, Guillaume; Guennic, Boris Le; Robert, Vincent; Pilet, Guillaume A 1D coordination polymer built on asymmetric μ1,1,3-azide bridge: from unusual topology to magnetic properties and Cu(ii)/Cu(i) redox reversibility New Journal of Chemistry, 2012, 36, 2228 |
| 7060356 | CIF | B5 O10 Y Zn | P 1 21/n 1 | 8.518; 7.5935; 9.3523 90; 93.755; 90 | 603.62 | Ma, Qin; Tong, Tinghao; Su, Zhi Synthesis, crystal structure and theoretical calculations of two rare-earth borates with DUV cut-off edges New Journal of Chemistry, 2021, 45, 4823-4827 |
| 7061320 | CIF | C12 H20 O3 | P -1 | 5.9803; 7.9085; 13.5905 88.056; 87.341; 70.216 | 604.06 | Galvez, Carolina E.; Piro, Oscar E.; Echeverría, Gustavo A.; Robles, Norma Lis; Lezama, José O. G.; Sankaran, Sankaran Venkatachalam; Thamotharan, Subbiah; Villecco, Margarita B.; Loandos, María del H.; Gil, Diego M. Experimental and theoretical insights into the formation of weak hydrogen bonds and H⋯H bonding interactions in the solid-state structure of two eucalyptol derivatives New Journal of Chemistry, 2022, 46, 5690-5704 |
| 7056409 | CIF | C3 H5 N9 O12 | P 1 21 1 | 7.484; 7.8907; 10.2465 90; 93.122; 90 | 604.2 | Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide New J. Chem., 2017 |
| 7055135 | CIF | B3 Li O9 Sr Tb2 | P -3 m 1 | 10.3845; 10.3845; 6.4739 90; 90; 120 | 604.6 | Chen, Pengyun; Xia, Mingjun; Li, R. K. A terbium rich orthoborate LiSrTb2(BO3)3and its analogues New J. Chem., 2015, 39, 9389 |
| 7052932 | CIF | C12 H16 N2 O3 | P -1 | 6.9305; 8.9843; 10.836 113.556; 95.236; 97.39 | 605.75 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7060799 | CIF | C16 H24 Cu2 N8 O8 S2 | P -1 | 8.5712; 8.7884; 9.8797 115.216; 97.265; 108.823 | 606.26 | Hchicha, Khouloud; Korb, Marcus; Badraoui, Riadh; Naïli, Houcine A novel sulfate-bridged binuclear copper(ii) complex: structure, optical, ADMET and in vivo approach in a murine model of bone metastasis New Journal of Chemistry, 2021, 45, 13775-13784 |
| 7056619 | CIF | C12 H10 B F2 N5 | P -1 | 7.7785; 8.8782; 9.621 91.401; 102.708; 109.795 | 606.29 | Yousaf, Muhammad; Yutronkie, Nathan J.; Castañeda, Raúl; Klein, Jacob A.; Brusso, Jaclyn Boratriazines: inducing luminescence through boron incorporation into a terpy-type framework New J. Chem., 2017 |
| 7052496 | CIF | C12 H11 I N2 O | P -1 | 7.531; 12.236; 7.154 106.27; 100.1; 74.9 | 607.2 | George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones New Journal of Chemistry, 2003, 27, 568 |
| 7060243 | CIF | C4 H11 Cd N5 O9 | P -1 | 7.451; 7.883; 11.51 88.788; 89.634; 63.936 | 607.2 | Lemes, Maykon Alves; do Nascimento Neto, José Antônio; Fernandes Guimarães, Freddy; Maia, Lauro June Queiroz; de Santana, Ricardo Costa; Terra Martins, Felipe Secondary ligands and the intramolecular hydrogen bonds drive photoluminescence quantum yields from aminopyrazine coordination polymers New Journal of Chemistry, 2020, 44, 20259-20266 |
| 7051490 | CIF | C12 H11 N3 O3 | P -1 | 8.302; 8.516; 9.333 99.5; 97.06; 108.21 | 607.4 | New Journal of Chemistry, 1999 |
| 7052519 | CIF | C12 H13 Cl N2 O | P m n 21 | 6.801; 12.199; 7.327 90; 90; 90 | 607.89 | Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics New Journal of Chemistry, 2001, 25, 1520 |
| 7056668 | CIF | C10 H11 N5 O5 | P 1 n 1 | 4.2; 8.507; 17.069 90; 94.05; 90 | 608.3 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7051751 | CIF | C12 H9 N O4 S2 | P -1 | 8.05; 8.123; 11.287 101.816; 97.338; 119.11 | 608.5 | Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia Privileged structures: synthesis and structural investigations on tricyclic sulfonamides New Journal of Chemistry, 2009, 33, 2219 |
| 7051749 | CIF | C12 H9 Br N2 O2 S | P -1 | 7.3326; 8.131; 10.314 97.41; 90.145; 91.61 | 609.5 | Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia Privileged structures: synthesis and structural investigations on tricyclic sulfonamides New Journal of Chemistry, 2009, 33, 2219 |
| 7058134 | CIF | C13 H14 O4 | P 1 21 1 | 8.9464; 6.8743; 9.9114 90; 90.1; 90 | 609.55 | Peixoto de Abreu Lima, Alejandro; Suescun, Leopoldo; Pandolfi, Enrique; Schapiro, Valeria The first enantioselective strategy towards speciosins New Journal of Chemistry, 2019, 43, 3653 |
| 7063071 | CIF | C15 H14 N2 O | P 1 21 1 | 8.1113; 6.7331; 11.6092 90; 105.805; 90 | 610.06 | Chen, Yanqi; Hao, Subin; Yin, Lingfeng; Song, Xinluo; Liu, Zhiyao; Li, Mingde; Dang, Li Metal-free cascade reactions for one-pot tetrahydroquinoxaline construction through nitroarene reduction and imine hydrogenation with water New Journal of Chemistry, 2024, 48, 6103-6108 |
| 7051299 | CIF | C6 H8 N2 | P 1 21/c 1 | 7.5568; 10.8552; 7.4451 90; 90.525; 90 | 610.7 | New Journal of Chemistry, 2000 |
| 7060355 | CIF | B5 Gd O10 Zn | P 1 21/n 1 | 8.5905; 7.5936; 9.3872 90; 93.398; 90 | 611.28 | Ma, Qin; Tong, Tinghao; Su, Zhi Synthesis, crystal structure and theoretical calculations of two rare-earth borates with DUV cut-off edges New Journal of Chemistry, 2021, 45, 4823-4827 |
| 7050635 | CIF | C7 H6 F4 I2 N2 | P 1 21/c 1 | 6.9365; 11.5354; 8.1604 90; 110.487; 90 | 611.66 | Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br) New Journal of Chemistry, 2003, 27, 1522 |
| 7059947 | CIF | C12 H13 F3 N2 O2 | P -1 | 7.2135; 9.5319; 9.6366 84.67; 68.742; 82.721 | 611.74 | Peerzada, Mudasir Nabi; Khan, Parvez; Khan, Nashrah Sharif; Gaur, Aysha; Avecilla, Fernando; Hassan, Md. Imtaiyaz; Azam, Amir Identification of morpholine based hydroxylamine analogues: selective inhibitors of MARK4/Par-1d causing cancer cell death through apoptosis New Journal of Chemistry, 2020, 44, 16626-16637 |
| 7055121 | CIF | C15 H12 O4 | P 1 21 1 | 10.439; 5.0804; 11.712 90; 99.816; 90 | 612 | Eyong, Kenneth O.; Chinthapally, Kiran; Senthilkumar, Soundararasu; Lamshöft, Marc; Folefoc, Gabriel N.; Baskaran, Sundarababu Conversion of lapachol to lomatiol: synthesis of novel naphthoquinone derivatives New J. Chem., 2015, 39, 9611 |
| 7063185 | CIF | C16 H13 N O | P -1 | 7.4062; 7.8098; 10.9025 101.137; 93.235; 96.394 | 612.92 | Altia, Minakshi; Anbarasan, Pazhamalai α-Hydroxydimethylacetal/ketal as α-hydroxycarbonyl equivalent in interrupted Heyns/Amadori rearrangement: Regioselective synthesis of substituted C2- and C3-acylindoles New Journal of Chemistry, 2024 |
| 7051391 | CIF | C4 H4 Ag N3 O2 | C 1 2/c 1 | 12.378; 7.934; 6.322 90; 99.07; 90 | 613.04 | New Journal of Chemistry, 1999 |
| 7050551 | CIF | C4 H8 N4 O2 | P c a 21 | 16.6296; 3.6679; 10.0529 90; 90; 90 | 613.18 | Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen Hydrogen bond patterns in aromatic and aliphatic dioximes New J. Chem., 2003, 27, 1084-1094 |
| 7051437 | CIF | C15 H17 N O3 | P -1 | 7.161; 8.296; 11.377 77.42; 82.78; 68.75 | 614 | New Journal of Chemistry, 1999 |
| 7056023 | CIF | C14 H10 N2 O Se | P -1 | 5.539; 8.1345; 13.8742 94.771; 98.816; 93.294 | 614.04 | Kumar, Sanjeev; Sharma, Nidhi; Maurya, Indresh K.; Verma, Ajay; Kumar, Sangit; Bhasin, K. K.; Sharma, Rohit K. Insights into selenylation of imidazo[1,2-a]pyridine: synthesis, structural and antimicrobial evaluation New J. Chem., 2017, 41, 2919 |
| 7060224 | CIF | C18 H30 Cl2 N2 O16 | P -1 | 8.0335; 8.3743; 10.4076 104.296; 104.67; 105.419 | 614.77 | Giorgi, Luca; Ambrosi, Gianluca; Paderni, Daniele; Conti, Luca; Amatori, Stefano; Romagnoli, Francesca; Rossi, Patrizia; Formica, Mauro; Macedi, Eleonora; Giorgi, Claudia; Paoli, Paola; Fanelli, Mirco; Fusi, Vieri Bis-maltol-polyamine family: structural modifications at strategic positions. Synthesis, coordination and antineoplastic activity of two new ligands New Journal of Chemistry, 2021, 45, 2659-2669 |
| 7057344 | CIF | C4 Cl2 F8 O4 S2 | P 1 21/c 1 | 5.4994; 19.724; 6.219 90; 114.278; 90 | 614.9 | Liu, Xiaolin; McMillen, Colin D.; Thrasher, Joseph S. Cooperative intermolecular S‒Cl⋯O and F⋯F associations in the crystal packing of α,ω-di(sulfonyl chloride) perfluoroalkanes, ClSO2(CF2)nSO2Cl, where n = 4, 6 New Journal of Chemistry, 2018, 42, 10484 |
| 7052941 | CIF | C14 H12 N4 | P 1 21/m 1 | 6.8273; 12.263; 7.4173 90; 97.954; 90 | 615.03 | Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups New Journal of Chemistry, 2012, 36, 2520 |
| 7056415 | CIF | C3 H2 K N9 O11 | P 1 21 1 | 7.4594; 7.8789; 10.4774 90; 90.745; 90 | 615.72 | Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide New J. Chem., 2017 |
| 7061907 | CIF | C5 H4 F N3 O2 | P n a 21 | 9.0668; 14.8508; 4.5755 90; 90; 90 | 616.09 | Ghosh, Priyanka; Panda, Subhra Jyoti; Purohit, Chandra Shekhar A new short synthesis route for favipiravir and its analogue: Their tautomerization behaviour New Journal of Chemistry, 2022, 46, 18824-18831 |
| 7062139 | CIF | C12 H6 F7 N O2 | P -1 | 7.214; 7.4875; 11.7137 80.95; 85.782; 80.9 | 616.2 | Li, Ning-Bo; Gu, Shuo; Hu, Chu-Qian; Wang, Yu-Xin; Zhou, Xue; Qiao, Jie; Jiang, Jun; Ji, Hong-Tao; He, Wei-Min Visible-light-induced mesoporous graphitic carbon nitride-catalyzed trifluoromethylation and perfluoroalkylation of 4-aminocoumarins New Journal of Chemistry, 2023, 47, 660-665 |
| 7059177 | CIF | C15 H14 N2 O2 | P -1 | 5.3129; 9.3886; 12.8335 86.747; 88.785; 75.123 | 617.67 | Il’in, Mikhail V.; Lesnikova, Liana A.; Bolotin, Dmitrii S.; Novikov, Alexander S.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu. A one-pot route to N-acyl ureas: a formal four-component hydrolytic reaction involving aminonitrones and isocyanide dibromides New Journal of Chemistry, 2020, 44, 1253-1262 |
| 7057080 | CIF | C8 H16 N2 O8 P2 | P -1 | 7.695; 7.92; 10.362 96.36; 99.93; 91.11 | 617.7 | Rojek, Tomasz; Goldeman, Waldemar; Ślepokura, Katarzyna; Duczmal, Marek; Wojciechowska, Agnieszka; Matczak-Jon, Ewa 1D Co(ii) coordination polymers based on cyclobutyl- and cyclopentyl-substituted zoledronate analogues: synthesis, structural comparison, thermal stability and magnetic properties New Journal of Chemistry, 2018, 42, 7830 |
| 7051525 | CIF | C8 H11 B F4 N6 O2 | P -1 | 8.2263; 8.5046; 9.812 111.91; 90.79; 102.23 | 619.2 | Armentano, Donatella; De Munno, Giovanni; Rossi, Rachele The counterion as a useful tool to obtain complexes of cytosine with alkali metal ions New Journal of Chemistry, 2006, 30, 13 |
| 7056078 | CIF | Ba O6 Pb Si2 | C m c m | 5.5092; 15.45; 7.287 90; 90; 90 | 620.2 | Dong, Lingyun; Jia, Liangliang; Wang, Lijun New lead(II) borates in the PbO/PbF2/H3BO3 ternary phase diagram: syntheses and structures of β-Pb6B10O21 and Pb4B8O16 New J. Chem., 2017 |
| 7055079 | CIF | C12 H11 Br N2 O2 | P -1 | 7.4955; 7.5254; 12.0645 80.285; 86.767; 67.729 | 620.7 | Zhang, Zhenfeng; Ma, Nana; Xuan, Xiaopeng An unusual CC⋯CO interaction in (Z)-3-[(4-halogenphenyl)amino]-2-cyanoprop-2-enoates New J. Chem., 2016, 40, 85 |
| 7050031 | CIF | C2 H6 N Ni O5 P | P n a 21 | 9.5378; 12.572; 5.183 90; 90; 90 | 621.49 | Modi, Rakesh; Hix, Gary B.; Tremayne, Maryjane; MacLean, Elizabeth Polymorphism in nickel phosphonates: synthesis of layered and microporous Ni(O3PCH2C(O)NH2)�H2O New Journal of Chemistry, 2005, 29, 427 |
| 7057781 | CIF | C12 H18 N4 O2 | P 1 21/a 1 | 9.2; 6.33; 11.25 90; 108.39; 90 | 622 | Ji, Bao-Qian; Jagodič, Marko; Ma, Hui-Yan; Su, Hai-Feng; Li, Yun-Wu; Tung, Chen-Ho; Sun, Di Solution behavior and magnetic properties of a novel nonanuclear copper(ii) cluster New Journal of Chemistry, 2018, 42, 17884 |
| 7061346 | CIF | C26 H30 Cu N4 O6 | P -1 | 5.6066; 10.4353; 11.283 104.885; 95.48; 99.643 | 622.28 | Podjed, Nina; Modec, Barbara; Clérac, Rodolphe; Rouzières, Mathieu; Alcaide, María M.; López-Serrano, Joaquín Structural diversity and magnetic properties of copper(ii) quinaldinate compounds with amino alcohols New Journal of Chemistry, 2022, 46, 6899-6920 |
| 7061236 | CIF | Ba4 Bi3 Na O12 | P -1 | 8.5415; 8.5421; 8.5441 89.996; 89.995; 90.016 | 623.4 | Hossain, Khandaker Monower; Saiduzzaman, Md; Kumada, Nobuhiro; Takei, Takahiro; Yamane, Hisanori Hydrothermal synthesis and crystal structure of a novel double-perovskite-type bismuth oxide with 3 : 1 ordering at the B-site New Journal of Chemistry, 2022, 46, 3595-3601 |
| 7055169 | CIF | C16 H24 Ag2 B2 F8 N8 O4 | P -1 | 7.9688; 9.2044; 9.3306 73.719; 76.471; 74.445 | 623.48 | Kalinowska-Lis, Urszula; Felczak, Aleksandra; Chęcińska, Lilianna; Małecka, Magdalena; Lisowska, Katarzyna; Ochocki, Justyn Influence of selected inorganic counter-ions on the structure and antimicrobial properties of silver(i) complexes with imidazole-containing ligands New J. Chem., 2016, 40, 694 |
| 7053079 | CIF | C28 H22 Cu N4 O6 | P -1 | 8.2341; 8.2839; 11.321 69.656; 72.198; 61.084 | 624.801 | Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A. Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand New Journal of Chemistry, 2013, 37, 2303 |
| 7054653 | CIF | C26 H30 N6 O4 | P -1 | 5.1024; 8.0128; 16.497 99.94; 93.967; 108.231 | 625.5 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7054476 | CIF | C4 H10 N12 O7 | P 1 21 1 | 8.0286; 8.0668; 9.6666 90; 90.004; 90 | 626.06 | Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R. Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles New J. Chem., 2015, 39, 1619 |
| 7056346 | CIF | C22 H27 Cl3 Mn N2 O7 | P -1 | 6.9737; 10.1021; 10.3328 66.047; 73.622; 73.682 | 626.64 | Chattopadhyay, Shouvik; Sarkar, Nandita; Harms, Klaus; Frontera, Antonio The importance of unconventional C‒H•••π(SCN) interactions in stabilizing the unexpected syn/anti arrangement of pendant alkoxy side arms in two manganese(IV) Schiff base complexes: Exploration of catechol oxidase and phenoxazinone synthase like activities New J. Chem., 2017 |
| 7058095 | CIF | C12 H12 N4 O4 | P -1 | 5.9932; 10.2222; 10.8532 95.69; 101.192; 103.562 | 626.74 | Todorov, Petar T.; Peneva, Petia N.; Georgieva, Stela I.; Rusew, Rusi I.; Shivachev, Boris L.; Georgiev, Anton H. Photochromic and molecular switching behaviour of new Schiff bases containing hydantoin rings: synthesis, characterization and crystal structures New Journal of Chemistry, 2019, 43, 2740 |
| 7053681 | CIF | F18 In Sb3 | P -3 c 1 | 8.719; 8.719; 9.5219 90; 90; 120 | 626.88 | Mazej, Zoran; Goreshnik, Evgeny Fluoride ion donor properties of group 13 trifluorides (MF3, M = Al, Ga, In, Tl) and crystal structures of InF3·3SbF5, TlF3·3SbF5 and TlF3·AsF5·2HF New Journal of Chemistry, 2010, 34, 2806 |
| 7055868 | CIF | C8 H16 N6 Ni O4 | P 1 21/n 1 | 9.8999; 5.7496; 11.1292 90; 98.159; 90 | 627.07 | Andrusenko, Elena V.; Kabin, Evgeniy V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Starova, Galina L.; Kukushkin, Vadim Yu. Metal-mediated generation of triazapentadienate-terminated di- and trinuclear μ2-pyrazolate NiII species and control of their nuclearity New J. Chem., 2017, 41, 316 |
| 7057645 | CIF | C30 H16 Cl2 Cu N4 O4 | P -1 | 7.8422; 8.7783; 9.4903 90.286; 104.15; 97.796 | 627.15 | Qin, Qi-Pin; Zou, Bi-Qun; Tan, Ming-Xiong; Wang, Shu-Long; Liu, Yan-Cheng; Liang, Hong Tryptanthrin derivative copper(ii) complexes with high antitumor activity by inhibiting telomerase activity, and inducing mitochondria-mediated apoptosis and S-phase arrest in BEL-7402 New Journal of Chemistry, 2018, 42, 15479 |
| 7051461 | CIF | C10 H10 Br2 N2 O3 | P -1 | 8.168; 9.279; 9.875 65.47; 80.99; 67.69 | 629.9 | Banwell, Martin, G.; Bray, Andrew M.; Willis, Anthony C.; Wong, David J. First Syntheses of the Pyrroloketopiperazine Marine Natural Products (±)-Longamide, (±)-Longamide B Methyl Ester and and (±)-Hanishin. New Journal of Chemistry, 1999 |
| 7053982 | CIF | C6 H10 Cl Cu N8 O5.5 | P -1 | 6.537; 9.314; 11.282 108.282; 99.043; 98.41 | 630 | Chen, Jun; Wang, Shuai-Hua; Liu, Zhi-Fa; Wu, Mei-Feng; Xiao, Yu; Zheng, Fa-Kun; Guo, Guo-Cong; Huang, Jin-Shun Anion-directed self-assembly of Cu(ii) coordination compounds with tetrazole-1-acetic acid: syntheses in ionic liquids and crystal structures New Journal of Chemistry, 2014, 38, 269 |
| 7053277 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.545; 4.877; 23.3506 90; 93.62; 90 | 630.2 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7055190 | CIF | C28 H12 F6 N4 S4 | P -1 | 5.0599; 6.4683; 20.014 93.915; 97.142; 102.709 | 630.93 | Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives New J. Chem., 2016, 40, 1403 |
| 7052840 | CIF | C4 H7 N3 O3 | P 1 21/c 1 | 8.957; 9.917; 7.143 90; 96.046; 90 | 631 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
| 7053268 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.5591; 4.8698; 23.3593 90; 93.448; 90 | 631.23 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7057322 | CIF | C8 H9 N5 O7 Pb | P -1 | 7.127; 9.93; 10.576 113.286; 106.951; 97.512 | 631.3 | Yan, Yang-Tian; Cao, Feng; Zhang, Wen-Yan; Zhang, Si-Si; Zhang, Fang; Wang, Yao-Yu Seven luminescent metal‒organic frameworks constructed from 5-(triazol-1-yl)nicotinic acid: luminescent sensors for CrVI and MnO4− ions in an aqueous medium New Journal of Chemistry, 2018, 42, 9865 |
| 7054787 | CIF | C2 H6 N6 O3 | P 1 21/c 1 | 8.5269; 6.265; 12.7601 90; 112.003; 90 | 632.01 | Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia 3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties New J. Chem., 2015, 39, 5265 |
| 7059946 | CIF | C13 H18 N2 O3 | P -1 | 6.828; 8.4251; 12.0384 101.229; 95.141; 109.126 | 632.92 | Peerzada, Mudasir Nabi; Khan, Parvez; Khan, Nashrah Sharif; Gaur, Aysha; Avecilla, Fernando; Hassan, Md. Imtaiyaz; Azam, Amir Identification of morpholine based hydroxylamine analogues: selective inhibitors of MARK4/Par-1d causing cancer cell death through apoptosis New Journal of Chemistry, 2020, 44, 16626-16637 |
| 7051697 | CIF | C10 H16 N6 S | P -1 | 7.6762; 8.512; 10.3122 104.177; 102.599; 93.444 | 632.94 | Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives New Journal of Chemistry, 2009, 33, 1663 |
| 7053278 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.564; 4.879; 23.3903 90; 93.43; 90 | 633.8 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7056372 | CIF | C12 H8 F3 N2 O2 S | P -1 | 5.8417; 8.906; 12.8197 86.18; 88.587; 72.272 | 633.87 | S. Chourasiya, Sumit; Patel, Dhara; Nagaraja, C. M.; Chakraborti, Asit Kumar; Bharatam, Prasad. V. Sulfonamide vs.Sulfonimide: Tautomerism and Electronic Structure Analysis of N-Heterocyclic Arenesulfonamides New J. Chem., 2017 |
| 7057777 | CIF | C11 H10 Cl2 Cu N2 Se | P -1 | 6.9883; 7.3034; 14.1926 77.705; 81.6484; 63.8415 | 634.17 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
| 7051183 | CIF | C9 H5 N S6 | P -1 | 6.9395; 7.6083; 12.502 104.45; 93.03; 95.46 | 634.3 | Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts New J. Chem., 2001, 25, 1418-1424 |
| 7062169 | CIF | C13 H12 F N3 O4 | P -1 | 6.4654; 7.2568; 13.7654 83.05; 81.814; 87.445 | 634.32 | Bu, Fan-Zhi; Yu, Yue-Ming; Yu, Yu; Yan, Cui-Wei; Wu, Zhi-Yong; Li, Yan-Tuan Self-assembly of antifungal agent 5-fluorocytosine and nutrient trans-p-coumaric acid furnishes a cocrystal with the potential to reduce toxicity and side effects for the drug: a case study combining theory with experiment New Journal of Chemistry, 2023, 47, 1328-1341 |
| 7055711 | CIF | C22 H20 Cu3 N6 O12 | P -1 | 6.539; 8.752; 12.35 97.275; 101.14; 110.523 | 634.8 | Shang, Di; Ni, Jue chen; Gao, Xin Yu; Li, Cheng Ren; Lin, Xiao Meng; Wang, Zhi Nan; Du, Ning; Li, Shuang; Xing, Yong Heng The various structures of complexes fabricated with transition metal and triazole ligands and inhibiting effect on luminescent xanthine New J. Chem., 2016 |
| 7051055 | CIF | C11 H15 N5 O3 | P -1 | 7.262; 9.466; 9.839 91.28; 109.46; 94.01 | 635.4 | New Journal of Chemistry, 2001 |
| 7053269 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.5751; 4.8787; 23.403 90; 93.223; 90 | 635.54 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7058262 | CIF | C5 H6 N2 O4 | P 1 21/n 1 | 5.6945; 17.546; 6.621 90; 106.106; 90 | 635.58 | Khan, Ishaat M.; Alam, Kehkashan; Alam, Mohammad Jane; Ahmad, Musheer Spectrophotometric and photocatalytic studies of H-bonded charge transfer complex of oxalic acid with imidazole: single crystal XRD, experimental and DFT/TD-DFT studies New Journal of Chemistry, 2019, 43, 9039 |
| 7057977 | CIF | C9 H8 Cu F3 N3 O3 | P -1 | 6.426; 7.471; 13.774 75.689; 83.872; 85.763 | 636.3 | Cen, Peipei; Yuan, Weize; Luo, Shuchang; Liu, Xiangyu; Xie, Gang; Chen, Sanping Solvent coligands fine-tuned the structures and magnetic properties of triple-bridged 1D azido-copper(ii) coordination polymers New Journal of Chemistry, 2019, 43, 601 |
| 7057906 | CIF | C16 H14 N2 O | P 1 21/m 1 | 9.0075; 6.8883; 10.3867 90; 98.932; 90 | 636.64 | Smirnov, Andrey S.; Martins, Luísa M. D. R. S.; Nikolaev, Dmitriy N.; Manzhos, Roman A.; Gurzhiy, Vlad V.; Krivenko, Alexander G.; Nikolaenko, Kirill O.; Belyakov, Alexander V.; Garabadzhiu, Alexander V.; Davidovich, Pavel B. Structure and catalytic properties of novel copper isatin Schiff base complexes New Journal of Chemistry, 2019, 43, 188 |
| 7061897 | CIF | C13 H15 N3 O3 | P 1 n 1 | 4.6463; 13.9998; 9.849 90; 96.32; 90 | 636.76 | Ajormal, Fatemeh; Bikas, Rahman; Noshiranzadeh, Nader; Kozakiewicz-Piekarz, Anna; Lis, Tadeusz Green catalytic synthesis of symmetric and non-symmetric β-hydroxy-1,2,3-triazoles by using epichlorohydrin in the presence of Cu(ii) coordination compounds containing oxazole ligands New Journal of Chemistry, 2022, 46, 19468-19481 |
| 7059424 | CIF | C16 H9 F N4 | P 1 21/c 1 | 15.902; 5.4778; 7.3146 90; 90.515; 90 | 637.13 | Pedrini, Alessandro; Maspero, Angelo; Bracco, Silvia; Comotti, Angelina; Galli, Simona; Marchiò, Luciano; Nardo, Luca; Penoni, Andrea; Scapinello, Luca; Sozzani, Piero; Vesco, Guglielmo; Mella, Massimo Synthesis, crystal structure, and optical properties of fluorinated poly(pyrazole) ligands and in silico assessment of their affinity for volatile organic compounds New Journal of Chemistry, 2020, 44, 6443-6455 |
| 7050093 | CIF | C24 H20 Ag2 N10 O6 | P -1 | 8.0933; 8.8628; 9.3988 89.868; 82.849; 72.614 | 637.93 | Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes New Journal of Chemistry, 2005, 29, 826 |
| 7059091 | CIF | C8 H12 Br4 Se | P -1 | 7.5472; 7.8647; 11.259 77.095; 84.024; 79.049 | 638.2 | Torubaev, Yury V.; Skabitskiy, Ivan V.; Pavlova, Alina V.; Pasynskii, Alexander A. First structural evidence of a Se‒Br‒Br halogen-bonded molecular complex New Journal of Chemistry, 2017, 41, 3606 |
| 7057363 | CIF | C10 H4 F4 I2 N2 | P -1 | 5.7902; 8.7132; 13.4792 72.603; 79.867; 85.571 | 638.59 | Bedeković, Nikola; Stilinović, Vladimir; Friščić, Tomislav; Cinčić, Dominik Comparison of isomericmeta- andpara-diiodotetrafluorobenzene as halogen bond donors in crystal engineering New Journal of Chemistry, 2018, 42, 10584 |
| 7052927 | CIF | C8 H12 N12 | P 1 21/c 1 | 8.661; 8.102; 10.043 90; 115.001; 90 | 638.7 | Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao 1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound New Journal of Chemistry, 2012, 36, 1953 |
| 7057841 | CIF | C18 H24 Br0.75 Cl5.25 Cr2 N4 O0 | P 1 21 1 | 7.7436; 7.0456; 11.7412 90; 92.74; 90 | 639.85 | Malan, Frederick P.; Singleton, Eric; van Rooyen, Petrus H.; Conradie, Jeanet; Landman, Marilé Base-free glucose dehydration catalysed by NHC-stabilised heterohalo cyclopentadienyl Cr(iii) complexes New Journal of Chemistry, 2018, 42, 19193 |
| 7052520 | CIF | C13 H15 Cl N2 O | P 1 21/m 1 | 7.3047; 6.7669; 13.444 90; 105.59; 90 | 640.09 | Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics New Journal of Chemistry, 2001, 25, 1520 |
| 7053270 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.5929; 4.8891; 23.4513 90; 92.978; 90 | 640.39 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7061799 | CIF | C14 H15 N5 | P -1 | 8.7299; 9.2355; 9.5254 65.084; 68.436; 73.691 | 640.49 | Hu, Haoran; Jiang, Bitao; Zhang, Bo; Wang, Rong; Zhang, Chong; Sun, Chengguo; Hu, Bingcheng Novel pyrazolyazoindole derivatives as photoswitches: design, synthesis, and photoswitching behavior research combined with theoretical methods New Journal of Chemistry, 2022, 46, 18316-18325 |
| 7059277 | CIF | C24 H8 F8 I4 N | P -1 | 5.9625; 9.3712; 12.051 75.207; 88.706; 80.057 | 641.1 | Elamathi, C.; Fronczek, Frank R.; Madankumar, A.; Prabhakaran, R. Synthesis and spectral characterizations of water soluble Cu(ii) complexes containing N-heterocyclic chelates: cell-proliferation, antioxidant and nucleic acid/serum albumin interactions New Journal of Chemistry, 2020, 44, 4158-4170 |
| 7060342 | CIF | C2 H4 Ag N6 O3 | P 1 21/c 1 | 8.9723; 5.0146; 14.813 90; 105.854; 90 | 641.12 | Zhu, Jiaping; Xu, Jielai; Yao, Chaojian; Zhan, Tong; Liu, Weibing; Tan, Hua A new 3D Ag(i)-based high-energy metal organic frameworks (HE-MOFs): synthesis, crystal structure and explosive performance New Journal of Chemistry, 2021, 45, 3552-3558 |
| 7060303 | CIF | C3 H3 Cs N2 O4 | P -1 | 7.8313; 8.4529; 10.3855 71.081; 83.485; 81.22 | 641.22 | Isaia, Francesco; Garau, Alessandra; Castellano, Carlo; Demartin, Francesco; Aragoni, M. Carla; Arca, Massimiliano; Caltagirone, Claudia; Lippolis, Vito; Pivetta, Tiziana Stabilization of caesium ions by simple organic molecules: crystal structures of Cs(OXL) (OXL = oxalurate anion) and the CsOH/cyanuric acid co-crystal Cs3(CYH3)4(OH)3 (CYH3 = cyanuric acid) New Journal of Chemistry, 2021, 45, 3263-3270 |
| 7057378 | CIF | C10 H12 I2 O3 | P 42/m | 8.5167; 8.5167; 8.8404 90; 90; 90 | 641.23 | Gamekkanda, Janaka C.; Sinha, Abhijeet S.; Desper, John; Đaković, Marijana; Aakeröy, Christer B. Competition between hydrogen bonds and halogen bonds: a structural study New Journal of Chemistry, 2018, 42, 10539 |
| 7056870 | CIF | C31 H28 N2 O4 | P -1 | 6.0295; 9.1751; 11.9172 94.105; 100.519; 96.335 | 641.39 | Jauhar, RO. MU.; Era, Paavai; Viswanathan, V.; Vivek, P.; Vinitha, G.; D., Velmurugan; Murugakoothan, P. Crystal structure, molecular packing, FMO, NBO, nonlinear optical and optical limiting properties of an organic imidazolium diphenylacetate diphenylacetic acid single crystal New Journal of Chemistry, 2018, 42, 2439 |
| 7052521 | CIF | C12 H12 Cl2 N2 O | P 1 21/m 1 | 7.313; 6.668; 13.644 90; 105.23; 90 | 642 | Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics New Journal of Chemistry, 2001, 25, 1520 |
| 7057108 | CIF | C20 H24 N6 O2 Se4 | P -1 | 9.224; 9.382; 9.591 108.086; 116.283; 102.687 | 642.3 | Jeannin, Olivier; Huynh, Huu-Tri; Riel, Asia Marie S.; Fourmigué, Marc Chalcogen bonding interactions in organic selenocyanates: from cooperativity to chelation New Journal of Chemistry, 2018, 42, 10502 |
| 7053279 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.597; 4.897; 23.47 90; 92.97; 90 | 642.4 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7057776 | CIF | C22 H20 Cl4 Cu2 N4 Se2 | P -1 | 7.759; 8.3854; 11.2192 90.009; 106.819; 112.097 | 642.49 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
| 7052026 | CIF | C8 H17 N3 O4 S2 | P 1 21 1 | 6.2135; 13.7443; 7.8355 90; 106.172; 90 | 642.67 | Dean, Pamela M.; Pringle, Jennifer M.; Forsyth, Craig M.; Scott, Janet L.; MacFarlane, Douglas R. Interactions in bisamide ionic liquids—insights from a Hirshfeld surface analysis of their crystalline states New Journal of Chemistry, 2008, 32, 2121 |
| 7058099 | CIF | C10 H5 Br2 N4 O3 Re | P -1 | 6.612; 7.947; 13.079 105.928; 102.163; 92.124 | 642.7 | Pizarro, Nancy; Saldías, Marianela; Guzmán, Nicolás; Sandoval-Altamirano, Catalina; Kahlal, Samia; Saillard, Jean-Yves; Hamon, Jean-René; Vega, Andrés 1IL and 3MLCT excited states modulated by H+: the structure and photophysical properties of [(2-bromo-5-(1H-pyrazol-1-yl)pyrazine)Re(CO)3Br] New Journal of Chemistry, 2019, 43, 2449 |
| 7058947 | CIF | C14 H10 Cu N16 O16 | P -1 | 6.2297; 8.806; 12.0376 79.309; 89.906; 82.408 | 643.04 | Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions New Journal of Chemistry, 2019 |
| 7062141 | CIF | C14 H9 F3 N2 Se | P -1 | 7.7546; 7.758; 10.875 88.0511; 88.963; 79.6705 | 643.22 | Turcio-García, Luis Ángel; Valdés, Hugo; Arenaza-Corona, Antonino; Hernández-Ortega, Simón; Morales-Morales, David Electronic properties and supramolecular study of selenoureas with fluorinated-NHC ligands derived from imidazo[1,5-a]pyridines New Journal of Chemistry, 2023, 47, 2090-2095 |
| 7058775 | CIF | C3 H6 Cl F2 N O4 | P n m a | 12.1852; 7.0366; 7.5024 90; 90; 90 | 643.27 | Chen, Jifeng; Yu, Yi; Zhang, Shujuan; Li, Yuchuan; Pang, Siping Energetic materials with fluorinated four-membered heterocyclic ring: 3,3′-difluoroazetidine (DFAZ) salts New Journal of Chemistry, 2019, 43, 15115 |
| 7060136 | CIF | C11 H14 N6 O5 | P 1 21 1 | 6.82; 6.612; 14.279 90; 91.88; 90 | 643.5 | Rungta, Pallavi; Kumar, Manish; Mangla, Priyanka; Kumar, Sandeep; Prasad, Ashok K. Chemo-enzymatic access to C-4′-hydroxyl-tetrahydrofurano-spironucleosides New Journal of Chemistry, 2021, 45, 1609-1616 |
| 7059059 | CIF | C9 H2 N5 | P 1 21/m 1 | 3.9752; 26.0148; 6.282 90; 97.357; 90 | 644.3 | Nimax, Patrick R.; Zoller, Florian; Blockhaus, Tobias; Küblböck, Teresa; Fattakhova-Rohlfing, Dina; Sünkel, Karlheinz An aminotetracyanocyclopentadienide system: light-induced formation of a thermally stable cyclopentadienyl radical New Journal of Chemistry, 2020, 44, 72-78 |
| 7053274 | CIF | C7 H6 O4 | P 1 21/n 1 | 3.656; 22.329; 8.009 90; 99.76; 90 | 644.4 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7056416 | CIF | C3 H6 N10 O11 | P 1 21 1 | 7.5643; 8.0022; 10.6515 90; 91.239; 90 | 644.6 | Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide New J. Chem., 2017 |
| 7062260 | CIF | C13 H8 Cl2 I N O | P -1 | 7.9091; 8.4598; 11.0761 86.407; 74.604; 64.696 | 644.85 | Ahangar, Aadil A.; Ahmad, Ishtiyaq; Dar, Aijaz A. AIE in the halogenated anils and their utilization as fluorescent probes for explosive nitro-aromatics New Journal of Chemistry, 2023, 47, 4775-4783 |
| 7051484 | CIF | C10 H36 Cl2 Nd2 O20 | P 1 | 7.877; 8.781; 10.444 110.69; 95.24; 103.48 | 645.1 | New Journal of Chemistry, 1999 |
| 7050624 | CIF | C18 H24 Cd3 O21 | P -1 | 7.6819; 8.8715; 10.3205 105.852; 93.055; 105.705 | 645.16 | Fan, Jian; Zhu, Hui-Fang; Okamura, Taka-aki; Sun, Wei-Yin; Tang, Wen-Xia; Ueyama, Norikazu Three-dimensional photoluminescent pillared metal-organic framework with 4.82 topological channels obtained from the assembly of cadmium(ii) acetate and trimellitic salt New Journal of Chemistry, 2003, 27, 1409 |
| 7053474 | CIF | C20 H26 Cu N6 O6 S2 | P -1 | 7.808; 8.946; 10.837 102.017; 104.357; 111.247 | 645.2 | Rajput, Lalit; Biradha, Kumar Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion New Journal of Chemistry, 2010, 34, 2415 |
| 7057162 | CIF | C11 H8 Cl2 I N Se | P -1 | 7.336; 9.7341; 10.2629 104.09; 107.27; 102.43 | 645.24 | Montis, Riccardo; Arca, Massimiliano; Aragoni, M. Carla; Blake, Alexander J.; Castellano, Carlo; Demartin, Francesco; Isaia, Francesco; Lippolis, Vito; Pintus, Anna; Lenardão, Eder J.; Perin, Gelson; O'Connor, Alice E.; Thurow, Samuel Structural diversity in the products formed by the reactions of 2-arylselanyl pyridine derivatives and dihalogens New Journal of Chemistry, 2018, 42, 10592 |
| 7053271 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.6215; 4.8939; 23.492 90; 92.76; 90 | 645.54 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7063113 | CIF | C6 H11 Cl2 N3 O10 | P 1 21 1 | 4.9151; 10.5757; 12.47 90; 94.788; 90 | 645.9 | Kuang, Bao-long; Lu, Zu-jia; Zhao, Bin-shan; Wang, Ting-wei; Sun, Mou; Zhang, Chao; Xu, Mei-qi; Yu, Qi-yao; Zhang, Jian-guo A novel energetic pyridine-2-carbohydrazide copper perchlorate complex: synthesis, cationic ligand structure and properties New Journal of Chemistry, 2024, 48, 7946-7952 |
| 7050990 | CIF | C4 N6 Pb | P n m a | 13.501; 3.995; 11.98 90; 90; 90 | 646.2 | Shi, Yu-Jun; Chen, Xue-Tai; Li, Yi-Zhi; Xue, Ziling; You, Xiao-Zeng Pb(dca)2 (dca???=???dicyanamide): a novel 3D compound with unusual coordination modes of dicyanamide New Journal of Chemistry, 2002, 26, 1711 |
| 7053275 | CIF | C7 H6 O4 | P 1 21/n 1 | 3.669; 22.3473; 8.012 90; 99.63; 90 | 647.7 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7058071 | CIF | C3 H2 Cl N7 | P n m a | 7.5145; 6.2774; 13.7315 90; 90; 90 | 647.74 | Wang, Guilong; Lu, Tian; Fan, Guijuan; Yin, Hongquan; Chen, Fu-Xue Synthesis and properties of insensitive [1,2,4]triazolo[4,3-b]-1,2,4,5-tetrazine explosives New Journal of Chemistry, 2019, 43, 1663 |
| 7059189 | CIF | C26 H18 F4 I2 N4 O4 | P -1 | 8.3364; 8.9922; 9.0984 82.895; 73.539; 84.883 | 648.01 | Huang, Yaodong; Zhang, Xiaojie; Cui, Wei; Wang, Xin; Li, Bin; Zhang, Yongxin; Yang, Junjiao Novel liquid crystalline organogelators based on terephthalic acid and terephthalaldehyde derivatives: properties and promotion through the formation of halogen bonding New Journal of Chemistry, 2020, 44, 614-625 |
| 7053272 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.6218; 4.9063; 23.526 90; 92.48; 90 | 648.29 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7063112 | CIF | C6 H11 Cl2 N3 O10 | P -1 | 7.3108; 8.3745; 11.0926 82.288; 89.995; 74.587 | 648.34 | Kuang, Bao-long; Lu, Zu-jia; Zhao, Bin-shan; Wang, Ting-wei; Sun, Mou; Zhang, Chao; Xu, Mei-qi; Yu, Qi-yao; Zhang, Jian-guo A novel energetic pyridine-2-carbohydrazide copper perchlorate complex: synthesis, cationic ligand structure and properties New Journal of Chemistry, 2024, 48, 7946-7952 |
| 7057773 | CIF | C11 H10 Cl2 Co N2 Se | P -1 | 7.8194; 8.2508; 12.0455 94.298; 107.224; 115.874 | 648.75 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
| 7059426 | CIF | C16 H8 F2 N4 | P 1 21/c 1 | 7.913; 5.411; 15.519 90; 102.2; 90 | 649.5 | Pedrini, Alessandro; Maspero, Angelo; Bracco, Silvia; Comotti, Angelina; Galli, Simona; Marchiò, Luciano; Nardo, Luca; Penoni, Andrea; Scapinello, Luca; Sozzani, Piero; Vesco, Guglielmo; Mella, Massimo Synthesis, crystal structure, and optical properties of fluorinated poly(pyrazole) ligands and in silico assessment of their affinity for volatile organic compounds New Journal of Chemistry, 2020, 44, 6443-6455 |
| 7056444 | CIF | C20 H34 Co N6 O10 | P -1 | 8.7238; 8.907; 9.5349 92.976; 106.274; 111.903 | 649.61 | Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands New J. Chem., 2017 |
| 7050977 | CIF | C12 H14 Cl Co O5 | P -1 | 6.821; 8.904; 11.176 76.42; 80.11; 86.56 | 649.8 | Braga, Dario; Eckert, Matthieu; Fraccastoro, Matteo; Maini, Lucia; Grepioni, Fabrizia; Caneschi, Andrea; Sessoli, Roberta The hydrogen oxalate anion allows one-dimensional columnar aggregation of organometallic sandwich cations New Journal of Chemistry, 2002, 26, 1280 |
| 7054648 | CIF | C28 H34 N6 O4 | P -1 | 5.632; 6.845; 17.748 93.63; 98.988; 104.67 | 649.97 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7055073 | CIF | C14 H10 I2 | P 1 21/n 1 | 5.7078; 17.4128; 7.0077 90; 110.984; 90 | 650.3 | Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin Halogen bonding in the crystal structures of 1,2-diiodo alkenes New J. Chem., 2015, 39, 8522 |
| 7061383 | CIF | C19 H15 N | P 1 21 1 | 7.5986; 6.1021; 14.11 90; 96.293; 90 | 650.3 | Sarkar, Rumpa; Samanta, Surya Kanta; Hasija, Avantika; Chopra, Deepak; Ganguly, Debabani; Bera, Mrinal K. A practical route to arylated dihydroacridine derivatives via nickel boride mediated intramolecular reductive cyclization-concomitant dehydration New Journal of Chemistry, 2022, 46, 7168-7176 |
| 7054144 | CIF | C37 H24 N2 O3 | P -1 | 8.1578; 8.203; 10.141 89.462; 76.889; 80.215 | 651 | Nizhnik, Yakov P.; Lu, Jianjiang; Rosokha, Sergiy V.; Kochi, Jay K. Lewis acid effects on donor‒acceptor associations and redox reactions: ternary complexes of heteroaromatic N-oxides with boron trifluoride and organic donors New Journal of Chemistry, 2009, 33, 2317 |
| 7052933 | CIF | C13 H18 N2 O3 | P -1 | 6.991; 8.981; 11.398 67.479; 81.065; 83.458 | 651.877 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7053276 | CIF | C7 H6 O4 | P 1 21/n 1 | 3.686; 22.368; 8.015 90; 99.44; 90 | 651.9 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7055193 | CIF | C28 H12 F6 N4 O2 S4 | P -1 | 4.8806; 6.618; 20.996 96.69; 94.33; 103.15 | 652.2 | Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives New J. Chem., 2016, 40, 1403 |
| 7052235 | CIF | C36 H38 | P -1 | 6.401; 9.533; 11.538 103.85; 92.84; 105.71 | 653.1 | Torsten Müller; Wilhelm Seichter; Edwin Weber Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions New Journal of Chemistry, 2006, 30, 751 |
| 7050560 | CIF | C13 H8 Cu N4 O6 | P -1 | 6.7113; 9.2977; 11.825 106.316; 97.995; 107.84 | 653.32 | José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes New J. Chem., 2003, 27, 1775-1783 |
| 7057790 | CIF | C15 H14 B F2 N O | P 1 21 1 | 8.05; 6.18; 13.66 90; 105.7; 90 | 654 | Vaz, Patrícia A. A. M.; Rocha, João; Silva, Artur M. S.; Guieu, Samuel Aggregation-induced emission enhancement of chiral boranils New Journal of Chemistry, 2018, 42, 18166 |
| 7059490 | CIF | C16 H14 O2 | P 1 21/c 1 | 8.5051; 5.7663; 13.3375 90; 90.705; 90 | 654.06 | Morita, Masato; Yamada, Shigeyuki; Konno, Tsutomu Fluorine-induced emission enhancement of tolanes via formation of tight molecular aggregates New Journal of Chemistry, 2020, 44, 6704-6708 |
| 7050319 | CIF | C12 H44 Cl6 N6 O4 | P -1 | 7.2793; 8.0716; 11.4099 87.859; 77.59; 88.234 | 654.1 | Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W. Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~ New Journal of Chemistry, 2004, 28, 1160-1167 |
| 7060498 | CIF | C10 H26 F8 N10 O10 Ru2 Si | P -1 | 6.7669; 9.2867; 11.445 103.78; 101.152; 103.764 | 654.19 | Mikhailov, Artem A.; Komarov, Vladislav Yu.; Pishchur, Denis P.; Schaniel, Dominik; Kostin, Gennadiy A. Nitrosyl linkage photoisomerization in heteroleptic fluoride ruthenium complexes derived from labile nitrate precursors New Journal of Chemistry, 2021, 45, 8192-8202 |
| 7054641 | CIF | C14 H34 N4 Ni O18 S2 | P -1 | 6.6415; 8.2264; 12.2601 84.337; 79.491; 85.886 | 654.4 | Kammoun, Omar; Rekik, Walid; Naïli, Houcine; Bataille, Thierry Inorganic layered structures in hybrid double sulfates: related phases and thermal reactivity New J. Chem., 2015, 39, 2682 |
| 7050631 | CIF | C7 H11 F4 I2 N O | P -1 | 6.8922; 6.8945; 14.5254 77.793; 81.707; 77.341 | 654.74 | Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br) New Journal of Chemistry, 2003, 27, 1522 |
| 7060475 | CIF | C16 H12 F N O2 | P 1 c 1 | 7.1272; 12.8757; 7.3763 90; 104.703; 90 | 654.74 | Kukkonen, Esa; Lahtinen, Elmeri; Myllyperkiö, Pasi; Haukka, Matti; Konu, Jari Nonlinear optical properties of diaromatic stilbene, butadiene and thiophene derivatives New Journal of Chemistry, 2021, 45, 6640-6650 |
| 7057779 | CIF | C22 H20 Cu2 I2 N4 Se2 | P -1 | 7.8651; 9.3649; 9.9211 87.404; 71.217; 71.497 | 654.75 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
| 7058601 | CIF | C30 H30 O6 | P -1 | 8.6582; 8.9482; 9.1287 99.8; 94.649; 108.311 | 654.76 | Agrahari, Anand K.; Singh, Anoop S.; Singh, Ashish Kumar; Mishra, Nidhi; Singh, Mala; Prakash, Pradyot; Tiwari, Vinod K. Click inspired synthesis of hexa and octadecavalent peripheral galactosylated glycodendrimers and their possible therapeutic applications New Journal of Chemistry, 2019, 43, 12475 |
| 7051336 | CIF | C3 H12 Cl N2 O | P 1 21/c 1 | 4.7197; 10.658; 13.046 90; 93.25; 90 | 655.2 | New Journal of Chemistry, 2000 |
| 7053658 | CIF | C20 H21.98 Eu2 N2 O16.99 | P -1 | 7.97; 9.419; 10.391 95.79; 112.084; 110.002 | 655.2 | Zhang, Lijuan; Xu, Donghua; Zhou, Yunshan; Jiang, Fei Design of 3-D europium(iii)‒organic frameworks based on pyridine carboxylate N-oxide and acyclic binary carboxylate: syntheses, structures, and luminescence properties New Journal of Chemistry, 2010, 34, 2470 |
| 7053030 | CIF | C26 H24 N2 O10 S2 Zn | P -1 | 8.4656; 8.9809; 9.2251 76.535; 85.007; 74.037 | 655.6 | Hong, Xu-Jia; Wang, Ming-Fang; Jia, Hong-Yang; Li, Wei-Xing; Li, Jing; Liu, Yi-Ting; Jin, Hong-Guang; Cai, Yue-Peng Assemblies of several supramolecular networks containing quinoline-2,3-dicarboxylic acid New Journal of Chemistry, 2013, 37, 933 |
| 7050557 | CIF | C10 H13 Cu N3 O7 | P -1 | 7.0936; 9.8281; 10.1197 80.231; 81.306; 71.641 | 656.28 | José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes New J. Chem., 2003, 27, 1775-1783 |
| 7053273 | CIF | C7 H6 O4 | P 1 21/n 1 | 5.6491; 4.9306; 23.6191 90; 92.277; 90 | 657.35 | Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C. Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids New Journal of Chemistry, 2010, 34, 85 |
| 7054571 | CIF | C24 H34 O4 S4 | P -1 | 4.919; 7.285; 18.574 84.19; 86.42; 84.08 | 657.7 | Turbiez, Mathieu; Faye, Djibril; Leriche, Philippe; Frère, Pierre Bis-EDOT end capped by n-hexyl or n-hexylsulfanyl groups: the effect of the substituents on the stability of the oxidized states New J. Chem., 2015, 39, 1678 |
| 7060975 | CIF | C15 H8 Cl2 O3 | P -1 | 6.4976; 8.4557; 12.4568 79.643; 82.09; 79.56 | 658.19 | Ahmed, Muhammad Naeem; Ghias, Mehreen; Shah, Syed Wadood Ali; Shoaib, Mohammad; Tahir, Muhammad Nawaz; Ashfaq, Muhammad; Ibrahim, Mahmoud A. A.; Andleeb, Hina; Gil, Diego M.; Frontera, Antonio X-ray characterization, Hirshfeld surface analysis, DFT calculations, in vitro and in silico lipoxygenase inhibition (LOX) studies of dichlorophenyl substituted 3-hydroxy-chromenones New Journal of Chemistry, 2021, 45, 19928-19940 |
| 7062181 | CIF | C16 H32 Cu2 F2 I4 N4 | P 1 | 7.4735; 8.6042; 10.7737 80.277; 83.715; 75.29 | 658.84 | Shao, Juan-Juan; Ni, Jian-Ling; Chen, Wei-Min; Liu, Peng-Lai; Mensah, Abraham; Chen, Li-Zhuang; Wang, Fang-Ming Systematic regulation of ligands realizes the transition of luminescence color cuprous iodide inorganic–organic hybrid materials from blue to green light New Journal of Chemistry, 2023, 47, 2556-2564 |
| 7053682 | CIF | F18 Sb3 Tl | P -3 | 9.408; 9.408; 8.597 90; 90; 120 | 659 | Mazej, Zoran; Goreshnik, Evgeny Fluoride ion donor properties of group 13 trifluorides (MF3, M = Al, Ga, In, Tl) and crystal structures of InF3·3SbF5, TlF3·3SbF5 and TlF3·AsF5·2HF New Journal of Chemistry, 2010, 34, 2806 |
| 7051305 | CIF | C22 H36 Fe N4 O10 | P -1 | 5.768; 10.553; 11.536 109.374; 94.184; 90.998 | 660 | New Journal of Chemistry, 2000 |
| 7061185 | CIF | C14 H14 N2 O5 | P -1 | 8.432; 8.645; 10.0078 66.339; 84.385; 81.355 | 660.03 | Horsten, Tomas; Alegbejo Price, Temitayo Omowumi; Van Meervelt, Luc; Emery, Flavio da Silva; Dehaen, Wim 2-Imidazolidinone benzofurans as unexpected outcome of the Lewis acid mediated Nenitzescu reaction New Journal of Chemistry, 2022, 46, 2028-2032 |
| 7056543 | CIF | C15 H15 N O4 | P -1 | 7.5616; 8.9033; 10.8091 72.764; 80.486; 72.369 | 660.09 | Seeni, Maharani; Vivek Kumar, Sundaravel; Almansour, Abdulrahman Ibrahim; Kumar, Raju; K, Anitha; Raju, Ranjith Kumar Synthesis of penta- and tetra-cyclic cage-like compounds and dispiro heterocycles through microwave-assisted solvent-free multi-component domino reactions New J. Chem., 2017 |
| 7050156 | CIF | C12 H8 Ag N5 O4 | P -1 | 8.949; 9.856; 8.358 102.12; 110.5; 74.78 | 660.6 | Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer New Journal of Chemistry, 2004, 28, 191-199 |
| 7056862 | CIF | C16 H40 Cu2 N16 | P -1 | 8.586; 8.607; 9.1858 85.11; 84.7; 78.652 | 661.15 | Massoud, Salah S.; Henary, Maher M.; Maxwell, Lindley; Martín, Alejandro; Ruiz, Eliseo; Vicente, Ramon; Fischer, Roland C.; Mautner, Franz A. Structure, magnetic properties and DFT calculations of azido-copper(ii) complexes with different azido-bonding, nuclearity and dimensionality New Journal of Chemistry, 2018, 42, 2627 |
| 7052139 | CIF | C8 H8 N2 | P 1 21/n 1 | 8.907; 5.6894; 13.0599 90; 90.588; 90 | 661.78 | Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles New Journal of Chemistry, 2007, 31, 936 |
| 7061678 | CIF | C15 H16 N2 O3 | P -1 | 6.2372; 10.2168; 10.4548 89.654; 86.046; 84.783 | 661.88 | Barman, Sayani; Jana, Subhendu; Panigrahi, Gopabandhu; Yadav, Sweta; Niranjan, Manish K.; Prakash, Jai Ba3Zr2Cu4S9: the first quaternary phase of the Ba–Zr–Cu–S system New Journal of Chemistry, 2022, 46, 15976-15986 |
| 7062374 | CIF | C24 H24 Cu2 N8 O8 | P -1 | 9.3312; 9.3618; 9.405 60.556; 76.213; 68.001 | 661.9 | Gurbanov, Atash V.; Mahmoud, Abdallah G.; Aliyeva, Vusala A.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. Novel cyano-activated Cu(ii) complexes of arylhydrazones of active methylene nitriles and their catalytic application for azide–alkyne cycloaddition in water and glycerol New Journal of Chemistry, 2023, 47, 7965-7974 |
| 7050116 | CIF | C10 H12 I N O6 S | P 1 | 7.5196; 8.1049; 11.426 101.53; 96.26; 100.54 | 663.1 | Koposov, Alexey Y.; Nemykin, Victor N.; Zhdankin, Viktor V. Intra- and intermolecular interactions in the solid state structure of 2-iodylbenzenesulfonamides: a heptacoordinated organic iodine(v) compound New Journal of Chemistry, 2005, 29, 998 |
| 7050744 | CIF | C16 H14 N4 | P -1 | 7.778; 9.003; 10.24 101.77; 97.54; 105.52 | 663.1 | Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz Supramolecular structures formed by 2-aminopyridine derivatives. New Journal of Chemistry, 2002, 26, 448 |
| 7061345 | CIF | C28 H34 Cu N4 O6 | P -1 | 5.841; 9.7548; 11.6529 92.222; 91.154; 91.002 | 663.21 | Podjed, Nina; Modec, Barbara; Clérac, Rodolphe; Rouzières, Mathieu; Alcaide, María M.; López-Serrano, Joaquín Structural diversity and magnetic properties of copper(ii) quinaldinate compounds with amino alcohols New Journal of Chemistry, 2022, 46, 6899-6920 |
| 7054112 | CIF | Mo4 O15 Y2 | P 1 21/c 1 | 6.8185; 9.5913; 10.5299 90; 105.586; 90 | 663.31 | Laufer, Sonja; Strobel, Sabine; Schleid, Thomas; Cybinska, Joanna; Mudring, Anja-Verena; Hartenbach, Ingo Yttrium(iii) oxomolybdates(vi) as potential host materials for luminescence applications: an investigation of Eu3±doped Y2[MoO4]3 and Y2[MoO4]2[Mo2O7] New Journal of Chemistry, 2013, 37, 1919 |
| 7056669 | CIF | C10 H11 Cl N4 O6 | P 1 n 1 | 4.419; 8.581; 17.499 90; 91.35; 90 | 663.4 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7052236 | CIF | C38 H38 | P -1 | 6.662; 10.16; 11.1284 114.744; 92.734; 101.36 | 663.47 | Torsten Müller; Wilhelm Seichter; Edwin Weber Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions New Journal of Chemistry, 2006, 30, 751 |
| 7062862 | CIF | C15 H12 N6 O2 | P 1 21 1 | 7.4288; 7.2604; 12.4596 90; 99.035; 90 | 663.684 | Nandi, Nishithendu Bikash; Das, Nishan; Ghanta, Susanta; Puzari, Krishti Rekha; Dutta, Pranab; Kłak, Julia; Sieroń, Lesław; Maniukiewicz, Waldemar; Misra, Tarun Kumar Atropisomers and a copper(ii) complex derived from 1,3-dimethyl-5-(8′-quinolinylazo)-6-aminouracil: structures, magnetism and biological properties New Journal of Chemistry, 2023, 47, 21633-21647 |
| 7062861 | CIF | C15 H12 N6 O2 | P 1 21 1 | 7.4301; 7.26; 12.4619 90; 99.037; 90 | 663.882 | Nandi, Nishithendu Bikash; Das, Nishan; Ghanta, Susanta; Puzari, Krishti Rekha; Dutta, Pranab; Kłak, Julia; Sieroń, Lesław; Maniukiewicz, Waldemar; Misra, Tarun Kumar Atropisomers and a copper(ii) complex derived from 1,3-dimethyl-5-(8′-quinolinylazo)-6-aminouracil: structures, magnetism and biological properties New Journal of Chemistry, 2023, 47, 21633-21647 |
| 7060747 | CIF | C6 H4 N8 Na2 O10 | P -1 | 7.495; 9.356; 10.19 72.347; 87.502; 77.247 | 663.9 | Wang, Yu; Xu, Siyu; Li, Heng; Ma, Haixia; Zhang, Yazhou; Guo, Zhaoqi Laser ignition of energetic complexes: impact of metal ion on laser initiation ability New Journal of Chemistry, 2021, 45, 12705-12710 |
| 7056672 | CIF | C10 H13 N4 O6 P | P 1 n 1 | 4.4091; 8.6022; 17.525 90; 91.34; 90 | 664.5 | Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts New J. Chem., 2017 |
| 7053419 | CIF | C30 H34 N4 O5 | P 1 | 9.0758; 9.2281; 9.3635 64.225; 81.697; 70.435 | 665.42 | Lenev, Denis A.; Lyssenko, Konstantin A.; Kostyanovsky, Remir G. The chiral drug Albicar: resolution of its racemate via complexation with BINOL New Journal of Chemistry, 2010, 34, 403 |
| 7061219 | CIF | C8 H4 F N S | P 1 21/c 1 | 8.82; 5.152; 14.649 90; 91.24; 90 | 665.5 | Costa, Letícia D.; Guieu, Samuel; Faustino, Maria do Amparo F.; Tomé, Augusto C. Straightforward synthesis of thiazolo[5,4-c]isoquinolines from dithiooxamide and 2-halobenzaldehydes New Journal of Chemistry, 2022, 46, 3602-3615 |
| 7054644 | CIF | C22 H40 Cl4 N4 O2 | P -1 | 7.9236; 10.168; 10.2931 62.925; 67.443; 69.428 | 665.97 | Khandar, Ali Akbar; Kirschbaum, Kristin; Abedi, Marjan; Mock, Kristi; Tracy, Greg; Spasojevic, Vojislav; Hosseini-Yazdi, Seyed Abolfazl Synthesis, characterization and crystal structures of mono and dinuclear macrocyclic cobalt(ii) complexes with a new tetraaza m-xylyl-based macrocyclic ligand New J. Chem., 2015, 39, 2822 |
| 7052928 | CIF | C4 H8 N6 | P 1 21/c 1 | 7.533; 7.408; 12.029 90; 96.629; 90 | 666.8 | Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao 1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound New Journal of Chemistry, 2012, 36, 1953 |
| 7057899 | CIF | C30 H24 Cl2 Cu N4 O2 | P -1 | 8.087; 9.2417; 9.6103 75.944; 75.005; 79.112 | 666.9 | Smirnov, Andrey S.; Martins, Luísa M. D. R. S.; Nikolaev, Dmitriy N.; Manzhos, Roman A.; Gurzhiy, Vlad V.; Krivenko, Alexander G.; Nikolaenko, Kirill O.; Belyakov, Alexander V.; Garabadzhiu, Alexander V.; Davidovich, Pavel B. Structure and catalytic properties of novel copper isatin Schiff base complexes New Journal of Chemistry, 2019, 43, 188 |
| 7058736 | CIF | C16 H20 N10 O20 Zn | P -1 | 7.1016; 7.9404; 12.364 96.25; 92.51; 105.12 | 667.2 | Yang, Xiaoming; Wang, Yanna; Li, Zhimin; Du, Jiang; Wang, Lin; Zhang, Tonglai Energetic transition metal complexes based on methyl carbazate and picric acid: syntheses, structures, physicochemical properties and catalysis on the thermal decomposition of ammonium perchlorate New Journal of Chemistry, 2019, 43, 14159 |
| 7061334 | CIF | C28 H34 Cu N4 O6 | P -1 | 6.063; 10.1393; 10.9316 87.176; 84.072; 88.091 | 667.34 | Podjed, Nina; Modec, Barbara; Clérac, Rodolphe; Rouzières, Mathieu; Alcaide, María M.; López-Serrano, Joaquín Structural diversity and magnetic properties of copper(ii) quinaldinate compounds with amino alcohols New Journal of Chemistry, 2022, 46, 6899-6920 |
| 7057052 | CIF | C13 H12 N4 O2 Pb | P -1 | 7.2696; 9.6656; 10.0853 93.216; 100.911; 105.07 | 667.75 | Mahmoudi, Ghodrat; Zangrando, Ennio; Mitoraj, Mariusz P.; Gurbanov, Atash V.; Zubkov, Fedor I.; Moosavifar, Maryam; Konyaeva, Irina A.; Kirillov, Alexander M.; Safin, Damir A. Extended lead(ii) architectures engineered via tetrel bonding interactions New Journal of Chemistry, 2018, 42, 4959 |
| 7060470 | CIF | C16 H16 N2 O2 | P 1 21 1 | 5.9378; 7.3721; 15.3569 90; 96.417; 90 | 668.02 | Kukkonen, Esa; Lahtinen, Elmeri; Myllyperkiö, Pasi; Haukka, Matti; Konu, Jari Nonlinear optical properties of diaromatic stilbene, butadiene and thiophene derivatives New Journal of Chemistry, 2021, 45, 6640-6650 |
| 7054638 | CIF | C14 H34 Co N4 O18 S2 | P -1 | 6.7203; 8.2504; 12.3358 84.469; 79.593; 85.31 | 668.13 | Kammoun, Omar; Rekik, Walid; Naïli, Houcine; Bataille, Thierry Inorganic layered structures in hybrid double sulfates: related phases and thermal reactivity New J. Chem., 2015, 39, 2682 |
| 7053540 | CIF | C6 H6 Ag N O3 | P 1 21/c 1 | 3.6519; 12.1512; 15.07 90; 90.982; 90 | 668.63 | Kalf, Irmgard; Mathieu, Patrick; Englert, Ulli From crystal to crystal: a new polymorph of (4-carboxylatopyridine)silver(i) by topotactic dehydration of its monohydrate New Journal of Chemistry, 2010, 34, 2491 |
| 7059982 | CIF | C22 H18 Ag2 F12 N8 | P -1 | 7.9948; 9.2604; 10.149 95.903; 99.779; 113.145 | 668.8 | Dias, H. V. Rasika; Palehepitiya Gamage, Chammi S.; Jayaratna, Naleen B.; Hettiarachchi, Champika V. Mixed ligand complexes of silver(i) supported by highly fluorinated pyrazolates, and chelating and bridging N-heterocycles New Journal of Chemistry, 2020, 44, 17079-17087 |
| 7059425 | CIF | C16 H6 F4 N4 | P 1 21/c 1 | 13.3901; 6.3395; 7.8929 90; 93.316; 90 | 668.88 | Pedrini, Alessandro; Maspero, Angelo; Bracco, Silvia; Comotti, Angelina; Galli, Simona; Marchiò, Luciano; Nardo, Luca; Penoni, Andrea; Scapinello, Luca; Sozzani, Piero; Vesco, Guglielmo; Mella, Massimo Synthesis, crystal structure, and optical properties of fluorinated poly(pyrazole) ligands and in silico assessment of their affinity for volatile organic compounds New Journal of Chemistry, 2020, 44, 6443-6455 |
| 7052825 | CIF | C13 H13 F N2 O3 | P -1 | 7.1447; 7.5795; 13.441 83.394; 78.094; 70.208 | 669.34 | Zhang, Zhenfeng; Tong, Hongbo; Wu, Yanbo; Zhang, Guisheng C⋯π interaction of non-hydrogen bond type New Journal of Chemistry, 2012, 36, 44 |
| 7058948 | CIF | C16 H14 Cu N16 O18 | P -1 | 8.0087; 8.7623; 11.2661 69.572; 78.715; 64.89 | 669.8 | Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions New Journal of Chemistry, 2019 |
| 7058762 | CIF | C5 H9 As O3 | P 1 21/n 1 | 5.9923; 10.546; 10.779 90; 100.379; 90 | 670 | Trubenstein, Henry J.; Moaven, Shiva; Vega, Maythe; Unruh, Daniel K.; Cozzolino, Anthony F. Pnictogen bonding with alkoxide cages: which pnictogen is best? New Journal of Chemistry, 2019, 43, 14305 |
| 7054654 | CIF | C28 H34 N6 O4 | P -1 | 5.2731; 7.8464; 17.163 81.964; 88.938; 72.499 | 670.39 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7061696 | CIF | C32 H28 Cl2 N2 O2 Ru2 | P -1 | 7.562; 9.2366; 9.7047 91.151; 91.017; 98.196 | 670.64 | Vatsa, Aditi; Padhi, Sumanta Kumar Formic acid dehydrogenation by [Ru(η6-benzene)(L)Cl] catalysts: L = 2-methylquinolin-8-olate and quinolin-8-olate New Journal of Chemistry, 2022, 46, 15723-15731 |
| 7056501 | CIF | C12 H19 N O5 | P -1 | 6.1511; 6.3794; 17.526 88.877; 80.145; 82.187 | 671.28 | Weck, Christian; Obst, Franziska; Nauha, Elisa; Schofield, Christopher J.; Gruber, Tobias Synthesis of a bicyclic oxo-γ-lactam from a simple caprolactam derivative New J. Chem., 2017 |
| 7062984 | CIF | C22 H30 Cl2 Cu N6 O10 | P -1 | 7.2188; 7.2384; 13.1301 96.606; 90.314; 99.721 | 671.52 | Chauhan, Chetan; Kumar, Santosh; Kumar, Rajesh; Saini, Anju; Aree, Thammarat Synergistic effects of steric constraints and non-covalent interactions in copper(ii) chloro-nitro-benzoato complexes: synthesis, structural characterization, theoretical investigations, antimicrobial studies, and molecular docking analyses New Journal of Chemistry, 2024, 48, 3829-3848 |
| 7058453 | CIF | C25 H28 N2 O18 | P -1 | 8.537; 8.7025; 9.7295 84.792; 88.545; 68.948 | 671.79 | Liang, Xiaoqiang; Chen, Yixiang; Wang, Li; Zhang, Feng; Fan, Zenglu; Cao, Tingting; Cao, Yaya; Zhu, Huifang; He, Xinyue; Deng, Bolin; You, Yazhi; Dong, Yu; Zhao, Yamei Effect of carbon-skeleton isomerism on the dielectric properties and proton conduction of organic cocrystal compounds assembled from 1,2,4,5-benzenetetracarboxylic acid and piperazine derivatives New Journal of Chemistry, 2019, 43, 11099 |
| 7053153 | CIF | C44 H26 | P -1 | 8.0943; 8.7229; 10.6687 99.129; 90.439; 114.943 | 672.02 | Kwon, Jongchul; Hong, Jung-Pyo; Lee, Seonghoon; Hong, Jong-In 4,4′-Di(pyren-1-yl)-1,1′-biphenyl as an efficient material for organic light-emitting diodes and thin-film transistors New Journal of Chemistry, 2013, 37, 2881 |
| 7058479 | CIF | C7 H7 N13 O7 | P -1 | 8.6518; 8.7863; 9.96 83.38; 66.139; 76.502 | 673.11 | Xu, Minxian; Cheng, Guangbin; Xiong, Hualin; Wang, Bohan; Ju, Xuehai; Yang, Hongwei Synthesis of high-performance insensitive energetic materials based on nitropyrazole and 1,2,4-triazole New Journal of Chemistry, 2019, 43, 11157 |
| 7051783 | CIF | C9 H6 Au Cl N3 P S3 | P -1 | 8.0705; 8.6077; 10.5184 72.425; 84.882; 75.129 | 673.2 | Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G. Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions New Journal of Chemistry, 2008, 32, 138 |
| 7052141 | CIF | C8 H F7 N2 | P 32 | 12.5382; 12.5382; 4.9499 90; 90; 120 | 673.9 | Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles New Journal of Chemistry, 2007, 31, 936 |
| 7060815 | CIF | C13 H12 Br N O3 S | P -1 | 8.3674; 8.5936; 10.4526 88.161; 88.241; 63.805 | 673.95 | Chung, Duy T. M.; Tran, Phuong Vy; Chau Nguyen, Khiem; Wang, Pengzhi; Lindsey, Jonathan S. Synthesis of model bacteriochlorophylls containing substituents of native rings A, C and E New Journal of Chemistry, 2021, 45, 13302-13316 |
| 7054639 | CIF | C14 H34 Cu N4 O18 S2 | P -1 | 6.8292; 8.1314; 12.3445 85.429; 81.437; 85.436 | 674.11 | Kammoun, Omar; Rekik, Walid; Naïli, Houcine; Bataille, Thierry Inorganic layered structures in hybrid double sulfates: related phases and thermal reactivity New J. Chem., 2015, 39, 2682 |
| 7057978 | CIF | C10 H10 Cu F3 N3 O3 | P -1 | 6.3596; 7.6821; 14.234 102.532; 94.963; 93.215 | 674.3 | Cen, Peipei; Yuan, Weize; Luo, Shuchang; Liu, Xiangyu; Xie, Gang; Chen, Sanping Solvent coligands fine-tuned the structures and magnetic properties of triple-bridged 1D azido-copper(ii) coordination polymers New Journal of Chemistry, 2019, 43, 601 |
| 7054020 | CIF | C5 H4 Cu N2 O4 | P 1 21/c 1 | 8.5694; 9.3227; 8.4631 90; 92.1; 90 | 675.66 | Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes New Journal of Chemistry, 2014, 38, 1611 |
| 1544071 | CIF | C10 H7 Ag2 Fe N7 | C 1 m 1 | 6.734; 12.536; 9.12 90; 118.622; 90 | 675.8 | Gural'skiy, Il'ya A.; Shylin, Sergii I.; Golub, Bohdan O.; Ksenofontov, Vadim; Fritsky, Igor O.; Tremel, Wolfgang High temperature spin crossover in [Fe(pyrazine){Ag(CN)2}2] and its solvate New J. Chem., 2016, 40, 9012 |
| 7052117 | CIF | C12 H14 F3 N O5 | P -1 | 8.3685; 9.1253; 9.7248 69.2894; 82.1053; 77.1832 | 675.92 | Alberto Avenoza; Jesús H. Busto; Noelia Canal; José I. García; Gonzalo Jiménez-Osés; Jesús M. Peregrina; Marta Pérez-Fernández Mechanistic study of the ring-size modulation in Michael?Dieckmann type reactions of 2-acylaminoacrylates with ketene diethyl acetal New Journal of Chemistry, 2007, 31, 224 |
| 7051784 | CIF | C9 H6 Au Cl N3 P S3 | P -1 | 8.6111; 8.7006; 9.5117 90.821; 97.446; 106.515 | 676.5 | Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G. Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions New Journal of Chemistry, 2008, 32, 138 |
| 7054651 | CIF | C28 H32 N6 O8 | P -1 | 7.6142; 8.6608; 11.0348 102.357; 105.996; 93.866 | 677.09 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7050569 | CIF | C28 H20 Cl6 N4 | P -1 | 6.234; 9.344; 12.612 70.957; 77.614; 84.16 | 677.89 | Patra, Goutam Kumar; Goldberg, Israel The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/ New Journal of Chemistry, 2003, 27, 1124 |
| 7056414 | CIF | C3 H6 N10 O12 | P 1 21 1 | 7.8388; 7.873; 10.987 90; 90.413; 90 | 678 | Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide New J. Chem., 2017 |
| 7056202 | CIF | C5 H6 N8 O13 | P n n 2 | 10.396; 11.229; 5.8102 90; 90; 90 | 678.3 | Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Yang, Hongwei An interesting ring cleavage of 1,2,4-oxadiazole ring New J. Chem., 2017 |
| 7060731 | CIF | C12 H11 N O2 S4 | P -1 | 7.3968; 8.334; 11.6041 82.169; 89.492; 73.337 | 678.56 | Afzali, Azadeh; Abdollahi, Maryam F.; Zhang, Baiyu; Zhao, Yuming Donor/acceptor substituted dithiafulvenes and tetrathiafulvalene vinylogues: electronic absorption, crystallographic, and computational analyses New Journal of Chemistry, 2021, 45, 11918-11926 |
| 7058675 | CIF | C16 H9 Cl O2 Se | P -1 | 7.7944; 7.9496; 12.1938 91.575; 105.071; 110.273 | 678.58 | Jardim, Guilherme A. M.; Bozzi, Ícaro A. O.; Oliveira, Willian X. C.; Mesquita-Rodrigues, Camila; Menna-Barreto, Rubem F. S.; Kumar, Ramar A.; Gravel, Edmond; Doris, Eric; Braga, Antonio L.; da Silva Júnior, Eufrânio N. Copper complexes and carbon nanotube‒copper ferrite-catalyzed benzenoid A-ring selenation of quinones: an efficient method for the synthesis of trypanocidal agents New Journal of Chemistry, 2019, 43, 13751 |
| 7062441 | CIF | C28 H16 Fe N12 Ni O2 | P -1 | 6.898; 7.436; 13.424 98.963; 92.418; 90.299 | 679.5 | Feng, Zhe; Ling, Jie-Jie; Song, Huijie; Zhu, Dunru Modulation of the spin transition in 2D Hofmann frameworks via π⋯π stacking between the axial 2,5-dipyridyl-1,3,4-oxadiazoles New Journal of Chemistry, 2023, 47, 10162-10168 |
| 7057793 | CIF | C15 H14 B F2 N O | P 1 21 1 | 8.1632; 6.2464; 13.8361 90; 105.594; 90 | 679.54 | Vaz, Patrícia A. A. M.; Rocha, João; Silva, Artur M. S.; Guieu, Samuel Aggregation-induced emission enhancement of chiral boranils New Journal of Chemistry, 2018, 42, 18166 |
| 7062259 | CIF | C13 H8 Cl I2 N O | P -1 | 7.9582; 8.5499; 11.2354 87.144; 76.439; 66.457 | 680.48 | Ahangar, Aadil A.; Ahmad, Ishtiyaq; Dar, Aijaz A. AIE in the halogenated anils and their utilization as fluorescent probes for explosive nitro-aromatics New Journal of Chemistry, 2023, 47, 4775-4783 |
| 7059809 | CIF | C14 H13 N5 O2 | P -1 | 7.7355; 9.1187; 9.7039 93.758; 93.79; 92.877 | 680.5 | Topić, Edi; Landripet, Ivana; Duguin, Maëlle; Pisk, Jana; Đilović, Ivica; Vrdoljak, Višnja; Rubčić, Mirta Coordinating and supramolecular prospects of unsymmetrically substituted carbohydrazides New Journal of Chemistry, 2020, 44, 13357-13367 |
| 7056413 | CIF | C3 H7 N11 O11 | P 1 21 1 | 8.228; 7.3357; 11.3167 90; 94.923; 90 | 680.54 | Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide New J. Chem., 2017 |
| 7058098 | CIF | C10 H5 Br2 N4 O3 Re | P -1 | 6.769; 8.079; 13.343 106.008; 102.69; 91.343 | 681.5 | Pizarro, Nancy; Saldías, Marianela; Guzmán, Nicolás; Sandoval-Altamirano, Catalina; Kahlal, Samia; Saillard, Jean-Yves; Hamon, Jean-René; Vega, Andrés 1IL and 3MLCT excited states modulated by H+: the structure and photophysical properties of [(2-bromo-5-(1H-pyrazol-1-yl)pyrazine)Re(CO)3Br] New Journal of Chemistry, 2019, 43, 2449 |
| 7051341 | CIF | C4 H12 Cl N2 | P 1 21/c 1 | 5.5047; 11.895; 10.41 90; 90.67; 90 | 681.6 | New Journal of Chemistry, 2000 |
| 7055640 | CIF | C31 H23 F3 N2 O7 S | P -1 | 8.2989; 9.0995; 9.8014 72.396; 77.357; 78.795 | 681.83 | Trzybiński, Damian; Zadykowicz, Beata; Wera, Michał; Serdiuk, Illia E.; Sieradzan, Andrzej; Sikorski, Artur; Storoniak, Piotr; Krzymiński, Karol Structure, formation, thermodynamics and interactions in 9-carboxy-10-methylacridinium-based molecular systems New J. Chem., 2016, 40, 7359 |
| 7051248 | CIF | C18 H12 O2 | P -1 | 8.7684; 8.9558; 10.315 113.78; 102.06; 102.59 | 682.3 | Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R. Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family New Journal of Chemistry, 2000, 24, 1 |
| 7053686 | CIF | C32 H36 O8 | P -1 | 7.4523; 8.838; 10.7212 84.569; 77.234; 83.613 | 682.61 | Fernando, Isurika R.; Bairu, Semere G.; Ramakrishna, Guda; Mezei, Gellert Single-color pseudorotaxane-based temperature sensing New Journal of Chemistry, 2010, 34, 2097 |
| 7061512 | CIF | C15 H10 Cl N5 O | P -1 | 6.5832; 7.6795; 13.7007 97.024; 91.925; 96.046 | 682.87 | Kumari, Annu; Dehaen, Wim; Chopra, Deepak; Dey, Swapan Imidazopyridine–fluoride interaction: solvent-switched AIE effects via S⋯O conformational locking New Journal of Chemistry, 2022, 46, 10628-10636 |
| 7062450 | CIF | C13 H12 Cu N6 O3 | P -1 | 7.3702; 10.2412; 10.3398 71.39; 70.13; 73.883 | 682.97 | Ermakova, Ekaterina A.; Golubeva, Yuliya A.; Smirnova, Ksenia S.; Klyushova, Lyubov S.; Berezin, Alexey S.; Fetisov, Leonid N.; Svyatogorova, Alexandra E.; Andros, Natalia O.; Zubenko, Alexander A.; Lider, Elizaveta V. Cytotoxic mixed-ligand copper(ii) complexes with 1H-tetrazole-5-acetic acid and oligopyridine derivatives New Journal of Chemistry, 2023, 47, 9472-9482 |
| 7050592 | CIF | C6 H12 Ca N4 O9 S2 | P -1 | 5.9972; 9.2102; 12.9567 76.536; 89.264; 79.057 | 682.98 | Mezei, Gellert; Raptis, Raphael G. Pyrazole-4-sulfonate networks of alkali and alkaline-earth metals. Effect of cation size, charge, H-bonding and aromatic interactions on the three-dimensional supramolecular architecture New Journal of Chemistry, 2003, 27, 1399 |
| 7056663 | CIF | C9 H14 N4 O4 S | P -1 | 6.6195; 8.2505; 12.924 96.15; 99.794; 97.771 | 683 | Fernández-Stefanuto, V.; Verdía, P.; Tojo, E. A new procedure to obtain ε-caprolactam catalyzed by a guanidinium salt New J. Chem., 2017 |
| 7053820 | CIF | C13 H14 N2 O2 S2 | P -1 | 8.0365; 8.9123; 11.2816 98.842; 107.731; 111.521 | 683.11 | Johnston, Karen A.; McNab, Hamish Synthesis and properties of 5,6-dihydrodipyrrolo[1,2-d;2′,1′-g][1,4]diazepin-11-one New Journal of Chemistry, 2009, 33, 1703 |
| 7057359 | CIF | C10 H10 F4 I2 N2 | P -1 | 6.1088; 9.4013; 12.4113 103.403; 96.182; 95.921 | 683.27 | Bedeković, Nikola; Stilinović, Vladimir; Friščić, Tomislav; Cinčić, Dominik Comparison of isomericmeta- andpara-diiodotetrafluorobenzene as halogen bond donors in crystal engineering New Journal of Chemistry, 2018, 42, 10584 |
| 7063063 | CIF | C16 H8 Br2 N2 | P -1 | 3.9428; 7.726; 22.719 91.706; 92.741; 98.326 | 683.5 | Ali, Hasrat; van Lier, Johan E. gem-Dibromovinyl phthalonitriles: synthesis, structure elucidation, Hirshfeld surface analysis and energy framework calculations New Journal of Chemistry, 2024, 48, 6350-6366 |
| 7056140 | CIF | C17 H15 N O2 | P -1 | 5.6408; 10.3136; 12.233 74.13; 89.422; 86.861 | 683.52 | Dawange, Monali; Parekh, Nikita; Kumbhar, Avinash; Dehaen, Wim; Kusurkar, Radhika A synthetic route towards 3,4-disubstituted pyrrolidin-2-ones via a Michael addition and reductive ring closing strategy New J. Chem., 2017, 41, 3612 |
| 7061913 | CIF | C12 H10 F2 N4 O6 | P -1 | 4.124; 12.7162; 14.3351 67.238; 82.602; 81.791 | 683.88 | Ghosh, Priyanka; Panda, Subhra Jyoti; Purohit, Chandra Shekhar A new short synthesis route for favipiravir and its analogue: Their tautomerization behaviour New Journal of Chemistry, 2022, 46, 18824-18831 |
| 7059470 | CIF | C12 H7 Cl3 N S Se | P -1 | 5.9982; 10.1384; 12.369 71.952; 82.221; 73.411 | 684.5 | Romito, Deborah; Biot, Nicolas; Babudri, Francesco; Bonifazi, Davide Non-covalent bridging of bithiophenes through chalcogen bonding grips New Journal of Chemistry, 2020, 44, 6732-6738 |
| 7058451 | CIF | C16 H14 N2 O3 | P -1 | 6.158; 7.899; 14.325 79.963; 87.426; 86.68 | 684.6 | Gupta, Vijay; Singh, Ravi P. Enantioselective vinylogous Michael addition of β,γ-unsaturated butenolide to 2-iminochromenes New Journal of Chemistry, 2019, 43, 9771 |
| 7061800 | CIF | C15 H17 N5 | P -1 | 9.2845; 9.2942; 9.4489 67.465; 69.5; 70.108 | 685.12 | Hu, Haoran; Jiang, Bitao; Zhang, Bo; Wang, Rong; Zhang, Chong; Sun, Chengguo; Hu, Bingcheng Novel pyrazolyazoindole derivatives as photoswitches: design, synthesis, and photoswitching behavior research combined with theoretical methods New Journal of Chemistry, 2022, 46, 18316-18325 |
| 7055509 | CIF | C8 H7 N9 O8 | P -1 | 8.5617; 9.3986; 9.7876 113.277; 106.073; 92.266 | 685.23 | Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines New J. Chem., 2016, 40, 6059 |
| 7058906 | CIF | C5 H10 O4 | P 43 21 2 | 8.9845; 8.9845; 8.5007 90; 90; 90 | 686.19 | Arp, Fabian Felix; Ahn, Shin Hye; Bhuvanesh, Nattamai; Bluemel, Janet Selective Synthesis and Stabilization of Peroxides via Phosphine Oxides New Journal of Chemistry, 2019 |
| 7061151 | CIF | C14 H8 Br2 N2 O2 | P -1 | 7.9284; 8.2719; 12.334 85.421; 71.683; 63.651 | 686.4 | Zhang, Qi; Zhao, Cheng; Zhang, Xun; He, Chunlin; Pang, Siping Oxidation of o-dioxime by (diacetoxyiodo)benzene: green and mild access to furoxans New Journal of Chemistry, 2022, 46, 1489-1493 |
| 7050608 | CIF | C24 H42 As2 Cl2 Pd | P -1 | 7.982; 9.366; 10.1692 68.166; 82.138; 77.166 | 686.84 | Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures New Journal of Chemistry, 2003, 27, 1584 |
| 7061519 | CIF | C16 H26 B2 Fe N18 O2 S2 | P -1 | 8.3929; 9.0045; 10.0309 86.465; 84.49; 65.635 | 687.2 | Horniichuk, Oleksandr Ye.; Ridier, Karl; Molnár, Gábor; Kotsyubynsky, Volodymyr O.; Shova, Sergiu; Amirkhanov, Vladimir M.; Gural'skiy, Il’ya A.; Salmon, Lionel; Bousseksou, Azzedine Solvatomorphism, polymorphism and spin crossover in bis[hydrotris(1,2,3-triazol-1-yl)borate]iron(ii) New Journal of Chemistry, 2022, 46, 11734-11740 |
| 7061368 | CIF | C36 H34 N4 | P -1 | 6.9576; 8.7932; 12.4732 106.094; 105.084; 98.5367 | 687.64 | Jing, Haoyu; Liu, Sijia; Jiang, Jianbing; Tran, Vy-Phuong; Rong, Jie; Wang, Pengzhi; Lindsey, Jonathan S. Meso bromination and derivatization of synthetic bacteriochlorins New Journal of Chemistry, 2022 |
| 7055683 | CIF | C10 H6 Cu N6 O8 | P -1 | 7.9317; 8.7062; 11.2388 100.563; 107.502; 104.506 | 687.88 | Yang, Qi; Ge, Jing; Gong, Qibing; Song, Xiaxia; Zhao, Jinwen; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli Two energetic complexes incorporating 3,5-dinitrobenzoic acid and azole ligands: microwave-assisted synthesis, favorable detonation properties, insensitivity and effects on the thermal decomposition of RDX New J. Chem., 2016, 40, 7779 |
| 7054443 | CIF | C11 H18 N2 O3 S2 | P -1 | 7.9432; 8.4258; 11.299 89.703; 71.855; 73.959 | 687.92 | Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J. Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy New J. Chem., 2014, 38, 5905 |
| 7054834 | CIF | C29 H29 N3 Pd S4 | P -1 | 6.7086; 10.3187; 10.8136 74.967; 84.813; 72.281 | 688.59 | Yadav, Manoj Kumar; Rajput, Gunjan; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai Rare intermolecular M⋯H‒C anagostic interactions in homoleptic Ni(ii)‒Pd(ii) dithiocarbamate complexes New J. Chem., 2015, 39, 5493 |
| 7059308 | CIF | C16 H13 N O3 S | P -1 | 7.518; 9.118; 11.293 70.671; 71.668; 78.323 | 689.2 | Bhasin, Aman K. K.; Raj, Pushap; Chauhan, Pooja; Mandal, Sanjay K.; Chaudhary, Savita; Singh, Narinder; Kaur, Navneet Design and synthesis of a novel coumarin-based framework as a potential chemomarker of a neurotoxic insecticide, azamethiphos New Journal of Chemistry, 2020, 44, 3341-3349 |
| 7057528 | CIF | C13 H18 N2 O4 Zn0.5 | P -1 | 8.2199; 8.3508; 11.2244 86.849; 78.013; 66.215 | 689.3 | Sohail, Manzar; Altaf, Muhammad; Baig, Nadeem; Jamil, Rabia; Sher, Muhammad; Fazal, Atif A new water stable zinc metal organic framework as an electrode material for hydrazine sensing New Journal of Chemistry, 2018, 42, 12486 |
| 7059495 | CIF | C16 H10 F4 O2 | P -1 | 7.3516; 8.506; 12.5385 100.778; 96.71; 113.627 | 689.46 | Morita, Masato; Yamada, Shigeyuki; Konno, Tsutomu Fluorine-induced emission enhancement of tolanes via formation of tight molecular aggregates New Journal of Chemistry, 2020, 44, 6704-6708 |
| 7052838 | CIF | C11 H11 N5 O7 | P -1 | 7.2105; 9.615; 10.265 78.308; 82.099; 85.773 | 689.5 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
| 7058993 | CIF | C26 H16 N4 S8 | P -1 | 5.575; 10.0695; 12.6027 102.074; 91.263; 93.737 | 689.9 | Bechu, Damien; Rogez, Guillaume; Hosseini, Mir Wais; Baudron, Stéphane A. Tetrathiopyridyl-tetrathiafulvalene-based Cd(ii) coordination polymers: one ligand, one metal cation, many possibilities New Journal of Chemistry, 2019, 43, 14291 |
| 7051337 | CIF | C3 H12 Br N2 O | P 1 21/c 1 | 4.7413; 10.935; 13.315 90; 91.77; 90 | 690 | New Journal of Chemistry, 2000 |
| 7061776 | CIF | C15 H20 O5 | P -1 | 4.9574; 11.4656; 13.002 107.096; 100.136; 93.672 | 690.06 | Li, Fengli; Huang, Zhangyan; Mo, Shuyuan; Gu, Saisai; Zhang, Sitian; Yang, Beiye; Wang, Jianping; Hu, Zhengxi; Zhang, Yonghui Two undescribed pairs of isoprenyl hydroxybenzoic acid derivatives from coculture of Pestalotiopsis sp. and Penicillium bialowiezense: enantioseparation and their absolute configurations New Journal of Chemistry, 2022, 46, 17149-17152 |
| 7054027 | CIF | C20 H28 Cu3 N4 O16 | P -1 | 7.6832; 8.848; 10.4914 98.405; 90.733; 101.71 | 690.21 | Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes New Journal of Chemistry, 2014, 38, 1611 |
| 7057567 | CIF | C2 H3 Cd N9 O | P 1 21/n 1 | 6.5352; 9.853; 10.779 90; 95.922; 90 | 690.4 | Zhang, Mi; Xu, Jian-Gang; Zhang, Ning-Ning; Lu, Jian; Xin, Xue-Huan; Zheng, Fa-Kun; Guo, Guo-Cong A highly stable and tightly packed 3D energetic coordination polymer assembled from nitrogen-rich tetrazole derivatives New Journal of Chemistry, 2018, 42, 13927 |
| 7055883 | CIF | C10 H10 N5 O6 V | P -1 | 7.8991; 8.1586; 12.3149 74.517; 85.174; 64.596 | 690.463 | Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study New J. Chem., 2017, 41, 735 |
| 7052830 | CIF | C7 H10 N2 O | P c a 21 | 8.841; 9.053; 8.63 90; 90; 90 | 690.7 | Chmielewski, Marcin K.; Tykarska, Ewa; Markiewicz, Wojciech T.; Rypniewski, Wojciech Engineering N-(2-pyridyl)aminoethyl alcohols as potential precursors of thermolabile protecting groups New Journal of Chemistry, 2012, 36, 603 |
| 7060312 | CIF | C13 H15 N3 O3 S | P -1 | 5.7508; 8.5166; 14.7464 84.878; 85.115; 74.344 | 691.26 | Surov, Artem O.; Voronin, Alexander P.; Vasilev, Nikita A.; Ilyukhin, Andrey B.; Perlovich, German L. Novel cocrystals of the potent 1,2,4-thiadiazole-based neuroprotector with carboxylic acids: virtual screening, crystal structures and solubility performance New Journal of Chemistry, 2021, 45, 3034-3047 |
| 7055487 | CIF | C20 H38 Cl2 N8 O8 | P -1 | 8.919; 9.336; 9.741 65.97; 89.173; 70.563 | 691.66 | Pitarch-Jarque, Javier; Belda, Raquel; Blasco, Salvador; Navarro, Pilar; Tejero, Roberto; Junquera-Hernández, José Miguel; Pérez-Mondéjar, Vicente; García-España, Enrique A water molecule in the interior of a 1H-pyrazole Cu2+metallocage New J. Chem., 2016, 40, 5670 |
| 7052859 | CIF | C14 H13 Au Cl N3 | P -1 | 7.5072; 9.1676; 10.705 79.845; 84.056; 72.958 | 692.3 | Adhikary, Sirsendu Das; Bose, Dipayan; Mitra, Partha; Saha, Krishna Das; Bertolasi, Valerio; Dinda, Joydev Au(i)- and Pt(ii)-N-heterocyclic carbene complexes with picoline functionalized benzimidazolin-2-ylidene ligands; synthesis, structures, electrochemistry and cytotoxicity studies New Journal of Chemistry, 2012, 36, 759 |
| 7055923 | CIF | H4 Ni O8 V2 | P n m a | 5.536; 10.628; 11.77 90; 90; 90 | 692.5 | Li, Ning; Zhang, Zhong; Liu, Yiwei; Lu, Ying; He, Danfeng; Xu, Li; Zhong, Xiahua; Liu, Shuxia Magnetic and luminescence properties of an inorganic 3D nickel‒vanadium bimetallic framework New J. Chem., 2017, 41, 1245 |
| 7056980 | CIF | C22 H28 F12 N6 P2 | P -1 | 9.0425; 9.3574; 9.7188 63.038; 85.745; 71.462 | 692.5 | Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands New Journal of Chemistry, 2018, 42, 4700 |
| 7062686 | CIF | C16 H16 O2 S | P 1 21 1 | 10.367; 5.5115; 12.1835 90; 95.746; 90 | 692.64 | Blé-González, Ever A.; Isbel, Stephen R.; Ojo, Olatunji S.; Hillesheim, Patrick C.; Zeller, Matthias; Bugarin, Alejandro Regiodivergent sulfonylation of terminal olefins via dearomative rearrangement New Journal of Chemistry, 2023, 47, 17020-17025 |
| 7060791 | CIF | C11 H11 Cl2 N3 Se Zn | P -1 | 7.6875; 7.775; 12.7025 98.029; 91.212; 112.392 | 692.81 | Cervo, Rodrigo; Lopes, Thaísa R. R.; de Vasconcelos, Adriana R.; Cargnelutti, Juliana F.; Schumacher, Ricardo F.; Tirloni, Bárbara; dos Santos, Sailer S.; Abram, Ulrich; Lang, Ernesto S.; Cargnelutti, Roberta Coordination compounds containing 2-pyridylselenium ligands: synthesis, structural characterization, and antibacterial evaluation New Journal of Chemistry, 2021, 45, 12863-12870 |
| 7053852 | CIF | C6 H7 N3 O3 | P 1 21/c 1 | 9.0878; 11.2798; 6.7696 90; 92.969; 90 | 693.01 | Kopylovich, Maximilian N.; Mahmudov, Kamran T.; Haukka, Matti; Pombeiro, Armando J. L. Metal-free regioselective C‒C bond cleavage in 1,3,5-triazine derivatives of β-diketones New Journal of Chemistry, 2014, 38, 495 |
| 7055304 | CIF | C22 H38 N4 S4 Tl2 | P -1 | 6.2864; 6.4124; 17.4 91.512; 95.518; 96.508 | 693.2 | Ramalingam, Kuppukkannu; Rizzoli, Corrado; Sivagurunathan, Gurunathan Senthilkumar Mono and trivalent thallium‒sulfur interactions and their influence on the formation of nano thallium sulphide: single crystal X-ray structural and spectral studies on thallium(i)/(iii)‒cyclohexylpiperazine dithiocarbamates New J. Chem., 2016, 40, 2489 |
| 7061086 | CIF | C13 H12 Cl F2 N O Pt S | P -1 | 7.115; 10.484; 10.9 63.89; 72.81; 77.2 | 693.5 | Shahsavari, Hamid R.; Paziresh, Sareh The impact of cyclometalated and phosphine ligands on the luminescence properties of cycloplatinated(ii) complexes: photophysical and theoretical investigations New Journal of Chemistry, 2021, 45, 22732-22740 |
| 7060788 | CIF | C11 H11 Cl2 Co N3 Se | P -1 | 7.691; 7.7691; 12.7167 97.994; 91.522; 112.289 | 693.63 | Cervo, Rodrigo; Lopes, Thaísa R. R.; de Vasconcelos, Adriana R.; Cargnelutti, Juliana F.; Schumacher, Ricardo F.; Tirloni, Bárbara; dos Santos, Sailer S.; Abram, Ulrich; Lang, Ernesto S.; Cargnelutti, Roberta Coordination compounds containing 2-pyridylselenium ligands: synthesis, structural characterization, and antibacterial evaluation New Journal of Chemistry, 2021, 45, 12863-12870 |
| 7050260 | CIF | C10 H30 Cl2 Cu2 N12 O8 | P -1 | 8.524; 8.78; 11.32 71.79; 68.88; 63.2 | 693.9 | Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour New J. Chem., 2004, 28, 681-686 |
| 7058669 | CIF | C17 H12 O2 Se | P -1 | 7.9308; 7.9752; 12.3077 89.175; 73.899; 68.845 | 694.32 | Jardim, Guilherme A. M.; Bozzi, Ícaro A. O.; Oliveira, Willian X. C.; Mesquita-Rodrigues, Camila; Menna-Barreto, Rubem F. S.; Kumar, Ramar A.; Gravel, Edmond; Doris, Eric; Braga, Antonio L.; da Silva Júnior, Eufrânio N. Copper complexes and carbon nanotube‒copper ferrite-catalyzed benzenoid A-ring selenation of quinones: an efficient method for the synthesis of trypanocidal agents New Journal of Chemistry, 2019, 43, 13751 |
| 7054649 | CIF | C30 H38 N6 O4 | P -1 | 5.6047; 6.8589; 18.879 97.644; 91.164; 104.659 | 694.78 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7056284 | CIF | C13 H7 F3 N4 O6 | P -1 | 8.0718; 8.2115; 11.4425 76.477; 82.582; 70.713 | 694.9 | GAUR, PINKI; Bhaskar Yamjala, Kanka Durga; Banerjee, Shaibal Efficient Synthetic route to Aromatic Secondary Amines via Pd/RuPhos/TBAB Catalyzed Cross Coupling New J. Chem., 2017 |
| 7058901 | CIF | C8 H17 Gd O14 | P 1 2/n 1 | 10.0354; 5.9271; 11.7386 90; 95.511; 90 | 695 | Zheng, Teng-Fei; Tian, Xue-Mei; Wu, Lin-Hui; Liu, Sui-Jun; Yao, Shu-Li; He, Kun-Huan; Huang, Hai-Ping; Liao, Jinsheng; Chen, Jing-Lin; Wen, He-Rui Two GdIII complexes with different structures and magnetocaloric properties induced by metal ion sources New Journal of Chemistry, 2019 |
| 7051052 | CIF | C12 H15 N5 O5 | P -1 | 8.181; 12.891; 7.758 104.73; 116.1; 73.34 | 696 | New Journal of Chemistry, 2001 |
| 7059735 | CIF | C17 H10 Cl N3 O2 | P -1 | 6.096; 7.6004; 15.3686 85.08; 87.562; 78.958 | 696.05 | He, Xinwei; Li, Ruxue; Xie, Mengqing; Duan, Jiahui; Tang, Qiang; Shang, Yongjia Copper-catalyzed cascade three-component azide‒alkyne cycloaddition/condensation/transesterification: easy access to 3-triazolylcoumarins New Journal of Chemistry, 2020, 44, 12266-12273 |
| 7057140 | CIF | C18 H18 N2 O | P -1 | 6.0722; 8.3073; 14.1215 98.482; 96.914; 94.487 | 696.07 | Brink, Alice; Kroon, Robin E.; Visser, Hendrik G.; van Rensburg, Constance E. J.; Roodt, Andreas Designing model imino bifunctional chelators for radiopharmaceuticals ‒ in vitro antitumor activity, photoluminescence and structural analysis New Journal of Chemistry, 2018, 42, 5193 |
| 7051342 | CIF | C4 H12 Br N2 | P 1 21/c 1 | 5.9645; 12.573; 9.4371 90; 100.24; 90 | 696.4 | New Journal of Chemistry, 2000 |
| 7057156 | CIF | C11 H8 Br Cl I N Se | P -1 | 7.8181; 9.764; 10.419 104.07; 107.51; 103 | 696.5 | Montis, Riccardo; Arca, Massimiliano; Aragoni, M. Carla; Blake, Alexander J.; Castellano, Carlo; Demartin, Francesco; Isaia, Francesco; Lippolis, Vito; Pintus, Anna; Lenardão, Eder J.; Perin, Gelson; O'Connor, Alice E.; Thurow, Samuel Structural diversity in the products formed by the reactions of 2-arylselanyl pyridine derivatives and dihalogens New Journal of Chemistry, 2018, 42, 10592 |
| 7056206 | CIF | C20 H26 Cl4 F2 N8 P4 | P -1 | 8.5886; 9.2505; 9.5924 75.382; 71.148; 87.868 | 697.06 | Elmas, Gamze; Okumuş, Aytuğ; Sevinç, Pelin; Kılıç, Zeynel; Açık, Leyla; Atalan, Mustafa; Turk, Mustafa; Deniz, Gökberk; Hökelek, Tuncer Phosphorus-nitrogen compounds. Part 37. Syntheses and structural characterizations, biological activities of mono and bis(4-fluorobenzyl)spirocyclotetraphosphazenes New J. Chem., 2017 |
| 7054741 | CIF | C12 H11 N2 O8 V | P 1 21/m 1 | 7.8481; 6.421; 13.8887 90; 95.055; 90 | 697.17 | Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives New J. Chem., 2015, 39, 4265 |
| 7057901 | CIF | C32 H28 Cl2 Cu N4 O2 | P -1 | 8.905; 9.2277; 9.8071 74.79; 65.4; 76.151 | 699.24 | Smirnov, Andrey S.; Martins, Luísa M. D. R. S.; Nikolaev, Dmitriy N.; Manzhos, Roman A.; Gurzhiy, Vlad V.; Krivenko, Alexander G.; Nikolaenko, Kirill O.; Belyakov, Alexander V.; Garabadzhiu, Alexander V.; Davidovich, Pavel B. Structure and catalytic properties of novel copper isatin Schiff base complexes New Journal of Chemistry, 2019, 43, 188 |
| 7057345 | CIF | C6 Cl2 F12 O4 S2 | P 1 21/c 1 | 5.3148; 24.007; 5.8975 90; 111.669; 90 | 699.3 | Liu, Xiaolin; McMillen, Colin D.; Thrasher, Joseph S. Cooperative intermolecular S‒Cl⋯O and F⋯F associations in the crystal packing of α,ω-di(sulfonyl chloride) perfluoroalkanes, ClSO2(CF2)nSO2Cl, where n = 4, 6 New Journal of Chemistry, 2018, 42, 10484 |
| 7061615 | CIF | C16 H22 N18 O10 | P 1 21/m 1 | 9.1828; 6.5037; 11.7685 90; 95.504; 90 | 699.6 | Hu, Yong; Lu, Zu-Jia; Dong, Wen-Shuai; Zhang, Jian-Guo; Sinditskii, Valery P. Detonation performance enhancement through a positional isomerism modification strategy New Journal of Chemistry, 2022, 46, 13874-13879 |
| 7053473 | CIF | C24 H32 Cu N8 O4 S2 | P -1 | 7.474; 9.371; 10.441 80.422; 89.867; 76.38 | 700.3 | Rajput, Lalit; Biradha, Kumar Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion New Journal of Chemistry, 2010, 34, 2415 |
| 7052612 | CIF | C28 H34 N2 O10 Zn2 | P -1 | 6.2142; 9.4307; 12.213 81.975; 82.195; 85.397 | 700.8 | Lee, Yu Jin; Kim, Eun Young; Kim, Soo Hyun; Jang, Seung Pyo; Lee, Tae Geum; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee Synthesis, crystal structures, photoluminescence, and catalytic reactivity of novel coordination polymers (0-D, 1-D, 2-D to 3-D) constructed from cis-1,2-cyclohexanedicarboxylic acid and various bipyridyl ligands New Journal of Chemistry, 2011, 35, 833 |
| 7053683 | CIF | As F10 H2 Tl | P 1 21/c 1 | 5.5533; 5.7652; 21.9287 90; 93.279; 90 | 700.92 | Mazej, Zoran; Goreshnik, Evgeny Fluoride ion donor properties of group 13 trifluorides (MF3, M = Al, Ga, In, Tl) and crystal structures of InF3·3SbF5, TlF3·3SbF5 and TlF3·AsF5·2HF New Journal of Chemistry, 2010, 34, 2806 |
| 7050610 | CIF | C24 H42 As2 Cl2 Pt | P -1 | 8.6461; 9.4107; 9.532 108.19; 102.878; 97.604 | 701 | Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures New Journal of Chemistry, 2003, 27, 1584 |
| 7052934 | CIF | C13 H18 N2 O3 | P -1 | 6.9587; 9.0375; 12.3302 68.763; 76.211; 82.636 | 701.2 | Lemmerer, Andreas; Fernandes, Manuel A. Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide New Journal of Chemistry, 2012, 36, 2242 |
| 7050795 | CIF | C5 H11 B F N O2 | C m c 21 | 9.8; 12.045; 5.9433 90; 90; 90 | 701.6 | Aldridge, Simon; Calder, Richard J.; Coombs, Deborah L.; Jones, Cameron; Steed, Jonathan W.; Coles, Simon; Hursthouse, Michael B. Intramolecular base-stabilised adducts of main group halides New Journal of Chemistry, 2002, 26, 677 |
| 7053876 | CIF | C12 H9 Au Cl3 N3 | P -1 | 7.8238; 9.795; 10.093 112.116; 95.677; 97.329 | 701.6 | Dinda, Joydev; Samanta, Tapastaru; Nandy, Abhishek; Saha, Krishna Das; Seth, Saikat Kumar; Chattopadhyay, Shymal Kumar; Bielawski, Christopher W. N-heterocyclic carbene supported Au(i) and Au(iii) complexes: a comparison of cytotoxicities New Journal of Chemistry, 2014, 38, 1218 |
| 7056389 | CIF | C13 H18 N2 O5 | P -1 | 7.7375; 8.0667; 12.449 86.51; 88.96; 64.82 | 701.9 | Kulikov, Oleg V.; Sevryugina, Yulia V.; Mehmood, Arshad; Saraogi, Ishu Characterization of aggregated morphologies derived from mono- and bis-arylbenzamides ‒ potential alpha-helix mimetics New J. Chem., 2017 |
| 7058276 | CIF | C13 H14 N2 O7 | P -1 | 8.38; 9.417; 9.554 87.314; 69.762; 83.089 | 702.3 | Liu, Jin-jian; Li, Jing; Zhao, Guo-zheng Photochromism of supramolecular assemblies based on benzenecarboxylate donors and viologen acceptors New Journal of Chemistry, 2019, 43, 6607 |
| 7054245 | CIF | C28 H26 Cu2 N6 O8 | P -1 | 8.2841; 8.9822; 9.6248 86.725; 82.846; 81.578 | 702.39 | Jena, Himanshu Sekhar Effect of non-covalent interaction on the diastereoselective self-assembly of Cu(ii) complexes containing a racemic Schiff base in a chiral self-discriminating process New Journal of Chemistry, 2014, 38, 2486 |
| 7062440 | CIF | C28 H16 Fe N12 O2 Pt | P -1 | 7.0488; 7.5849; 13.336 99.682; 92.062; 90.229 | 702.4 | Feng, Zhe; Ling, Jie-Jie; Song, Huijie; Zhu, Dunru Modulation of the spin transition in 2D Hofmann frameworks via π⋯π stacking between the axial 2,5-dipyridyl-1,3,4-oxadiazoles New Journal of Chemistry, 2023, 47, 10162-10168 |
| 7051272 | CIF | C16 H16 B Fe P | P -1 | 7.4376; 8.9729; 11.9365 73.754; 83.435; 66.728 | 702.56 | Evans, Chris E. B.; Lough, Alan J.; Grondey, Hiltrud; Manners, Ian Synthesis, structure and polymerization behaviour of borane adducts of a phosphorus-bridged [1]ferrocenophane, [(η-C5H4)2FePPh] New Journal of Chemistry, 2000, 24, 447 |
| 7059603 | CIF | C3 H3 N5 O5 | P 21 21 21 | 6.4603; 10.1472; 10.7225 90; 90; 90 | 702.9 | Yang, Rui; Dong, Zhen; Ye, Zhiwen Exploration of low-melting energetic compounds: influence of substituents on melting points New Journal of Chemistry, 2020, 44, 13576-13583 |
| 7051168 | CIF | C16 H20 N2 | P 1 21/c 1 | 7.0406; 14.7756; 6.9714 90; 104.185; 90 | 703.12 | Yu-Lin Lam; Ming Wah Wong; Hsing Hua Huang; Eping Liang Conformational Analysis of Meso- and (±)- 2,3-Dicyano-2,3-Dicyclopropylbutane and 1,2-Dicyanotetracyclopropylethane New Journal of Chemistry, 2001 |
| 7053049 | CIF | C6 H10 N2 O2 | P 1 21/n 1 | 5.7744; 15.2403; 7.9988 90; 92.736; 90 | 703.12 | Belmar, Julio; Quezada, José; Jiménez, Claudio A.; Díaz-Gallifa, Pau; Pasán, Jorge; Ruiz-Pérez, Catalina Synthesis, crystal structures and tautomerism in novel oximes based on hydroxyalkylpyrazolones New Journal of Chemistry, 2013, 37, 2002 |
| 7055196 | CIF | C12 H10 N4 O9 Zn | P -1 | 7.7271; 9.6737; 10.9425 69.74; 87.236; 67.112 | 703.38 | Karmakar, Anirban; Paul, Anup; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. pH dependent synthesis of Zn(ii) and Cd(ii) coordination polymers with dicarboxyl-functionalized arylhydrazone of barbituric acid: photoluminescence properties and catalysts for Knoevenagel condensation New J. Chem., 2016, 40, 1535 |
| 7062831 | CIF | C6 H5 N3 O S | P 21 21 21 | 5.4688; 6.1708; 20.871 90; 90; 90 | 704.33 | Sheremetev, Aleksei B.; Kozeev, Andrei S.; Palysaeva, Nadezhda V.; Suponitsky, Kyrill Yu. A mild and efficient synthesis of aminofurazans New Journal of Chemistry, 2023, 47, 21091-21097 |
| 7057979 | CIF | C11 H12 Cu F3 N3 O3 | P -1 | 6.409; 7.792; 14.448 100.724; 94.544; 91.601 | 706 | Cen, Peipei; Yuan, Weize; Luo, Shuchang; Liu, Xiangyu; Xie, Gang; Chen, Sanping Solvent coligands fine-tuned the structures and magnetic properties of triple-bridged 1D azido-copper(ii) coordination polymers New Journal of Chemistry, 2019, 43, 601 |
| 7062442 | CIF | C28 H16 Fe N12 O2 Pd | P -1 | 7.036; 7.641; 13.358 100.392; 91.265; 90.145 | 706.2 | Feng, Zhe; Ling, Jie-Jie; Song, Huijie; Zhu, Dunru Modulation of the spin transition in 2D Hofmann frameworks via π⋯π stacking between the axial 2,5-dipyridyl-1,3,4-oxadiazoles New Journal of Chemistry, 2023, 47, 10162-10168 |
| 7050362 | CIF | C17 H15 N O2 | P -1 | 7.574; 8.315; 12.782 84.56; 79.32; 63.27 | 706.44 | J. Narasimha Moorthy; R.Natarajan; Prasenjit Mal; P.Venugopalan First example of a helical nanotube sustained by weak C-H∙∙∙O/N hydrogen bonds: Remarkable self-assembly of an o-anisaldehyde New J.Chem.(Nouv.J.Chim.), 2004 |
| 7053285 | CIF | C3 H3 Cs N2 O3 S | P 1 21/c 1 | 8.8211; 8.1086; 9.8888 90; 91.56; 90 | 707.05 | Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion New Journal of Chemistry, 2010, 34, 221 |
| 7057593 | CIF | C12 H20 F N3 O3 | P -1 | 5.2617; 8.7066; 15.71 81.892; 85.884; 84.46 | 707.94 | Souza, Matheus S.; Diniz, Luan F.; Vogt, Lautaro; Carvalho, Paulo S.; D’vries, Richard F.; Ellena, Javier Avoiding irreversible 5-fluorocytosine hydration via supramolecular synthesis of pharmaceutical cocrystals New Journal of Chemistry, 2018, 42, 14994 |
| 7060210 | CIF | C18 H12 S2 | P 1 21/c 1 | 8.6466; 7.0684; 11.6275 90; 94.936; 90 | 708.01 | Li, Meijing; Zhang, Xinxin; Zhen, Shijie; Xu, Jingkun Multichannel transport in conjugated polymers based on through-space conjugated naphthalene New Journal of Chemistry, 2021, 45, 1795-1799 |
| 7059971 | CIF | C19 H14 N2 O | P 1 21 1 | 8.8495; 5.0583; 16.2521 90; 102.686; 90 | 709.74 | Younes, Eyad A.; Hussein, Nour; Shtaiwi, Majed; Shahrokhi, Farshid; Abu Safieh, Kayed A.; Zhao, Yuming N-(Cyano(naphthalen-1-yl)methyl)benzamides: synthesis, crystal structures, and colorimetric sensing of fluoride anions New Journal of Chemistry, 2020, 44, 16546-16556 |
| 7053214 | CIF | C14 H6 Br2 S4 | P 1 21/c 1 | 3.9007; 11.814; 15.453 90; 94.644; 90 | 709.8 | Liu, Ying; Liu, Qida; Zhang, Xingye; Ai, Ling; Wang, Yang; Peng, Ruixiang; Ge, Ziyi Synthesis, crystal structure, and polymerization of butterfly-shaped thieno[3,2-b]thiophene oligomers New Journal of Chemistry, 2013, 37, 1189 |
| 7054309 | CIF | C10 H15 Cu N O9 | P -1 | 7.558; 9.2626; 10.536 104.104; 90.218; 96.517 | 710.35 | Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. Synthesis, structure and catalytic applications of amidoterephthalate copper complexes in the diastereoselective Henry reaction in aqueous medium New J. Chem., 2014, 38, 4837 |
| 7061227 | CIF | C16 H6 F4 N2 S2 | P -1 | 3.8831; 11.9865; 15.5339 83.534; 83.375; 84.296 | 710.89 | Costa, Letícia D.; Guieu, Samuel; Faustino, Maria do Amparo F.; Tomé, Augusto C. Straightforward synthesis of thiazolo[5,4-c]isoquinolines from dithiooxamide and 2-halobenzaldehydes New Journal of Chemistry, 2022, 46, 3602-3615 |
| 7060938 | CIF | C8 H9 Au2 Cl3 N4 S | P 1 21 1 | 7.0766; 12.4355; 8.0835 90; 90.355; 90 | 711.34 | Mageed, Ahmed Hassoon; Al-Ameed, Karrar Synthesis, structures, and DFT analysis of gold complexes containing a thiosemicarbazone ligand New Journal of Chemistry, 2021, 45, 18433-18442 |
| 7056142 | CIF | C32 H28 Cu N4 O8 | P -1 | 6.42; 8.6707; 12.9072 85.11; 88.215; 83.692 | 711.37 | Wang, Hua-Hua; Wen, Wei-Hong; Zou, Huai-Bo; Cheng, Fan; Ali, Atif; Shi, Lei; Liu, Hai-Yang; Chang, Chi-Kwong Copper porphyrin catalyzed esterification of C(sp3)‒H via a cross-dehydrogenative coupling reaction New J. Chem., 2017, 41, 3508 |
| 7057179 | CIF | C5 H5 N5 O2 | P -1 | 7.0876; 9.8869; 11.4194 89.761; 73.244; 69.093 | 711.41 | Beliaev, Nikolai A.; Shafikov, Marsel Z.; Efimov, Ilya V.; Beryozkina, Tetyana V.; Lubec, Gert; Dehaen, Wim; Bakulev, Vasiliy A. Design and synthesis of imidazoles linearly connected to carbocyclic and heterocyclic ringsviaa 1,2,3-triazole linker. Reactivity of β-azolyl enamines towards heteroaromatic azides New Journal of Chemistry, 2018, 42, 7049 |
| 7052914 | CIF | C26 H28 Cu2 N4 O12 | P -1 | 9.1371; 9.2116; 10.2632 63.521; 68.961; 72.657 | 711.7 | Kopylovich, Maximilian N.; Gajewska, Malgorzata J.; Mahmudov, Kamran T.; Kirillova, Marina V.; Figiel, Paweł J.; Guedes da Silva, M. Fátima C.; Gil-Hernández, Beatriz; Sanchiz, Joaquin; Pombeiro, Armando J. L. Copper(ii) complexes with a new carboxylic-functionalized arylhydrazone of β-diketone as effective catalysts for acid-free oxidations New Journal of Chemistry, 2012, 36, 1646 |
| 7057048 | CIF | C12 H9 N5 O8 | P -1 | 3.8305; 13.112; 14.5122 80.38; 82.576; 86.434 | 711.99 | Tarai, Arup; Baruah, Jubaraj B. Different self-assemblies and absorption‒emission properties of the picrate salts of aromatic amine or heterocycle linked oximes New Journal of Chemistry, 2018, 42, 4757 |
| 7059264 | CIF | C14 H14 B I O4 | P -1 | 7.4048; 9.6801; 10.5728 101.675; 90.6702; 105.763 | 712.47 | Al-Zoubi, Raed M.; Al-Jammal, Walid K.; McDonald, Robert Regioselective synthesis of ortho-iodobiphenylboronic acid derivatives: a superior catalyst for carboxylic acid activation New Journal of Chemistry, 2020, 44, 3612-3623 |
| 7056027 | CIF | C12 H18 Cu N4 O4 | P -1 | 7.7557; 10.0442; 10.1321 78.38; 78.554; 68.519 | 712.65 | Noshiranzadeh, Nader; Emami, Marzieh; Bikas, Rahman; Kozakiewicz, Anna Green click synthesis of β-hydroxy-1,2,3-triazoles in water in the presence of a Cu(ii)‒azide catalyst: a new function for Cu(ii)‒azide complexes New J. Chem., 2017, 41, 2658 |
| 7055517 | CIF | C6 H11 N9 O10 | P 1 21 1 | 10.828; 5.5849; 12.363 90; 107.59; 90 | 712.7 | Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines New J. Chem., 2016, 40, 6059 |
| 7062467 | CIF | C10 H14 N12 Ni | P 1 21/c 1 | 12.2955; 4.9045; 13.1699 90; 116.167; 90 | 712.79 | Mahmudov, Ibadulla; Gurbanov, Atash V.; Martins, Luísa M. D. R. S.; Abdullayev, Yusif; Sujayev, Afsun; Mahmudov, Kamran T.; Pombeiro, Armando J. L. Co(ii/iii), Ni(ii) and Cu(ii) complexes with a pyrazole-functionalized 1,3,5-triazopentadiene: synthesis, structure and application in the oxidation of styrene to benzaldehyde New Journal of Chemistry, 2023, 47, 10826-10833 |
| 7063070 | CIF | C20 H16 N2 O | P -1 | 5.6923; 11.2384; 11.8487 109.053; 93.53; 92.661 | 713.32 | Chen, Yanqi; Hao, Subin; Yin, Lingfeng; Song, Xinluo; Liu, Zhiyao; Li, Mingde; Dang, Li Metal-free cascade reactions for one-pot tetrahydroquinoxaline construction through nitroarene reduction and imine hydrogenation with water New Journal of Chemistry, 2024, 48, 6103-6108 |
| 7062849 | CIF | C18 H14 Mo O2 | P 1 21 1 | 8.1572; 6.9602; 12.5929 90; 93.328; 90 | 713.77 | Štěpán, Jiří; Vinklárek, Jaromír; Císařová, Ivana; Dostál, Libor; Honzíček, Jan Benz[e]indenyl and benz[f]indenyl molybdenum compounds: evidence of the η3-coordination mode New Journal of Chemistry, 2023, 47, 21396-21403 |
| 7050609 | CIF | C24 H42 As2 Br2 Pd | P -1 | 8.8295; 9.4059; 9.5258 108.471; 103.331; 96.937 | 713.9 | Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures New Journal of Chemistry, 2003, 27, 1584 |
| 7061622 | CIF | C10 H16 Cl2 N4 Pt | P 1 21/c 1 | 6.584; 8.8961; 12.5131 90; 102.895; 90 | 714.43 | Rivera, Carolina; Bacilio-Beltrán, Héctor Alejandro; Puebla-Pérez, Ana Maria; Rangel-Salas, Irma Idalia; Alvarado–Rodríguez, José G; Flores-Moreno, Roberto; Velázquez- Juárez, Gilberto; Peregrina-Lucano, Alejandro Aarón; Becerra-Martinez, Elvia; Valdez-Ruvalcaba, Jaime; Rubio-Garcia, J. Emiliano; Cortes-Llamas, Sara Angelica Cis and trans platinum(II) N-heterocyclic carbene isomers: synthesis, characterization and biological activity New Journal of Chemistry, 2022 |
| 7054312 | CIF | C11 H17 Cu N O9 | P -1 | 7.4875; 9.4303; 10.4406 78.225; 84.542; 83.261 | 714.78 | Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. Synthesis, structure and catalytic applications of amidoterephthalate copper complexes in the diastereoselective Henry reaction in aqueous medium New J. Chem., 2014, 38, 4837 |
| 7055858 | CIF | C20 H20 Cu2 N6 O11 | P -1 | 7.0667; 9.232; 11.548 95.15; 95.809; 105.873 | 715.5 | Cheng, Meiling; Sun, Lin; Han, Wei; Wang, Shen; Liu, Qi; Sun, Xiaoqiang; Xi, Haitao Effect of N ancillary ligands on the structure, nuclearity and magnetic behavior of Cu(ii)‒pyrazolecarboxylate complexes New J. Chem., 2016, 40, 10504 |
| 7060939 | CIF | C9 H14 Au Cl2 N4 O S | P -1 | 7.3584; 7.8336; 12.6006 99.299; 90.361; 92.429 | 716.08 | Mageed, Ahmed Hassoon; Al-Ameed, Karrar Synthesis, structures, and DFT analysis of gold complexes containing a thiosemicarbazone ligand New Journal of Chemistry, 2021, 45, 18433-18442 |
| 7061560 | CIF | C19 H14 N | P m n 21 | 14.1719; 8.9226; 5.6638 90; 90; 90 | 716.19 | Zhang, Fang; An, Yi; Liu, Jichang; Du, Guangfen; Cai, Zhihua; He, Lin Assembly of unsymmetrical 1,3,5-triarylbenzenes via tandem reaction of β-arylethenesulfonyl fluorides and α-cyano-β-methylenones New Journal of Chemistry, 2022, 46, 12367-12371 |
| 7055197 | CIF | C12 H10 Cd N4 O9 | P -1 | 7.8701; 10.0231; 10.5151 107.894; 91.326; 113.088 | 716.27 | Karmakar, Anirban; Paul, Anup; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. pH dependent synthesis of Zn(ii) and Cd(ii) coordination polymers with dicarboxyl-functionalized arylhydrazone of barbituric acid: photoluminescence properties and catalysts for Knoevenagel condensation New J. Chem., 2016, 40, 1535 |
| 7060472 | CIF | C16 H14 Cl N O4 | P 1 21 1 | 4.2178; 16.5839; 10.27 90; 93.821; 90 | 716.76 | Kukkonen, Esa; Lahtinen, Elmeri; Myllyperkiö, Pasi; Haukka, Matti; Konu, Jari Nonlinear optical properties of diaromatic stilbene, butadiene and thiophene derivatives New Journal of Chemistry, 2021, 45, 6640-6650 |
| 7051961 | CIF | C10 H24 Cl Ga N2 O2 | P -1 | 7.7913; 7.9556; 12.052 99.069; 93.211; 102.462 | 717.2 | Basharat, Siama; Knapp, Caroline E.; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A. Synthesis and structures of gallium alkoxides New Journal of Chemistry, 2008, 32, 1513 |
| 7055144 | CIF | C16 H14 Mo O4 | P -1 | 7.8969; 9.4631; 9.992 74.851; 89.546; 84.803 | 717.69 | Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan Novel indenyl ligands bearing electron-withdrawing functional groups New J. Chem., 2016, 40, 245 |
| 7056925 | CIF | C10 H14 Cu N2 O7 S2 | P -1 | 7.2021; 9.469; 11.699 66.533; 80.57; 81.58 | 719 | Thakur, Neha; Pandey, Mrituanjay D.; Pandey, Rampal A uniquely fabricated Cu(ii)-metallacycle as a reusable highly sensitive dual-channel and practically functional metalloreceptor for Fe3+ and Ca2+ ions: an inorganic site of cation detection New Journal of Chemistry, 2018, 42, 3582 |
| 7050146 | CIF | C6 H12 O2 | P 1 21/c 1 | 15.018; 5.0236; 9.9426 90; 106.549; 90 | 719.04 | Bond, Andrew D. On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/ New Journal of Chemistry, 2004, 28, 104 |
| 7054655 | CIF | C30 H38 N6 O4 | P -1 | 5.2955; 7.8185; 18.424 85.042; 83.543; 71.912 | 719.4 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7057627 | CIF | C13 H F4 N O5 Pb | P -1 | 7.722; 8.4029; 12.016 93.629; 103.75; 106.323 | 719.7 | Ma, Jing-xin; Yang, Zhihua; Zhou, Tong; Guo, Qi; Yang, Jinhui; Yang, Tianlin; Yang, Qingfeng Construction of structurally diverse luminescent lead(ii) fluorinated coordination polymers based on auxiliary ligands New Journal of Chemistry, 2018, 42, 15413 |
| 7059131 | CIF | C16 H16 N4 O | P -1 | 7.8537; 10.0186; 10.4353 73.18; 70.237; 72.218 | 719.76 | Huang, Ying; Min, Wei; Wu, Qiu-Wen; Sun, Jing; Shi, Da-Hua; Yan, Chao-Guo Facile one-pot synthesis of spirooxindole-pyrrolidine derivatives and their antimicrobial and acetylcholinesterase inhibitory activities New Journal of Chemistry, 2018, 42, 16211 |
| 7061951 | CIF | C16 H14 N2 O2 S | P -1 | 7.7462; 9.2543; 10.7494 106.819; 100.376; 93.807 | 719.78 | Zhao, Lan; Xu, Jun; Ma, Jun; Yin, Guangwei; Li, Fangyi; Suo, Tongchuan; Wang, Chunhua Formal [4+1] cyclization of (thio/imido)hydrazides and ethyl 3,3,3-trifluoropropanoate: unified synthesis of 1,3,4-oxadiazoles, 1,3,4-thiadiazoles and 1,2,4-triazoles New Journal of Chemistry, 2022, 46, 20755-20759 |
| 7057874 | CIF | C4 H5 N5 O4 | P 1 21/n 1 | 8.6418; 4.985; 17.235 90; 104.095; 90 | 720.12 | Wang, Bohan; Xiong, Hualin; Cheng, Guangbin; Zhang, Zaichao; Yang, Hongwei An unexpected method to synthesise 1,2,4-oxadiazolone derivatives: a class of insensitive energetic materials New Journal of Chemistry, 2018, 42, 19671 |
| 7053656 | CIF | C26 H20 Eu2 N4 O18 | P -1 | 8.327; 9.7525; 9.9181 101.562; 108.428; 100.982 | 720.2 | Zhang, Lijuan; Xu, Donghua; Zhou, Yunshan; Jiang, Fei Design of 3-D europium(iii)‒organic frameworks based on pyridine carboxylate N-oxide and acyclic binary carboxylate: syntheses, structures, and luminescence properties New Journal of Chemistry, 2010, 34, 2470 |
| 7056038 | CIF | C32 H18 N8 O12 U | P -1 | 7.3139; 9.6308; 11.2039 73.572; 78.457; 73.711 | 720.31 | Li, Shuang; Sun, Li Xian; Ni, Jue Chen; Shi, Zhan; Xing, Yong Heng; Shang, Di; Bai, Feng Ying Two uranyl heterocyclic carboxyl compounds with fluorescent properties as high sensitivity and selectivity optical detectors for nitroaromatics New J. Chem., 2017, 41, 3073 |
| 7060603 | CIF | C3 H7 N7 O2 | C 1 c 1 | 4.0295; 12.201; 14.678 90; 91.823; 90 | 721.3 | Chen, Xiang; Guo, Zhaoqi; Zhang, Cong; Zhang, Jianguo; Ma, Haixia Boosting intermolecular interactions of fused cyclic explosives: the way to thermostable and insensitive energetic materials with high density New Journal of Chemistry, 2021, 45, 9358-9367 |
| 7057186 | CIF | C15 H7 F3 N2 O S | P -1 | 7.9423; 8.3974; 11.4457 99.623; 101.966; 98.974 | 721.75 | Günsel, Armağan; Bilgiçli, Ahmet T.; Pişkin, Hasan; Çaylak Delibaş, Nagihan; Yarasir, M. Nilüfer; Gündüz, Bayram Synthesis, characterization, and optical and surface properties of (4-(trifluoromethylthio)phenoxy) copper(ii) phthalocyanine New Journal of Chemistry, 2018, 42, 6013 |
| 7052973 | CIF | C8 N2 O12 | P 1 21 1 | 12.5711; 11.2144; 5.2079 90; 100.529; 90 | 721.83 | Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid New Journal of Chemistry, 2013, 37, 97 |
| 7050249 | CIF | C4 H10 N2 O2 | P n m a | 10.0507; 9.2132; 7.7953 90; 90; 90 | 721.84 | Ferretti, Valeria; Bertolasi, Valerio; Pretto, Loretta Supramolecular aggregation by means of charge-assisted hydrogen bonds in acid-base adducts containing amidinium cations New Journal of Chemistry, 2004, 28, 646 |
| 7058778 | CIF | C3 H6 F2 N4 O4 | P c c n | 6.042; 9; 13.277 90; 90; 90 | 722 | Chen, Jifeng; Yu, Yi; Zhang, Shujuan; Li, Yuchuan; Pang, Siping Energetic materials with fluorinated four-membered heterocyclic ring: 3,3′-difluoroazetidine (DFAZ) salts New Journal of Chemistry, 2019, 43, 15115 |
| 7050196 | CIF | C12 H12 Br2 O6 | P -1 | 8.694; 9.24; 9.899 110.1; 98.04; 98.76 | 722.1 | Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/ New Journal of Chemistry, 2004, 28, 425 |
| 7050878 | CIF | C24 H28 Cl4 N4 O4 Pt | P -1 | 7.8552; 8.5681; 11.6142 88.8886; 74.9911; 73.4238 | 722.39 | Pombeiro, Armando; Bokach, Nadezhda A.; Galanski, Markus; Garnovskii, Dmitrii A.; Haukka, Matti; Keppler, Bernhard K.; Kukushkin, Vadim Yu.; Makarycheva-Mikhailova, Anastassiya V. Platinum(IV)-mediated Coupling of Dione Monoximes and Nitriles: a Novel Reactivity Pattern of the Classic Oxime-based Chelating Ligands New Journal of Chemistry, 2002 |
| 7054739 | CIF | C12 H13 N2 O8 V | P -1 | 6.7436; 8.14; 13.7971 103.904; 97.539; 95.474 | 722.45 | Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives New J. Chem., 2015, 39, 4265 |
| 7054700 | CIF | C32 H32 Be2 N4 O6 | P -1 | 8.5367; 8.8067; 10.1596 106.505; 92.538; 97.889 | 722.6 | Reglinski, John; Kennedy, Alan R.; Steel, Graham Tetradentate Schiff base beryllium complexes New J. Chem., 2015, 39, 2437 |
| 7054815 | CIF | C11 H18 F4 I N O | P -1 | 5.7245; 11.1337; 12.3817 66.474; 87.523; 89.655 | 722.82 | Pang, Xue; Jin, Wei Jun Exploring the halogen bond specific solvent effects in halogenated solvent systems by ESR probe New J. Chem., 2015, 39, 5477 |
| 7056094 | CIF | C20 H28 N4 O18 Pb4 | P -1 | 8.4173; 8.4523; 11.035 71.442; 89.744; 76.903 | 722.96 | Dai, Jun-Wei; zheng, jianmei; Li, Haiyan; Zhou, Jin-Mei; Dong, Xin; Zhou, Zhao-Hui Halide assisted formations of polymeric ethylenediaminetetraacetato lead(II) complexes New J. Chem., 2017 |
| 7053289 | CIF | C3 H3 F3 O2 S2 | P -1 | 6.4698; 9.0499; 12.57 97.219; 93.131; 96.888 | 723.07 | Torrico-Vallejos, Sonia; Erben, Mauricio F.; Boese, Roland; Della Védova, Carlos O. Methoxycarbonyl trifluoromethyl disulfide, CH3OC(O)SSCF3: synthesis, structure and conformational properties New Journal of Chemistry, 2010, 34, 1365 |
| 7059176 | CIF | C15 H17 F3 N2 O2 | P -1 | 5.1066; 11.5568; 12.7664 100.531; 94.646; 100.547 | 723.1 | Il’in, Mikhail V.; Lesnikova, Liana A.; Bolotin, Dmitrii S.; Novikov, Alexander S.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu. A one-pot route to N-acyl ureas: a formal four-component hydrolytic reaction involving aminonitrones and isocyanide dibromides New Journal of Chemistry, 2020, 44, 1253-1262 |
| 7057678 | CIF | C14 H32 N18 O4 Pd S4 | P -1 | 8.0774; 9.3329; 10.9899 96.638; 108.728; 107.974 | 724.82 | Zhao, Gang; He, Chunlin; Gao, Haixiang; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Improving the density and properties of nitrogen-rich scaffolds by the introduction of a C‒NO2 group New Journal of Chemistry, 2018, 42, 16162 |
| 7050032 | CIF | C14 H14 Cl I S | P 1 21 1 | 6.956; 5.6659; 18.636 90; 98.9; 90 | 725.6 | Asseily, Gabriel A.; Davies, Robert P.; Rzepa, Henry S.; White, Andrew J. P. A solid-state structural and theoretical study on the 1 ? 1 addition compounds of thioethers with dihalogens and interhalogens I?X (X = I, Br, Cl) New Journal of Chemistry, 2005, 29, 315 |
| 7062046 | CIF | C14 H16 Cl N O2 Se | P -1 | 7.304; 9.1476; 11.7026 70.419; 80.43; 88.427 | 726.09 | Aragoni, M. Carla; Podda, Enrico; Arca, Massimiliano; Pintus, Anna; Lippolis, Vito; Caltagirone, Claudia; Bartz, Ricardo H.; Lenardão, Eder J.; Perin, Gelson; Schumacher, Ricardo F.; Coles, Simon J.; Orton, James B. An unprecedented non-classical polyinterhalogen anion made of [I2Cl]− and I2 at the 2-(p-tolyl)selenopheno[2,3-b]pyridinium cation template New Journal of Chemistry, 2022, 46, 21921-21929 |
| 7052972 | CIF | C8 H20 N2 O12 | P 1 21 1 | 4.8832; 11.9276; 12.4798 90; 92.018; 90 | 726.43 | Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid New Journal of Chemistry, 2013, 37, 97 |
| 7058758 | CIF | C6 H6 N18 O2 Pb Zn | P -1 | 7.2877; 7.4427; 13.6865 83.102; 85.643; 81.066 | 726.8 | Wu, Shuo; Lin, Guowei; Yang, Zhengyi; Yang, Qi; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli; Lu, Jack Y. Crystal structures, thermodynamics and accelerating thermal decomposition of RDX: two new energetic coordination polymers based on a Y-shaped ligand of tris(5-aminotetrazole)triazine New Journal of Chemistry, 2019, 43, 14336 |
| 7050160 | CIF | C26 H20 Mn N10 O4 S2 | P -1 | 7.9571; 8.674; 11.326 94.31; 110.17; 94.66 | 726.9 | Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer New Journal of Chemistry, 2004, 28, 191 |
| 7058314 | CIF | C8 N12 O10 | P 1 21/c 1 | 11.2116; 5.9944; 10.8652 90; 95.429; 90 | 726.94 | Xiong, Hualin; Cheng, Guangbin; Zhang, Zaichao; Yang, Hongwei C8N12O10: a promising energetic compound with excellent detonation performance and desirable sensitivity New Journal of Chemistry, 2019, 43, 7784 |
| 7062830 | CIF | C7 H6 N4 O | P 1 21/c 1 | 3.8205; 15.6562; 12.191 90; 94.496; 90 | 726.95 | Sheremetev, Aleksei B.; Kozeev, Andrei S.; Palysaeva, Nadezhda V.; Suponitsky, Kyrill Yu. A mild and efficient synthesis of aminofurazans New Journal of Chemistry, 2023, 47, 21091-21097 |
| 7052663 | CIF | C10 H26 N4 O4 | P 1 21/c 1 | 10.609; 5.2; 14.302 90; 112.627; 90 | 728.27 | Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M. Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes New Journal of Chemistry, 2011, 35, 1515 |
| 7052560 | CIF | C4 H10 Cu I N2 | C 1 2/m 1 | 10.1972; 12.1811; 6.7879 90; 120.25; 90 | 728.34 | Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Mazzeo, Paolo P.; Ventura, Barbara Solid-state reactivity of copper(i) iodide: luminescent 2D-coordination polymers of CuI with saturated bidentate nitrogen bases New Journal of Chemistry, 2011, 35, 339 |
| 7060856 | CIF | C12 H15 N O7 S | P 1 | 7.6274; 9.1304; 10.6185 92.663; 99.327; 90.796 | 728.75 | Sosa-Gil, Concepción; Babiano, Reyes; Cintas, Pedro; Light, Mark E.; Palacios, Juan C. On the anomeric preference of the isothiocyanato group New Journal of Chemistry, 2021, 45, 14111-14125 |
| 7056305 | CIF | C15 H20 N2 O3 | P 1 21 1 | 8.325; 10.8767; 8.5879 90; 110.364; 90 | 729.02 | Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H. Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes New J. Chem., 2017 |
| 7061580 | CIF | C16 H18 O2 Se | P -1 | 7.8964; 8.401; 11.588 92.16; 96.22; 106.84 | 729.5 | Tripathi, Abhishek; Deka, Rajesh; Butcher, Ray J.; Turner, David R.; Deacon, Glen B.; Singh, Harkesh B. Exploring the reactivity of L-tellurocystine, Te-protected tellurocysteine conjugates and diorganodiselenides towards hydrogen peroxide: synthesis and molecular structure analysis New Journal of Chemistry, 2022, 46, 10550-10559 |
| 7057082 | CIF | C18 H38 Co3 N4 O20 P4 | P -1 | 7.9658; 9.4269; 9.9867 92.69; 95.66; 101.35 | 730 | Rojek, Tomasz; Goldeman, Waldemar; Ślepokura, Katarzyna; Duczmal, Marek; Wojciechowska, Agnieszka; Matczak-Jon, Ewa 1D Co(ii) coordination polymers based on cyclobutyl- and cyclopentyl-substituted zoledronate analogues: synthesis, structural comparison, thermal stability and magnetic properties New Journal of Chemistry, 2018, 42, 7830 |
| 7057158 | CIF | C11 H8 Cl I2 N Se | P -1 | 7.9441; 9.882; 10.709 103.25; 108.38; 103.88 | 730.9 | Montis, Riccardo; Arca, Massimiliano; Aragoni, M. Carla; Blake, Alexander J.; Castellano, Carlo; Demartin, Francesco; Isaia, Francesco; Lippolis, Vito; Pintus, Anna; Lenardão, Eder J.; Perin, Gelson; O'Connor, Alice E.; Thurow, Samuel Structural diversity in the products formed by the reactions of 2-arylselanyl pyridine derivatives and dihalogens New Journal of Chemistry, 2018, 42, 10592 |
| 7062402 | CIF | C26 H28 Cl4 Co2 N6 O2 | P -1 | 9.127; 9.5751; 9.8287 65.837; 70.687; 89.621 | 731.27 | Singh, Anshu; Boro, Bishal; Maji, Ankur; Singh, Ovender; Singh, Sain; Singh, Udai P.; Ghosh, Kaushik Design and synthesis of dinuclear cobalt(ii) complexes derived from strong π-acidic ligands: crystal structure and studies on the oxidation of sp3 C–H bonds New Journal of Chemistry, 2023, 47, 8951-8959 |
| 7057813 | CIF | C12 H11 Ag Br N3 O3 S | P -1 | 8.7498; 9.316; 10.2463 70.602; 84.715; 68.444 | 732.27 | Barwiolek, Magdalena; Wojtczak, Andrzej; Kozakiewicz, Anna; Szczesny, Robert; Babinska, Magdalena; Skowronski, Lukasz; Szlyk, Edward New highly fluorescent silver complexes and their thin films obtained by spin coating method New Journal of Chemistry, 2018, 42, 18559 |
| 7057912 | CIF | C15 H12 Cu I N2 O | P -1 | 8.5695; 9.3493; 10.6986 74.782; 75.057; 63.915 | 732.75 | Smirnov, Andrey S.; Martins, Luísa M. D. R. S.; Nikolaev, Dmitriy N.; Manzhos, Roman A.; Gurzhiy, Vlad V.; Krivenko, Alexander G.; Nikolaenko, Kirill O.; Belyakov, Alexander V.; Garabadzhiu, Alexander V.; Davidovich, Pavel B. Structure and catalytic properties of novel copper isatin Schiff base complexes New Journal of Chemistry, 2019, 43, 188 |
| 7054951 | CIF | C10 H15 Ba N O9 P2 | P -1 | 5.4566; 8.6781; 16.081 92.8; 92.173; 105.253 | 732.76 | Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure New J. Chem., 2015, 39, 6611 |
| 7056901 | CIF | C36 H40 N2 | P -1 | 8.3622; 8.7201; 11.3838 69.821; 81.103; 70.285 | 732.79 | Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties New Journal of Chemistry, 2018, 42, 3102 |
| 7054186 | CIF | C12 H16 N10 Ni | P 1 21/c 1 | 8.6717; 9.0238; 9.3952 90; 94.504; 90 | 732.92 | Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide New Journal of Chemistry, 2014, 38, 3529 |
| 7059443 | CIF | C16 H17 N5 O2 | P -1 | 7.1753; 10.1901; 11.0558 109.818; 97.305; 100.11 | 733.32 | Pan, Zexi; Song, Chan; Zhou, Wei; Cui, Dong-Mei; Zhang, Chen Synthesis of imidazo[1,2-a][1,3,5]triazines by NBS-mediated coupling of 2-amino-1,3,5-triazines with 1,3-dicarbonyl compounds New Journal of Chemistry, 2020, 44, 6182-6185 |
| 7060587 | CIF | C2 H Cl2 N3 | P -6 2 c | 11.409; 11.409; 6.5079 90; 90; 120 | 733.61 | Kordestani, Nazanin; Amiri Rudbari, Hadi; Correia, Isabel; Valente, Andreia; Côrte-Real, Leonor; Islam, Mohammad Khairul; Micale, Nicola; Braun, Jason D.; Herbert, David E.; Tumanov, Nikolay; Wouters, Johan; Enamullah, Mohammed Heteroleptic enantiopure Pd(ii)-complexes derived from halogen-substituted Schiff bases and 2-picolylamine: synthesis, experimental and computational characterization and investigation of the influence of chirality and halogen atoms on the anticancer activity New Journal of Chemistry, 2021, 45, 9163-9180 |
| 7053385 | CIF | C18 H14 N O4 | P -1 | 7.559; 10.106; 11.41 104.767; 106.763; 108.177 | 733.8 | Linares, Maholy; Briceño, Alexander Solid-state synthesis of head-to-tail photodimers from supramolecular assemblies directed by charge-assisted hydrogen bonds New Journal of Chemistry, 2010, 34, 587 |
| 7054188 | CIF | C12 H16 Cu N10 | P 1 21/c 1 | 8.6111; 9.1061; 9.3794 90; 93.735; 90 | 733.91 | Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide New Journal of Chemistry, 2014, 38, 3529 |
| 7057665 | CIF | C11 H14 Cl Cu N5 S | P -1 | 8.5331; 9.4698; 9.511 96.619; 98.51; 102.123 | 734.58 | Kaushal, Mani; Lobana, Tarlok S.; Nim, Lovedeep; Kaur, Jaskamal; Bala, Ritu; Hundal, Geeta; Arora, Daljit S.; Garcia-Santos, Isabel; Duff, Courtney E.; Jasinski, Jerry P. Synthesis, structures, antimicrobial activity and biosafety evaluation of pyridine-2-formaldehyde-N-susbtituted-thiosemicarbazonates of copper(ii) New Journal of Chemistry, 2018, 42, 15879 |
| 7057907 | CIF | C32 H28 Br2 Cu2 N4 O2 | P -1 | 8.6213; 9.3911; 10.1721 90.122; 97.663; 115.574 | 734.61 | Smirnov, Andrey S.; Martins, Luísa M. D. R. S.; Nikolaev, Dmitriy N.; Manzhos, Roman A.; Gurzhiy, Vlad V.; Krivenko, Alexander G.; Nikolaenko, Kirill O.; Belyakov, Alexander V.; Garabadzhiu, Alexander V.; Davidovich, Pavel B. Structure and catalytic properties of novel copper isatin Schiff base complexes New Journal of Chemistry, 2019, 43, 188 |
| 7054659 | CIF | C15 H19 N O3 | P 1 21 1 | 9.7435; 6.5523; 11.959 90; 105.802; 90 | 734.64 | Rodríguez, Isabel; Calaza, M. Isabel; Jiménez, Ana I.; Cativiela, Carlos Synthesis of enantiomerically pure δ-benzylproline derivatives New J. Chem., 2015, 39, 3310 |
| 7059479 | CIF | C22 H36 N14 Ni O6 | P -1 | 9.5039; 9.5463; 9.7514 78.526; 61.114; 71.962 | 735.27 | Zelenkov, Lev E.; Kuznetsov, Maxim L.; Andrusenko, Elena V.; Avdontceva, Margarita S.; Starova, Galina L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu. Nickel(ii)-mediated cyanamide‒pyrazole coupling highlights distinct reactivity of NCNR2 and NCR nitrile ligands New Journal of Chemistry, 2020, 44, 6979-6991 |
| 7054742 | CIF | C12 H12 N3 O7 V | P 1 21/m 1 | 8.1855; 6.5443; 13.8669 90; 97.755; 90 | 736.03 | Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives New J. Chem., 2015, 39, 4265 |
| 7053140 | CIF | C18 H13 Fe N S2 | P -1 | 7.3774; 9.9499; 10.566 87.451; 79.77; 74.67 | 736.1 | Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles New Journal of Chemistry, 2013, 37, 2019 |
| 1551258 | CIF | C14 H16 Cu N2 O8 | P -1 | 7.9481; 8.7896; 11.4208 90.722; 106.939; 104.188 | 736.93 | May, Nóra V.; Gál, G. Tamás; Szentendrei, Zsolt; Korecz, László; May, Zoltán; Ferlin, Maria Grazia; Dean, Annalisa; Bombicz, Petra; Di Marco, Valerio B. Relationship between solid state structure and solution stability of copper(ii)–hydroxypyridinecarboxylate complexes New Journal of Chemistry, 2019, 43, 10699 |
| 7054021 | CIF | C8 H16 Cu N6 O7 | P -1 | 9.0343; 9.2812; 10.1736 63.807; 74.368; 82.407 | 737.05 | Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes New Journal of Chemistry, 2014, 38, 1611 |
| 7054784 | CIF | C2 H6 Cl N5 O4 | P 1 21/n 1 | 8.287; 9.193; 9.926 90; 102.89; 90 | 737.1 | Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia 3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties New J. Chem., 2015, 39, 5265 |
| 7059492 | CIF | C16 H7 F7 O | P -1 | 5.6304; 8.4095; 15.7707 95.118; 96.805; 92.702 | 737.25 | Morita, Masato; Yamada, Shigeyuki; Konno, Tsutomu Fluorine-induced emission enhancement of tolanes via formation of tight molecular aggregates New Journal of Chemistry, 2020, 44, 6704-6708 |
| 7051931 | CIF | C28 H32 Br2 Cu N8 O2 | P -1 | 8.683; 8.762; 10.844 75.252; 67.904; 80.906 | 737.5 | Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J. Influence of the metal-to-ligand ratio on the formation of metal organic complexes New Journal of Chemistry, 2008, 32, 813 |
| 7058549 | CIF | C14 H13 Cl Cu N4 S | P -1 | 7.0086; 8.3881; 13.5011 93.465; 94.684; 110.405 | 738.06 | Kaushal, Mani; Lobana, Tarlok S.; Nim, Lovedeep; Bala, Ritu; Arora, Daljit S.; Garcia-Santos, Isabel; Duff, Courtney E.; Jasinski, Jerry P. Synthesis of 2-acetylpyridine-N-substituted thiosemicarbazonates of copper(ii) with high antimicrobial activity against methicillin resistant S. aureus, K. pneumoniae 1 and C. albicans New Journal of Chemistry, 2019, 43, 11727 |
| 7060376 | CIF | C18 H17 N O3 | P -1 | 8.7769; 9.1976; 10.1697 74.462; 81.905; 69.13 | 738.13 | Kulakov, Ivan V.; Stalinskaya, Alena L.; Chikunov, Semyon Y.; Gatilov, Yuri V. Synthesis of new representatives of 11,12-dihydro-5H-5,11-epoxybenzo[7,8]oxocino[4,3-b]pyridines ‒ structural analogues of integrastatins A, B New Journal of Chemistry, 2021, 45, 3559-3569 |
| 7056752 | CIF | C7 H6 N2 O2 S | P 1 21/c 1 | 8.454; 12.125; 7.206 90; 91.66; 90 | 738.3 | Soares, Maria I.L.; Manaia Nunes, Cláudio; Gomes, Clara S. B.; Pinho e Melo, Teresa M. V. D.; Fausto, Rui Conformational Behaviour, Photochemistry and Flash Vacuum Pyrolysis of a 2-(1H-Tetrazol-1-yl)thiophene New Journal of Chemistry, 2017 |
| 7055031 | CIF | C26 H28 Cl2 Cu N4 Se4 | P -1 | 8.2538; 8.7192; 11.6817 87.058; 81.017; 62.798 | 738.35 | Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis New J. Chem., 2015, 39, 7948 |
| 7057914 | CIF | C30 H22 Br4 Cu2 N4 O2 | P -1 | 8.5542; 9.5043; 10.1464 90.501; 96.474; 115.484 | 738.4 | Smirnov, Andrey S.; Martins, Luísa M. D. R. S.; Nikolaev, Dmitriy N.; Manzhos, Roman A.; Gurzhiy, Vlad V.; Krivenko, Alexander G.; Nikolaenko, Kirill O.; Belyakov, Alexander V.; Garabadzhiu, Alexander V.; Davidovich, Pavel B. Structure and catalytic properties of novel copper isatin Schiff base complexes New Journal of Chemistry, 2019, 43, 188 |
| 7061593 | CIF | C16 H10 Fe O3 S2 | P -1 | 6.4288; 8.8456; 14.0419 105.769; 99.98; 99.222 | 738.5 | Matczak, Piotr; Kupfer, Stephan; Mlostoń, Grzegorz; Buday, Philipp; Görls, Helmar; Weigand, Wolfgang Metal–ligand bonding in tricarbonyliron(0) complexes bearing thiochalcone ligands New Journal of Chemistry, 2022, 46, 12924-12933 |
| 7059706 | CIF | C8 H21 Co N12 | P -1 | 8.1748; 9.1211; 11.034 89.394; 78.199; 66.964 | 738.9 | Jana, Narayan Ch.; Brandão, Paula; Panja, Anangamohan The first report of a tetra-azide bound mononuclear cobalt(iii) complex and its comparative biomimetic catalytic activity with tri-azide bound cobalt(iii) compounds New Journal of Chemistry, 2020, 44, 11527-11536 |
| 7062383 | CIF | C19 H16 N2 O2 | P -1 | 8.9663; 9.2196; 10.1384 109.529; 106.432; 96.016 | 738.97 | Guo, Hao; Wang, Huahao; Zhao, Hongyi; Zhang, Dongfeng Visible light-promoted synthesis of 4,6a-dihydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-diones via [3+2] cycloaddition reaction of 2H-azirines with maleimides New Journal of Chemistry, 2023, 47, 5634-5638 |
| 1544180 | CIF | C16 H18 N2 O2 S | P 1 21 1 | 6.4138; 7.6858; 15.2182 90; 99.722; 90 | 739.41 | Aillerie, Alexandre; Lemau de Talencé, Vincent; Dumont, Clément; Pellegrini, Sylvain; Capet, Frédéric; Bousquet, Till; Pélinski, Lydie Enantioselective transfer hydrogenation, a key step for the synthesis of 3-aminotetrahydroquinolines New J. Chem., 2016, 40, 9034 |
| 7055903 | CIF | C16 H16 N2 S2 | P 1 21/n 1 | 7.79; 5.2518; 18.107 90; 92.039; 90 | 740.32 | Saha, Pinaki; Samanta, Debasish; Ghosh, Prasanta Glyoxalbis(2-methylmercaptoanil) complexes of nickel and ruthenium: radical versus non-radical states New J. Chem., 2017, 41, 1149 |
| 7054933 | CIF | C15 H14 Co N3 O5 | P -1 | 6.63; 10.167; 12.475 109.11; 103.7; 100.43 | 740.7 | Li, Xiaoju; Sun, Xiaofei; Li, Xinxiong; Xu, Xiahong Syntheses and characterizations of six Co(ii) and Mn(ii) coordination polymers based on amino-substituted 5-aminoisophthalate and flexible bis(imidazolyl) ligands New J. Chem., 2015, 39, 6844 |
| 7054470 | CIF | C30 H24 Mo2 N4 O12 | P -1 | 9.2163; 9.9981; 10.1284 63.594; 65.191; 89.389 | 740.79 | Vrdoljak, Višnja; Pisk, Jana; Agustin, Dominique; Novak, Predrag; Parlov Vuković, Jelena; Matković-Čalogović, Dubravka Dioxomolybdenum(vi) and dioxotungsten(vi) complexes chelated with the ONO tridentate hydrazone ligand: synthesis, structure and catalytic epoxidation activity New J. Chem., 2014, 38, 6176 |
| 7057957 | CIF | C10 H14 N3 O8 P | P -1 | 7.4008; 10.413; 10.972 109.76; 99.84; 104.2 | 741 | Li, Rui-Xia; Zhou, Lin; Shi, Ping-Ping; Zheng, Xuan; Gao, Ji-Xing; Ye, Qiong; Fu, Da-Wei High-temperature phase transitions, switchable dielectric behaviors and barocaloric effects in three new organic molecule-based crystals New Journal of Chemistry, 2019, 43, 154 |
| 7053042 | CIF | C7 H5 N3 S | P 1 21/n 1 | 5.565; 13.292; 10.0843 90; 96.248; 90 | 741.5 | Branowska, Danuta; Chaciak, Bartosz; Siuchta, Olga; Olender, Ewa; Ledwon, Przemyslaw; Lapkowski, Mieczyslaw; Poronik, Eugenij; Wysocki, Waldemar; Karczmarzyk, Zbigniew; Skora, Lukasz; Filapek, Michał; Krompiec, Stanislaw; Urbanczyk-Lipkowska, Zofia; Kalicki, Przemyslaw Synthesis, photophysics and electrochemistry of novel, nitrogen-containing heterocyclic derivatives New Journal of Chemistry, 2013, 37, 1982 |
| 7054479 | CIF | C4 H6 N6 O3 | C 1 2/c 1 | 12.844; 8.919; 6.988 90; 112.147; 90 | 741.5 | Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R. Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles New J. Chem., 2015, 39, 1619 |
| 7059325 | CIF | C31 H33 N O12 | P 1 | 5.6782; 11.7351; 12.7603 115.226; 101.818; 93.6185 | 741.94 | Fujita, Hikaru; Zhang, Yunlong; Wu, Zhiyuan; Lindsey, Jonathan S. Chromogenic agents built around a multifunctional double-triazine framework for enzymatically triggered cross-linking under physiological conditions New Journal of Chemistry, 2020, 44, 3856-3867 |
| 7062951 | CIF | C30 H24 Cu3 N4 O12 | P -1 | 8.3526; 8.6543; 10.7547 85.213; 75.719; 80.446 | 742.2 | Wang, Ling-Li; Wang, Kai-Tong; Duan, Wen-Long; Luan, Jian; Han, Xiao-Ri Influence of bridging atoms in copper-based coordination polymers for enhancing urease inhibition activity New Journal of Chemistry, 2024, 48, 2787-2795 |
| 7053762 | CIF | C4 H19 Co N O13 P2 | P -1 | 9.3817; 9.3988; 9.776 82.84; 62.55; 76.32 | 743.1 | Ma, Kuirong; Xu, Jianing; Zhang, Lirong; Shi, Jing; Zhang, Daojun; Zhu, Yulan; Fan, Yong; Song, Tianyong Solvothermal syntheses, characterizations and properties of three transition metal (Ni(ii), Co(ii)) imino-carboxylate-diphosphonates New Journal of Chemistry, 2009, 33, 886 |
| 7052561 | CIF | C4 H10 Cu I N2 | C 1 2/m 1 | 10.315; 12.217; 6.859 90; 120.69; 90 | 743.3 | Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Mazzeo, Paolo P.; Ventura, Barbara Solid-state reactivity of copper(i) iodide: luminescent 2D-coordination polymers of CuI with saturated bidentate nitrogen bases New Journal of Chemistry, 2011, 35, 339 |
| 7061369 | CIF | C34 H42 N4 O4 | P -1 | 6.9814; 9.721; 11.6464 75.978; 85.771; 75.899 | 743.65 | Jing, Haoyu; Liu, Sijia; Jiang, Jianbing; Tran, Vy-Phuong; Rong, Jie; Wang, Pengzhi; Lindsey, Jonathan S. Meso bromination and derivatization of synthetic bacteriochlorins New Journal of Chemistry, 2022 |
| 7062528 | CIF | C14 H20 N6 O2 | P 1 21/c 1 | 8.0049; 10.5291; 9.2006 90; 106.405; 90 | 743.9 | Murugaperumal, Parvathavarthini; Rajendran, Praveena; Nallathambi, Sengottuvelan; Ayyanar, Siva; Perdih, Franc; Balasubramaniem, Ashokkumar; Alagarsamy, Arun An oxalamide-bridged imidazole based ‘turn off’ fluorescent receptor for copper(ii) and iron(iii) ions New Journal of Chemistry, 2023, 47, 13342-13352 |
| 7058763 | CIF | C6 H11 As O3 | P 1 21/n 1 | 6.018; 11.627; 10.644 90; 92.28; 90 | 744.2 | Trubenstein, Henry J.; Moaven, Shiva; Vega, Maythe; Unruh, Daniel K.; Cozzolino, Anthony F. Pnictogen bonding with alkoxide cages: which pnictogen is best? New Journal of Chemistry, 2019, 43, 14305 |
| 7050392 | CIF | C H5 B9 Br5 Cs | P 4/n m m :2 | 8.3873; 8.3873; 10.5853 90; 90; 90 | 744.64 | Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6] New J. Chem., 2004, 28, 1499-1505 |
| 7050920 | CIF | C42 H30 N2 O2 | P -1 | 5.8554; 9.3045; 14.6994 71.827; 89.422; 78.702 | 745.04 | Scott, Janet; Asami, Masaya; Tanaka, Koichi Novel chromogenic, guest-sensitive host compounds New Journal of Chemistry, 2002, 26, 1822 |
| 7052161 | CIF | C15 H13 Ni S4 | P -1 | 8.769; 9.318; 10.3604 87.844; 83.577; 62.422 | 745.55 | Mitsushiro Nomura; Marc Fourmigué The contrasted structural and magnetic behaviour of two single-component paramagnetic dithiolene complexes New Journal of Chemistry, 2007, 31, 528 |
| 7059873 | CIF | C18 H16 Cl N O2 | P -1 | 7.3932; 10.0477; 11.2604 100.487; 104.79; 106.52 | 745.56 | Shi, Yang; Wang, Gangqiang; Wang, Hang; Deng, Bin; Gao, Tao; Wang, Jian; Guo, Haibing; Wu, Minghu; Sun, Shaofa Cu-catalyzed cyclization to construct indoles from N-(ortho-chloromethyl)aryl carbamates and terminal alkynes via a one-pot reaction New Journal of Chemistry, 2020, 44, 14477-14480 |
| 7054727 | CIF | C14 H15 N2 O5 P | P -1 | 5.757; 8.9928; 14.7059 78.99; 86.504; 87.806 | 745.67 | Gholivand, Khodayar; Molaei, Foroogh Synthesis and structural study of some new phosphorus(v) hydrazide compounds: spectroscopic evidence and a theoretical approach New J. Chem., 2015, 39, 3747 |
| 7061007 | CIF | C8 H36 Co2 Mo2 N8 O27 | P -1 | 7.4297; 10.377; 10.9734 66.911; 74.016; 87.852 | 745.79 | Kuzman, Dino; Damjanović, Vladimir; Stilinović, Vladimir; Cindrić, Marina; Vrdoljak, Višnja The role of mono- and dicarboxylic acids in the building of oxomolybdates containing {MoO4}, {Mo2O5}, {Mo2O6}, {Mo3O8}, {Mo5O17}, {Mo5O18}, {Mo8O26}, and {SiMo12O40} units New Journal of Chemistry, 2021, 45, 19764-19774 |
| 7060882 | CIF | C17 H19 N O3 | P -1 | 7.8954; 10.2306; 10.8425 65.53; 73.962; 71.657 | 745.8 | Xia, Ai-Bao; Li, Chen; Bai, Liang; Ge, Min-Tong; Wang, Ying; Qiu, Yuan-Rui; Xu, Dan-Qian Base-controlled chemoselectivity: direct coupling of alcohols and acetonitriles to synthesise α-alkylated arylacetonitriles or acetamides New Journal of Chemistry, 2021 |
| 7052842 | CIF | C12 H13 N5 O7 | P -1 | 7.25; 9.107; 11.946 83.27; 74.608; 79.684 | 746.1 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
| 7051018 | CIF | C15 H15.668 Fe N O5.334 | P 1 21 1 | 7.455; 10.0294; 10.568 90; 109.2; 90 | 746.2 | Baker, Murray V.; Kraatz, Heinz-Bernhard; Wilson Quail, J. Solvent effects on the redox properties of ferrocenoyl-dipeptides New Journal of Chemistry, 2001, 25, 427 |
| 7050085 | CIF | C18 H20 O4 | P 1 21/c 1 | 8.9484; 6.7152; 12.4323 90; 92.5; 90 | 746.35 | Sergey P. Gromov; Artem I. Vedernikov; Evgeny N. Ushakov; Natalia A. Lobova; Asya A. Botsmanova; Lyudmila G. Kuz'mina; Andrei V. Churakov; Yuri A. Strelenko; Michael V. Alfimov; Judith A. K. Howard; Dan Johnels; Ulf G. Edlund Novel supramolecular charge-transfer systems based on bis(18-crown-6)stilbene and viologen analogues bearing two ammonioalkyl groups New Journal of Chemistry, 2005, 29, 881 |
| 7062687 | CIF | C16 H15 Cl O3 S | P -1 | 7.5988; 7.6069; 13.6966 91.485; 95.543; 108.404 | 746.37 | Blé-González, Ever A.; Isbel, Stephen R.; Ojo, Olatunji S.; Hillesheim, Patrick C.; Zeller, Matthias; Bugarin, Alejandro Regiodivergent sulfonylation of terminal olefins via dearomative rearrangement New Journal of Chemistry, 2023, 47, 17020-17025 |
| 7054190 | CIF | C12 H16 N10 Zn | P 1 21/c 1 | 8.752; 9.098; 9.408 90; 94.347; 90 | 747 | Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide New Journal of Chemistry, 2014, 38, 3529 |
| 7052781 | CIF | C19 H14 N P | P -1 | 8.4168; 9.9909; 10.6003 107.361; 104.961; 107.851 | 747.45 | Reis, Andreas; Dehe, Daniel; Farsadpour, Saeid; Munstein, Isabel; Sun, Yu; Thiel, Werner R. Fluoride catalyzed P‒aryl-coupling—a mild approach to functionalized arylphosphines New Journal of Chemistry, 2011, 35, 2488 |
| 7051695 | CIF | C13 H10 O3 S4 | P -1 | 10.224; 11.407; 7.0403 107.95; 104.63; 93.175 | 747.8 | Miyazaki, Akira; Enoki, Toshiaki Structure and physical properties of isopropyl TTF semisquarates New Journal of Chemistry, 2009, 33, 1249 |
| 7062125 | CIF | C21 H13 N S | P -1 | 8.8473; 9.7021; 10.1837 66.774; 69.333; 77.281 | 748.26 | Mast, Nicolas; Erb, William; Nauton, Lionel; Moreau, Pascale; Mongin, Olivier; Roisnel, Thierry; Macaigne, Margaux; Robert, Thomas; Bach, Stéphane; Picot, Laurent; Thiéry, Valérie; Hurvois, Jean-Pierre; Mongin, Florence From benzofuro-, benzothieno- and 10-methylindolo-[2,3-b]-fused benzothiopyrano[4,3,2-de]quinolines to the corresponding benzothiopyrano[4,3,2-de]1,8-naphthyridines: synthesis and properties of these hexacyclic heteroaromatic compounds New Journal of Chemistry, 2023, 47, 258-283 |
| 7060742 | CIF | C18 H12 B2 O4 | P 21 21 2 | 22.542; 4.7936; 6.9265 90; 90; 90 | 748.46 | Cheng, Jun; Lu, Chengrong; Zhao, Bei Cycloaddition of carbon dioxide and epoxides catalyzed by rare earth metal complexes bearing a Trost ligand New Journal of Chemistry, 2021, 45, 13096-13103 |
| 7058082 | CIF | C19 H16 N2 O | P -1 | 9.1292; 9.3744; 10.0457 84.328; 88.471; 61.065 | 748.5 | Meerakrishna, Ramakrishnan Suseela; Shanmugam, Ponnusamy Synthesis of blue-red emissive amido-substituted di(het)aryl and tri(het)aryl amine derivatives via chemoselective N-mono and N,N-diarylation of (het) aryl amino amides using benzyne/arynes New Journal of Chemistry, 2019, 43, 2550 |
| 7051960 | CIF | C15 H13 N O6 S | P -1 | 8.117; 8.432; 11.705 108.32; 90.98; 99.13 | 748.96 | Altamura, Maria; Dapporto, Paolo; Guidi, Antonio; Harmat, Nicholas J. S.; Jierry, Loïc; Libralesso, Elisa; Paoli, Paola; Rossi, Patrizia Investigation on the flexibility of chiral tricyclic derivatives New Journal of Chemistry, 2008, 32, 1617 |
| 7050033 | CIF | C14 H14 Br I S | P 1 21 1 | 7.1678; 5.7376; 18.5292 90; 100.495; 90 | 749.28 | Asseily, Gabriel A.; Davies, Robert P.; Rzepa, Henry S.; White, Andrew J. P. A solid-state structural and theoretical study on the 1 ? 1 addition compounds of thioethers with dihalogens and interhalogens I?X (X = I, Br, Cl) New Journal of Chemistry, 2005, 29, 315 |
| 7052537 | CIF | C16 H16 Br N O2 | P 1 | 7.2044; 9.3402; 12.3377 69.1986; 80.3396; 75.9081 | 749.7 | Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond New Journal of Chemistry, 2011, 35, 156 |
| 7062376 | CIF | C14 H12 Cu N6 O3 | P -1 | 8.3848; 8.9939; 11.1413 102.733; 90.338; 113.054 | 750.09 | Gurbanov, Atash V.; Mahmoud, Abdallah G.; Aliyeva, Vusala A.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. Novel cyano-activated Cu(ii) complexes of arylhydrazones of active methylene nitriles and their catalytic application for azide–alkyne cycloaddition in water and glycerol New Journal of Chemistry, 2023, 47, 7965-7974 |
| 7050545 | CIF | C8 H8 N2 O2 | C 1 2/c 1 | 10.186; 11.051; 7.6536 90; 119.445; 90 | 750.25 | Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen Hydrogen bond patterns in aromatic and aliphatic dioximes New J. Chem., 2003, 27, 1084-1094 |
| 7054252 | CIF | C9 H F9 N2 | P 32 | 12.439; 12.439; 5.599 90; 90; 120 | 750.26 | Muñoz, Bianca K.; Ojo, Wilfried-Solo; Jacob, Kane; Romero, Nuria; Vendier, Laure; Despagnet-Ayoub, Emmanuelle; Etienne, Michel Perfluorinated 1H-indazoles and hydrotris(indazol-1-yl)borates. Supramolecular organization and a new synthetic procedure to form scorpionate ligands New Journal of Chemistry, 2014, 38, 2451 |
| 7055892 | CIF | C16 H13 N O7 Zn | P -1 | 7.9019; 9.722; 10.8821 97.947; 95.917; 113.062 | 750.36 | Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies New J. Chem., 2017, 41, 1046 |
| 7050982 | CIF | C13 H11 Cl2 Cu N3 O S | P -1 | 9.674; 11.085; 7.751 97.63; 102.76; 108.18 | 751.7 | Li, Gang; Che, De-Ji; Li, Zi-Feng; Zhu, Yu; Zou, Da-Peng Versatile coordination patterns in the reaction system of N-benzoyl-N???-(2-pyridyl)thiourea with CuCl2. Their reaction conditions, systematic isolation and crystal structures New Journal of Chemistry, 2002, 26, 1629 |
| 7055538 | CIF | C13 H11 Au Cl3 N3 | P -1 | 7.8357; 9.7387; 11.0588 115.506; 92.671; 96.763 | 751.88 | Nandy, Abhishek; Samanta, Tapastaru; Mallick, Sumana; Mitra, Partha; Seth, Saikat Kumar; Saha, Krishna Das; Al-Deyab, Salem S.; Dinda, Joydev Synthesis of gold(iii) ←gold(i)‒NHC through disproportionation: the role of gold(i)‒NHC in the induction of apoptosis in HepG2 cells New J. Chem., 2016, 40, 6289 |
| 7051338 | CIF | C3 H12 I N2 O | P 1 21/c 1 | 4.8139; 11.418; 13.689 90; 90.48; 90 | 752.4 | New Journal of Chemistry, 2000 |
| 7050066 | CIF | C6 H9 N3 S | P -1 | 8.413; 9.333; 10.846 68.71; 73.31; 76.7 | 752.5 | Kovács, Attila; Nemcsok, Dénes; Pokol, György; Mészáros Szécsényi, Katalin; Leovac, Vukadin M.; Jaćimović, Željko K.; Radosavljević Evans, Ivana; Howard, Judith A. K.; Tomić, Zoran D.; Giester, Gerald Structural, spectroscopic and computational studies of the HgL2Cl2 complex (L = 3,5-dimethyl-1-thiocarboxamide pyrazole) and the crystal structure of L New Journal of Chemistry, 2005, 29, 833 |
| 7059008 | CIF | C9 H12 Cl N11 O4 | P -1 | 7.2659; 9.2453; 11.8288 72.19; 86.574; 84.812 | 752.99 | Yang, Zhen-Li; Wang, Zhen; Cao, Wenli; Li, Tong; Yang, Junqing; Zhang, Jianguo New green energetic materials based on unsymmetrically substituted pyrazole-tetrazine and hydroperchlorate thereof New Journal of Chemistry, 2019 |
| 7052839 | CIF | C10 H7 N7 O11 | P 1 21 1 | 6.2866; 11.646; 10.3067 90; 93.367; 90 | 753.3 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
| 7053095 | CIF | C8 H6 Ag N3 | P 1 21/n 1 | 6.4496; 13.5953; 8.6168 90; 94.244; 90 | 753.49 | Abul Haj, Mohammad; Aakeröy, Christer B.; Desper, John Silver(i) coordination chemistry: from 1-D chains to molecular rectangles New Journal of Chemistry, 2013, 37, 204 |
| 7061220 | CIF | C16 F10 N2 S2 | P 1 21/n 1 | 4.3379; 16.178; 10.9464 90; 101.031; 90 | 754.01 | Costa, Letícia D.; Guieu, Samuel; Faustino, Maria do Amparo F.; Tomé, Augusto C. Straightforward synthesis of thiazolo[5,4-c]isoquinolines from dithiooxamide and 2-halobenzaldehydes New Journal of Chemistry, 2022, 46, 3602-3615 |
| 7054474 | CIF | C4 H6 N6 O4 | P 1 21/n 1 | 6.9708; 14.408; 7.8104 90; 105.99; 90 | 754.1 | Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R. Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles New J. Chem., 2015, 39, 1619 |
| 7055540 | CIF | C13 H12 Au Cl3 N3 | P -1 | 4.3231; 9.305; 19.116 87.056; 86.072; 79.91 | 754.7 | Nandy, Abhishek; Samanta, Tapastaru; Mallick, Sumana; Mitra, Partha; Seth, Saikat Kumar; Saha, Krishna Das; Al-Deyab, Salem S.; Dinda, Joydev Synthesis of gold(iii) ←gold(i)‒NHC through disproportionation: the role of gold(i)‒NHC in the induction of apoptosis in HepG2 cells New J. Chem., 2016, 40, 6289 |
| 7062627 | CIF | C14 H18 Cl12 Cu N8 O2 | P -1 | 5.8826; 11.8884; 12.3119 112.979; 96.81; 102.216 | 755.14 | Garazade, Ismayil M.; Gurbanov, Atash V.; Gomila, Rosa M.; Frontera, Antonio; Nunes, Ana V. M.; Mahmudov, Kamran T.; Pombeiro, Armando J. L. Spodium, halogen and hydrogen bonds in the reactivity of bis(2,4-bis(trichloromethyl)-1,3,5-triazapentadienato)-Zn(ii) New Journal of Chemistry, 2023, 47, 15856-15861 |
| 7056618 | CIF | C5 H6 B F3 N4 | P 1 21/n 1 | 8.1901; 6.215; 14.8496 90; 92.216; 90 | 755.3 | Yousaf, Muhammad; Yutronkie, Nathan J.; Castañeda, Raúl; Klein, Jacob A.; Brusso, Jaclyn Boratriazines: inducing luminescence through boron incorporation into a terpy-type framework New J. Chem., 2017 |
| 7060350 | CIF | C18 H13 Cl N2 Pt | P -1 | 8.2027; 10.2109; 10.6109 113.843; 96.348; 106.099 | 755.53 | Katkova, Svetlana A.; Luzyanin, Konstantin V.; Novikov, Alexander S.; Kinzhalov, Mikhail A. Modulation of luminescence properties for [cyclometalated]-PtII(isocyanide) complexes upon co-crystallisation with halosubstituted perfluorinated arenes New Journal of Chemistry, 2021, 45, 2948-2952 |
| 7057778 | CIF | C11 H10 Cu2 I2 N2 Se | P 1 21 1 | 9.5828; 8.4187; 9.7002 90; 105.088; 90 | 755.58 | Cargnelutti, Roberta; Delgado, Cássia P.; Cervo, Rodrigo; Tirloni, Bárbara; Burrow, Robert A.; Lang, Ernesto S. Synthesis and structural chemistry of CoII, CuII, CuI and PdII complexes containing a flexible monoselenoether ligand New Journal of Chemistry, 2018, 42, 17185 |
| 7052837 | CIF | C5 H9 N3 O3 | P 1 21/n 1 | 7.863; 13.001; 7.9711 90; 111.871; 90 | 756.2 | Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D. Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs New Journal of Chemistry, 2012, 36, 702 |
| 7062404 | CIF | C17 H14 Br N5 | P -1 | 5.5829; 8.3646; 16.4765 80.436; 87.527; 85.727 | 756.26 | Sharma, Kanika; Tittal, Ram Kumar; Lal, Kashmiri; Mathpati, Ramling S.; D., Ghule Vikas Fluorescent 7-azaindole N-linked 1,2,3-triazole: synthesis and study of antimicrobial, molecular docking, ADME and DFT properties New Journal of Chemistry, 2023, 47, 9077-9086 |
| 7053955 | CIF | C22 H16 O2 | P -1 | 7.508; 9.0339; 12.3483 82.421; 87.073; 65.899 | 757.85 | Badave, Kirti D.; Patil, Shalaka S.; Khan, Ayesha A.; Srinivas, Darbha; Butcher, Raymond J.; Gonnade, Rajesh G.; Puranik, Vedavati G.; Pinjari, Rahul V.; Gejji, Shridhar P.; Rane, Sandhya Y. Cu(ii) conjugation along the transformation of a vitamin K3 derivative to a dinaphthoquinone methide radical New Journal of Chemistry, 2014, 38, 277 |
| 7058976 | CIF | C15 H15 Mo N3 O5 | P -1 | 7.252; 10.1453; 11.3074 79.677; 75.793; 71.147 | 758.68 | Cvijanović, Danijela; Pisk, Jana; Pavlović, Gordana; Šišak-Jung, Dubravka; Matković-Čalogović, Dubravka; Cindrić, Marina; Agustin, Dominique; Vrdoljak, Višnja Discrete mononuclear and dinuclear compounds containing a MoO22+ core and 4-aminobenzhydrazone ligands: synthesis, structure and organic-solvent-free epoxidation activity New Journal of Chemistry, 2019, 43, 1791 |
| 7058905 | CIF | C5 H10 O6 | P 1 21/n 1 | 5.5661; 15.4167; 8.8545 90; 92.306; 90 | 759.2 | Arp, Fabian Felix; Ahn, Shin Hye; Bhuvanesh, Nattamai; Bluemel, Janet Selective Synthesis and Stabilization of Peroxides via Phosphine Oxides New Journal of Chemistry, 2019 |
| 7058313 | CIF | C4 H2 N6 O5 | P 1 21/c 1 | 6.0977; 8.2774; 15.1568 90; 97.006; 90 | 759.3 | Xiong, Hualin; Cheng, Guangbin; Zhang, Zaichao; Yang, Hongwei C8N12O10: a promising energetic compound with excellent detonation performance and desirable sensitivity New Journal of Chemistry, 2019, 43, 7784 |
| 7059610 | CIF | C10 H14 Br2 Cu2 N4 S2 | P 1 21/c 1 | 9.5738; 10.568; 7.7642 90; 104.678; 90 | 759.91 | Beheshti, Azizolla; Mousavifard, Elham Sadat; Zargar, Behrooz; Mayer, Peter; Rezatofighi, Seyedeh Elham Synthesis and dye adsorption studies of the {dibromo(1,1′-(1,2-ethanediyl)bis(3-methyl-imidazole-2-thione)dicopper(i)}n polymer and its conversion to CuO nanospheres for photocatalytic and antibacterial applications New Journal of Chemistry, 2020, 44, 8520-8537 |
| 7054833 | CIF | C32 H32 N2 Ni O2 S4 | P -1 | 6.4945; 11.1068; 11.7301 101.467; 102.098; 106.947 | 760.24 | Yadav, Manoj Kumar; Rajput, Gunjan; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai Rare intermolecular M⋯H‒C anagostic interactions in homoleptic Ni(ii)‒Pd(ii) dithiocarbamate complexes New J. Chem., 2015, 39, 5493 |
| 7059935 | CIF | C22 H22 N16 O14 | P -1 | 7.8751; 8.0958; 12.352 81.816; 80.771; 80.036 | 760.25 | Tang, Jie; Chen, Jieyi; Yang, Pengju; Yang, Hongwei; Cheng, Guangbin An efficient strategy for the preparation of insensitive energetic materials: intramolecular cyclization of picrylhydrazone into an indazole derivative New Journal of Chemistry, 2020, 44, 15849-15856 |
| 7057346 | CIF | C13 H9 F4 I2 N | P -1 | 8.9694; 9.0988; 9.4933 86.132; 83.927; 81.238 | 760.38 | Bedeković, Nikola; Stilinović, Vladimir; Friščić, Tomislav; Cinčić, Dominik Comparison of isomericmeta- andpara-diiodotetrafluorobenzene as halogen bond donors in crystal engineering New Journal of Chemistry, 2018, 42, 10584 |
| 7055016 | CIF | C15 H17 N2 S3 | P -1 | 6.6627; 9.345; 13.5348 98.497; 102.934; 107.792 | 760.54 | Magnan, François; Korobkov, Ilia; Brusso, Jaclyn Influence of substitution pattern and enhanced π-conjugation on a family of thiophene functionalized 1,5-dithia-2,4,6,8-tetrazocines New J. Chem., 2015, 39, 7272 |
| 7060749 | CIF | C3 H4 Mg N4 O6 | P 1 21/c 1 | 3.4912; 12.4624; 17.4963 90; 92.169; 90 | 760.7 | Wang, Yu; Xu, Siyu; Li, Heng; Ma, Haixia; Zhang, Yazhou; Guo, Zhaoqi Laser ignition of energetic complexes: impact of metal ion on laser initiation ability New Journal of Chemistry, 2021, 45, 12705-12710 |
| 7059103 | CIF | C9 H13 Cl2 N3 O4 Pt S | P -1 | 7.0238; 9.0811; 12.9083 91.147; 94.584; 111.834 | 760.73 | Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu. Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity New Journal of Chemistry, 2017, 41, 6840 |
| 7050421 | CIF | C10 H7 N | P 1 21/c 1 | 5.9188; 12.03; 11.026 90; 104.17; 90 | 761.2 | Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B. Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/ New Journal of Chemistry, 2003, 27, 140 |
| 7051901 | CIF | C13 H20 N4 O5 | P -1 | 6.793; 11.479; 11.615 117.05; 93.32; 105.24 | 761.5 | Formica, Mauro; Fusi, Vieri; Macedi, Eleonora; Paoli, Paola; Piersanti, Giovanni; Rossi, Patrizia; Zappia, Giovanni; Orlando, Pierfrancesco New branched macrocyclic ligand and its side-arm, two urea-based receptors for anions: synthesis, binding studies and crystal structure New Journal of Chemistry, 2008, 32, 1204 |
| 7063069 | CIF | C22 H30 Cl4 F2 N8 P4 | P -1 | 9.1703; 9.7421; 9.8703 74.561; 82.14; 63.676 | 761.65 | Elmas, Gamze; Okumuş, Aytuğ; Kılıç, Zeynel; Hökelek, Tuncer Phosphorus–nitrogen compounds. Part 73. Dispiromono and dispirobicyclotetraphosphazene derivatives: syntheses, and spectroscopic, crystallographic and thermal studies New Journal of Chemistry, 2024, 48, 5804-5819 |
| 7061253 | CIF | C19 H12 Cl N O S | P -1 | 7.3208; 9.0728; 12.5495 73.212; 81.338; 73.194 | 761.88 | Motornov, Vladimir A.; Tabolin, Andrey A.; Ioffe, Sema L. Oxidative [3+2]-annulation of nitroalkenes and azolium ylides in the presence of Cu(ii): efficient synthesis of [5,5]-annulated N-fused heterocycles New Journal of Chemistry, 2022, 46, 4134-4141 |
| 7054674 | CIF | C26 H18 Cu2 N6 O6 S4 | P -1 | 7.2488; 8.5638; 13.1244 83.205; 89.661; 70.551 | 762.35 | Hazra, Susanta; Karmakar, Anirban; Guedes da Silva, Maria de Fátima C.; Dlháň, L'ubor; Boča, Roman; Pombeiro, Armando J. L. Sulfonated Schiff base dinuclear and polymeric copper(ii) complexes: crystal structures, magnetic properties and catalytic application in Henry reaction New J. Chem., 2015, 39, 3424 |
| 7052359 | CIF | C17 H16 N4 O3 | P -1 | 8.3089; 8.9991; 11.1671 85.733; 69.174; 77.699 | 762.52 | Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals New Journal of Chemistry, 2006, 30, 1452 |
| 7052432 | CIF | C6 H6 N4 O4 | P 1 21/n 1 | 8.778; 5.62; 15.635 90; 98.504; 90 | 762.83 | Siri, Olivier; Braunstein, Pierre Tuning the synthesis of a dinitroaromatic towards a new trinitroaromatic stabilized energetic material New Journal of Chemistry, 2005, 29, 75 |
| 7050068 | CIF | C12 H8 Ag3 N3 O7 | P -1 | 8.1686; 10.4479; 10.8106 62.257; 69.159; 80.817 | 763.1 | Liu, Zheng; Liu, Ping; Chen, Yun; Wang, Jian; Huang, Meihua Synthesis, structures, and photoluminescent properties of two ligand unsupported silver(i) coordination polymers from isonicotinate anions New Journal of Chemistry, 2005, 29, 474 |
| 7059821 | CIF | C18 H22 N4 | P 1 21/n 1 | 7.075; 7.303; 14.865 90; 96.04; 90 | 763.8 | Nagarasu, Palaniyappan; Kundu, Anu; Pitchaimani, Jayaraman; Anthony, Savarimuthu Philip; Moon, Dohyun; Madhu, Vedichi Structure controlled solvatochromism and halochromic fluorescence switching of 2,2′-bipyridine based donor‒acceptor derivatives New Journal of Chemistry, 2020, 44, 14421-14428 |
| 7059449 | CIF | C13 H11 Br3 N2 O | P -1 | 6.4706; 7.4628; 16.4827 93.785; 94.273; 104.845 | 764.23 | Canımkurbey, Betül; Taşkan, Mustafa Can; Demir, Sevde; Duygulu, Ercan; Atilla, Devrim; Yuksel, Fatma Synthesis and investigation of the electrical properties of novel liquid-crystal phthalocyanines bearing triple branched alkylthia chains New Journal of Chemistry, 2020, 44, 7424-7435 |
| 7052536 | CIF | C16 H16 N2 O4 | P 1 | 6.1083; 10.3445; 12.3439 93.254; 100.417; 92.94 | 764.38 | Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond New Journal of Chemistry, 2011, 35, 156 |
| 7053291 | CIF | C19 H18 Cl N O | P -1 | 6.3219; 8.4477; 15.349 102.22; 92.54; 106.21 | 764.6 | Báthori, Nikoletta B.; Bombicz, Petra; Bourne, Susan A.; Venter, Gerhard A. Investigation of sublimation with and without dissociation in the chloride and nitrate salts of 4-(1-hydroxy-1,2-diphenylethyl)pyridine New Journal of Chemistry, 2010, 34, 405 |
| 7050746 | CIF | C20 H16 N4 | P -1 | 8.118; 9.361; 11.803 100.62; 101.57; 114.2 | 765 | Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz Supramolecular structures formed by 2-aminopyridine derivatives. New Journal of Chemistry, 2002, 26, 448 |
| 7062388 | CIF | C44 H30 N2 O4 | P -1 | 7.5507; 10.0972; 10.5074 86.191; 76.039; 79.92 | 765.18 | Zheng, Zihang; Ju, Zhengkun; Ma, Shuang; Liu, Zhiqi; Xiang, Wenxin; Chen, Jinqiu; Yang, Bo; Mu, Zifeng; Zhang, Jing; Li, Pan; Sheng, Peng Napthalene diimide derivative based organic cocrystal frameworks as cathode electrodes for stable lithium batteries New Journal of Chemistry, 2023, 47, 7476-7480 |
| 7062270 | CIF | C14 H12 Cl2 N2 O Pd S | P -1 | 7.4987; 9.433; 11.6092 101.126; 103.873; 98.613 | 765.5 | Das, Akash; Saha, Moumita; Mandal, Subrata; Das, Sanjib; Das Saha, Krishna; Mondal, Tapan K. New palladium(ii) and platinum(ii) complexes with an ONS donor azo-thioether pincer ligand: synthesis, characterization, protein binding study and in vitro cytotoxicity New Journal of Chemistry, 2023, 47, 4931-4943 |
| 7054949 | CIF | C10 H15 Ca N O9 P2 | P -1 | 6.9927; 8.0857; 14.201 101.016; 95.091; 101.324 | 766.12 | Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure New J. Chem., 2015, 39, 6611 |
| 7058374 | CIF | C20 H20.5 N0.5 O2 | P 1 | 8.3185; 9.3562; 11.345 84.54; 69.51; 68.012 | 766.3 | Kazem-Rostami, Masoud Optically active and photoswitchable Tröger's base analogs New Journal of Chemistry, 2019, 43, 7751 |
| 7056068 | CIF | B3 Be3 F4 Li O9 Sr3 | R 3 m :H | 10.3062; 10.3062; 8.3458 90; 90; 120 | 767.7 | Guo, Shu; Liang, Fei; Liu, Lijuan; Xia, Mingjun; Fang, Zhi; Wu, Ruofei; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian LiSr3Be3B3O9F4: A New Ultraviolet Nonlinear Optical Crystal for Fourth-harmonic Generation of Nd:YAG Lasers New J. Chem., 2017 |
| 7059753 | CIF | C12 H2 F6 O9 Yb | P -1 | 8.771; 8.9368; 11.531 67.313; 68.094; 75.535 | 767.76 | Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Ridenour, J. August Supramolecular assembly of lanthanide-2,3,5,6-tetrafluoroterephthalic acid coordination polymers via fluorine⋯fluorine interactions: a platform for luminescent detection of Fe3+ and nitroaromatic compounds New Journal of Chemistry, 2020, 44, 12317-12330 |
| 7061218 | CIF | C6 H4 Cl N S Se | P 1 21/n 1 | 7.8867; 5.5755; 17.6217 90; 97.319; 90 | 768.55 | Makarov, Alexander Yu.; Volkova, Yulia M.; Zikirin, Samat B.; Irtegova, Irina G.; Bagryanskaya, Irina Yu.; Gatilov, Yuri V.; Nefedov, Andrey A.; Zibarev, Andrey V. New 3,1,2,4-benzothiaselenadiazines, related π-heterocycles including Herz cations, radicals and molecular complexes, and Bunte salts New Journal of Chemistry, 2022, 46, 3687-3696 |
| 7060199 | CIF | C4 H5 B Li N3 O2 | C 1 c 1 | 5.9444; 17.4508; 7.4613 90; 96.637; 90 | 768.807 | Schopper, Nils; Sprenger, Jan A. P.; Zapf, Ludwig; Reiss, Guido J.; Ignat’ev, Nikolai V.; Finze, Maik Alkoxycyanoborates: metal salts and low-viscosity ionic liquids New Journal of Chemistry, 2021, 45, 14973-14987 |
| 7055756 | CIF | C17 H17 N3 S | P -1 | 8.66567; 9.3865; 10.4897 84.169; 87.2611; 64.997 | 769.26 | Markiewicz, Karolina H.; Zembko, Paula; Półtorak, Katarzyna; Misztalewska, Iwona; Wojtulewski, Sławomir; Majcher, Anna M.; Fornal, Emilia; Wilczewska, Agnieszka Z. Magnetic nanoparticles with chelating shells prepared by RAFT/MADIX polymerization New J. Chem., 2016, 40, 9223 |
| 7052969 | CIF | C32 H44 N4 O8 | P -1 | 5.0083; 9.048; 17.725 85.179; 82.023; 75.645 | 769.6 | Sleem, Hisham Fathy; Dawe, Louise Nicole; Georghiou, Paris Elias A tetraamido isophthaloyl-based macrocyclic calcium chloride and strontium chloride tritopic receptor New Journal of Chemistry, 2012, 36, 2451 |
| 7060940 | CIF | C14 H18 N Na O2 P2 | P -1 | 7.1413; 10.5119; 11.2705 106.58; 107.348; 90.391 | 770.08 | Panova, Yulia; Khristolyubova, Alexandra; Sushev, Vyacheslav; Zolotareva, Natalya; Baranov, Evgeny V.; Fukin, Georgii K.; Kornev, Alexander Rearrangements and Reductive Cleavage of 3а,6а-Diaza-1,4-diphosphapentalenes New Journal of Chemistry, 2021 |
| 7062782 | CIF | C30 H28 Ag2 N10 O8 | P -1 | 7.1071; 9.7716; 11.4905 75.939; 85.843; 85.518 | 770.53 | Gahlaut, Puneet Singh; Gautam, Deepak; Shekhawat, Bhawana; Kushwaha, Shivani; Jana, Barun Simultaneous N2 and N3 coordination of inverse triazolyl-pyridine ligands in Ag(i) complexes: synthesis, structure, and application in the A3 coupling reaction to propargylamine under solvent free and low catalyst loading conditions New Journal of Chemistry, 2023, 47, 19953-19962 |
| 7050548 | CIF | C8 H8 N2 O2 | C 1 2/c 1 | 13.6142; 4.5032; 13.1697 90; 107.263; 90 | 771.03 | Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen Hydrogen bond patterns in aromatic and aliphatic dioximes New J. Chem., 2003, 27, 1084-1094 |
| 7060544 | CIF | C36 H4 F20 N2 O2 | P -1 | 6.537; 10.866; 11.701 71.27; 89.53; 78.96 | 771.3 | Moussallem, Chady; Allain, Magali; Gohier, Frédéric; Frère, Pierre Preponderant role of pentafluorophenyl moieties for tuning the electronic properties of extended benzodifuran-azomethine derivatives New Journal of Chemistry, 2021, 45, 8647-8653 |
| 7056674 | CIF | C15 H17 Cl O S2 | P -1 | 5.835; 8.6412; 15.4578 85.662; 83.585; 86.652 | 771.32 | Kurva, Srinivas; Sriramoju, Vinodkumar; Madabhushi, Sridhar; Nanubolu, Jagadeesh Babu Synthesis of polysubstituted 3,4-dihydro-2H-thiopyrans by regioselective annulation of 3,3-disubstituted allylic alcohols with a β-oxodithioester New J. Chem., 2017 |
| 7055799 | CIF | C26 H26 Cu2 N6 O12 | P -1 | 7.5555; 9.9153; 11.7151 102.312; 108.492; 102.9 | 772.07 | Martins, Nuno M. R.; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L. Copper(ii) and iron(iii) complexes with arylhydrazone of ethyl 2-cyanoacetate or formazan ligands as catalysts for oxidation of alcohols New J. Chem., 2016, 40, 10071 |
| 7056899 | CIF | C38 H44 N2 | P -1 | 8.181; 9.014; 11.892 86.414; 70.448; 69.436 | 772.2 | Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties New Journal of Chemistry, 2018, 42, 3102 |
| 7059487 | CIF | C13 H13 I3 N2 | P -1 | 9.0754; 9.9135; 9.9267 69.799; 77.933; 67.701 | 772.34 | Yang, Songjie; Bristow, Jonathan C.; Addicoat, Matthew A.; Wallis, John D. One step conversion of 1,5-bis(dimethylamino)naphthalene to salts of “back to back” bis-acridine derivatives New Journal of Chemistry, 2020, 44, 9621-9625 |
| 7052082 | CIF | C18 H19 N3 O | P -1 | 8.1028; 10.4312; 10.4731 67.932; 76.578; 71.72 | 772.36 | Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution New Journal of Chemistry, 2007, 31, 429 |
| 7051048 | CIF | C22 H20 | P -1 | 10.259; 14.7368; 5.1617 93.601; 111.643; 85.992 | 772.88 | Takehiko Yamato; Naozumi Sakaue; Kan Tanaka; Hirohisa Tsuzuki Medium-sized cyclophanes, 55: Synthesis and conformational studies of [2.1.1]orthocyclophanes New Journal of Chemistry, 2001 |
| 7062387 | CIF | C42 H26 Cl2 N2 O4 | P -1 | 7.2003; 10.1086; 11.0066 94.52; 94.515; 103.41 | 772.95 | Zheng, Zihang; Ju, Zhengkun; Ma, Shuang; Liu, Zhiqi; Xiang, Wenxin; Chen, Jinqiu; Yang, Bo; Mu, Zifeng; Zhang, Jing; Li, Pan; Sheng, Peng Napthalene diimide derivative based organic cocrystal frameworks as cathode electrodes for stable lithium batteries New Journal of Chemistry, 2023, 47, 7476-7480 |
| 7059813 | CIF | C18 H20 O4 | P 1 21 1 | 11.1124; 5.2113; 13.3792 90; 93.648; 90 | 773.22 | Jiménez-Cruz, Juan C.; Guzmán-Mejía, Ramón; Juaristi, Eusebio; Sánchez-Antonio, Omar; García-Revilla, Marco A.; González-Campos, J. Betzabe; Aviña-Verduzco, Judit Preparation of aromatic γ-hydroxyketones by means of Heck coupling of aryl halides and 2,3-dihydrofuran, catalyzed by a palladium(ii) glycine complex under microwave irradiation New Journal of Chemistry, 2020, 44, 13382-13392 |
| 7061655 | CIF | C4 H N7 O3 | P 1 21/n 1 | 9.3585; 5.3944; 15.367 90; 94.035; 90 | 773.9 | Zhang, Qi; He, Chunlin; Pang, Siping Synthesis of heterocyclic (triazole, furoxan, furazan) fused pyridazine di-N-oxides via hypervalent iodine oxidation New Journal of Chemistry, 2022, 46, 14324-14327 |
| 7059757 | CIF | C12 H6 F6 Lu O9 | P -1 | 8.8727; 8.8936; 11.561 67.613; 67.712; 75.395 | 774.3 | Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Ridenour, J. August Supramolecular assembly of lanthanide-2,3,5,6-tetrafluoroterephthalic acid coordination polymers via fluorine⋯fluorine interactions: a platform for luminescent detection of Fe3+ and nitroaromatic compounds New Journal of Chemistry, 2020, 44, 12317-12330 |
| 7052093 | CIF | C21 H18 O | P -1 | 5.7983; 9.0444; 15.82 94.69; 100; 106.81 | 774.4 | Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P. ?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions New Journal of Chemistry, 2007, 31, 127 |
| 7054825 | CIF | C14 H16 N4 O8 | P 1 21/c 1 | 6.4203; 18.901; 6.5776 90; 104.022; 90 | 774.4 | Briceño, Alexander; Leal, Dayana; Díaz de Delgado, Graciela A novel example of double reactivity by either photochemical [2+2] or thermal additions of an ionic organic supramolecular assembly New J. Chem., 2015, 39, 4965 |
| 7060380 | CIF | C18 H14 O5 S | P -1 | 7.9204; 8.7629; 11.5108 93.616; 92.555; 103.286 | 774.55 | Li, Edward W.; Katinas, Jade; Jones, Marjorie A.; Hamaker, Christopher G. Structural characterization of naphthalene sulfonamides and a sulfonate ester and their in vitro efficacy against Leishmania tarentolae promastigotes New Journal of Chemistry, 2021, 45, 4791-4801 |
| 7058240 | CIF | C8 H7 N Se | P 1 21/c 1 | 5.988; 7.444; 17.488 90; 96.277; 90 | 774.85 | Nasim, Muhammad Jawad; Witek, Karolina; Kincses, Annamária; Abdin, Ahmad Yaman; Żesławska, Ewa; Marć, Małgorzata Anna; Gajdács, Márió; Spengler, Gabriella; Nitek, Wojciech; Latacz, Gniewomir; Karczewska, Elżbieta; Kieć-Kononowicz, Katarzyna; Handzlik, Jadwiga; Jacob, Claus Pronounced activity of aromatic selenocyanates against multidrug resistant ESKAPE bacteria New Journal of Chemistry, 2019, 43, 6021 |
| 7061408 | CIF | C42 H26 N2 O4 | P -1 | 7.1522; 8.3752; 13.2773 88.436; 79.276; 82.799 | 775.26 | Moret, Massimo; Gavezzotti, Angelo The crystalline state of rubrene materials: intermolecular recognition, isomorphism, polymorphism, and periodic bond-chain analysis of morphologies New Journal of Chemistry, 2022, 46, 7626-7637 |
| 7062034 | CIF | C15 H23 F3 O2 | P 1 21 1 | 6.197; 9.8989; 12.9485 90; 102.482; 90 | 775.5 | Gyrdymova, Yulia V.; Rumyantcev, Roman V.; Esaulkova, Yana L.; Belyaevskaya, Svetlana V.; Zarubaev, Vladimir V.; Kayumov, Airat R.; Rubtsova, Svetlana A. New trifluoromethylated sesquiterpenoids: synthesis, rearrangement, and biological activity New Journal of Chemistry, 2022, 46, 23165-23172 |
| 7062688 | CIF | F2 Mg2 O7 Pb2 Si2 | P b c n | 7.0395; 10.9134; 10.0979 90; 90; 90 | 775.77 | Zhang, Zhiyuan; Deng, Lihan; Xu, Die; Hu, Mei; Wu, Zhencheng; Su, Xin; Huang, Yineng Mg2Pb2Si2O7F2: a new lead-containing alkali earth metal silicate fluoride with a short cutoff edge New Journal of Chemistry, 2023, 47, 17413-17419 |
| 7053386 | CIF | C18 H13 Cl N O4 | P -1 | 7.4116; 9.874; 12.082 66.39; 73.94; 79.39 | 775.9 | Linares, Maholy; Briceño, Alexander Solid-state synthesis of head-to-tail photodimers from supramolecular assemblies directed by charge-assisted hydrogen bonds New Journal of Chemistry, 2010, 34, 587 |
| 7059474 | CIF | C18 H32 F6 N8 Ni O8 S2 | P -1 | 7.8741; 9.1095; 11.9118 102.589; 108.164; 96.805 | 776.15 | Zelenkov, Lev E.; Kuznetsov, Maxim L.; Andrusenko, Elena V.; Avdontceva, Margarita S.; Starova, Galina L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu. Nickel(ii)-mediated cyanamide‒pyrazole coupling highlights distinct reactivity of NCNR2 and NCR nitrile ligands New Journal of Chemistry, 2020, 44, 6979-6991 |
| 1567142 | CIF | C6 H8 N2 Ni O4 S | C m c m | 6.476; 7.2221; 16.615 90; 90; 90 | 777.09 | González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates New Journal of Chemistry, 2022, 46, 14786-14792 |
| 7052020 | CIF | C32 H22 Cl4 Cu2 N6 O4 | P -1 | 8.4188; 9.2762; 10.6495 83.019; 87.266; 70.3459 | 777.39 | Budzisz, Elzbieta; Lorenz, Ingo-Peter; Mayer, Peter; Paneth, Piotr; Szatkowski, Lukasz; Krajewska, Urszula; Rozalski, Marek; Miernicka, Magdalena Synthesis, crystal structure, theoretical calculation and cytotoxic effect of new Pt(ii), Pd(ii) and Cu(ii) complexes with pyridine-pyrazoles derivatives New Journal of Chemistry, 2008, 32, 2238 |
| 7051497 | CIF | C5 H5 I2 N | P 1 21/c 1 | 4.5303; 21.784; 8.0761 90; 102.729; 90 | 777.42 | Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides New Journal of Chemistry, 1999 |
| 7050997 | CIF | C20 H10 F6 | P -1 | 6.929; 7.308; 15.991 91.51; 102.16; 100.16 | 777.5 | Collings, Jonathan C.; Roscoe, Karl P.; Robins, Edward G.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Clark, Stewart J.; Marder, Todd B. Arene‒perfluoroarene interactions in crystal engineering 8: structures of 1:1 complexes of hexafluorobenzene with fused-ring polyaromatic hydrocarbons New Journal of Chemistry, 2002, 26, 1740-1746 |
| 7059432 | CIF | C4 H4 N4 O7 | P 1 21/c 1 | 8.549; 10.104; 9.1163 90; 99.01; 90 | 777.7 | Yan, Tingou; Cheng, Guangbin; Yang, Hongwei 1,3,4-Oxadiazole based thermostable energetic materials: synthesis and structure‒property relationship New Journal of Chemistry, 2020, 44, 6643-6651 |
| 7052503 | CIF | C28 H18 Co4 O14 | P -1 | 7.9541; 8.0955; 12.4315 86.127; 85.621; 77.462 | 778.05 | Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D. Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/ New Journal of Chemistry, 2004, 28, 527 |
| 7058887 | CIF | C17 H12 N4 O5 | P 1 21 1 | 7.7345; 7.2239; 13.9285 90; 90.6; 90 | 778.19 | Bej, Sourav; Das, Riyanka; Hirani, Harish; Ghosh, Somnath; Banerjee, Priyabrata “Naked eye” detection of CN- from aqueous phase and other extracellular matrices: An experimental and theoretical approach mimicking logic gate concept New Journal of Chemistry, 2019 |
| 7050673 | CIF | C18 H16 N2 S2 | P 1 21/n 1 | 5.5099; 8.5604; 16.5197 90; 92.699; 90 | 778.32 | Elsegood, Mark R. J.; Holmes, Kathryn E.; Kelly, Paul F.; Parr, Jonathan; Stonehouse, Julia M. The preparation and structure of novel sulfimide systems; X-ray crystal structures of 1,4-(PhS{NH})2C6H4 (and dihydrate), 1,2-(PhS{NH})(PhS)C6H4·H2O and of [Ph2SNH] and its hydrate New Journal of Chemistry, 2002, 26, 202 |
| 7062844 | CIF | C18 H10 Co O8 | P 1 21/c 1 | 4.4234; 13.3689; 13.1637 90; 90.391; 90 | 778.43 | Zhang, Xiaoyu; Qin, Tianrui; Xiang, Ruifang; Dong, Xiuyan; Sakiyama, Hiroshi; Muddassir, Mohd.; Pan, Ying Impact of N-donor auxiliary ligands on three new Co(ii)-based coordination polymers with symmetrical tetracarboxylate ligands: a magnetism study New Journal of Chemistry, 2023, 47, 20426-20434 |
| 7057428 | CIF | C28 H36 N10 O2 Pd S2 | P -1 | 8.4859; 10.4674; 10.4763 62.218; 71.741; 78.431 | 780.19 | Haribabu, Jebiti; Tamizh, Manoharan Muthu; Balachandran, Chandrasekar; Arun, Yuvaraj; Bhuvanesh, Nattamai S. P.; Endo, Akira; Karvembu, Ramasamy Synthesis, structures and mechanistic pathways of anticancer activity of palladium(ii) complexes with indole-3-carbaldehyde thiosemicarbazones New Journal of Chemistry, 2018, 42, 10818 |
| 7056443 | CIF | C12 H18 Cu N4 O7 | P -1 | 8.9476; 9.2599; 10.2507 88.279; 74.957; 72.294 | 780.25 | Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands New J. Chem., 2017 |
| 7054656 | CIF | C32 H40 N6 O8 | P -1 | 4.9161; 8.0077; 20.828 87.266; 88.665; 72.608 | 781.5 | Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John Molecular electrostatic potential dependent selectivity of hydrogen bonding New J. Chem., 2015, 39, 822 |
| 7054826 | CIF | C7 H8 N2 O4 | P 1 21/c 1 | 7.646; 7.48; 13.756 90; 96.521; 90 | 781.6 | Briceño, Alexander; Leal, Dayana; Díaz de Delgado, Graciela A novel example of double reactivity by either photochemical [2+2] or thermal additions of an ionic organic supramolecular assembly New J. Chem., 2015, 39, 4965 |
| 7061650 | CIF | C4 Cl2 N4 O4 | P 1 21/n 1 | 9.121; 5.9953; 14.557 90; 100.853; 90 | 781.78 | Zhang, Qi; He, Chunlin; Pang, Siping Synthesis of heterocyclic (triazole, furoxan, furazan) fused pyridazine di-N-oxides via hypervalent iodine oxidation New Journal of Chemistry, 2022, 46, 14324-14327 |
| 7054950 | CIF | C10 H17 N O10 P2 Sr | P -1 | 6.0359; 8.0803; 16.5511 93.878; 95.273; 102.285 | 782.25 | Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure New J. Chem., 2015, 39, 6611 |
| 7055609 | CIF | C24 H20 La2 N3 O24 | P -1 | 8.3712; 9.8819; 10.268 105.245; 105.311; 93.668 | 782.26 | Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Lough, Alan J.; Knee, Christopher S. Eight rare earth metal organic frameworks and coordination polymers from 2-nitroterephthlate: syntheses, structures, solid-state luminescence and an unprecedented topology New J. Chem., 2016, 40, 7338 |
| 7061634 | CIF | C12 H12 F2 N2 O2 S4 | P -1 | 8.2628; 9.933; 10.3705 93.322; 107.069; 103.852 | 782.42 | Rogozhin, Anton F.; Ilichev, Vasily A.; Fagin, Anatoly A.; Rumyantcev, Roman V.; Fukin, Georgy K.; Yablonskiy, Artem N.; Andreev, Boris A.; Bochkarev, Mikhail N. Novel ditopic 2-mercaptothiazoles and their sodium salts: synthesis, structural diversity and luminescence New Journal of Chemistry, 2022, 46, 13987-13995 |
| 7053235 | CIF | C11 H12 Cl3 N2 O2 P S | P -1 | 7.525; 7.8787; 14.2239 99.852; 100.646; 104.192 | 782.49 | Betzl, Wolfgang; Hettstedt, Christina; Karaghiosoff, Konstantin New anellated 4H-1,4,2-diazaphospholes New Journal of Chemistry, 2013, 37, 481 |
| 7054385 | CIF | C16 H14 B2 F4 N2 O2 | P 1 21/c 1 | 16.417; 5.4987; 9.0065 90; 105.664; 90 | 782.8 | Guieu, Samuel; Cardona, Francisco; Rocha, João; Silva, Artur M. S. Luminescent bi-metallic fluoroborate derivatives of bulky salen ligands New J. Chem., 2014, 38, 5411 |
| 7054478 | CIF | C4 H2 Cl2 N4 O3 | P 1 21/n 1 | 8.2678; 11.2186; 8.5693 90; 99.912; 90 | 782.97 | Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R. Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles New J. Chem., 2015, 39, 1619 |
| 7059403 | CIF | K0 Mg O7 P2 Rb2 | P n m a | 15.6; 5.237; 9.588 90; 90; 90 | 783 | Qian, Zhen; Wu, Hongping; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng Synthesis, structure and characterization of three new Mg-containing phosphates with deep-UV cut-off edges New Journal of Chemistry, 2020, 44, 6771-6777 |
| 7054070 | CIF | C5 H26 B9 N4 S | P -1 | 8.4373; 9.5358; 10.6711 91.896; 105.717; 107.104 | 784 | Stogniy, Marina Yu.; Sivaev, Igor B.; Godovikov, Ivan A.; Starikova, Zoya A.; Bregadze, Vladimir I.; Qi, Shicheng Synthesis of new ω-amino- and ω-azidoalkyl carboranes New Journal of Chemistry, 2013, 37, 3865 |
| 7059102 | CIF | C10 H13 Cl2 F3 N2 O2 Pt S | P -1 | 7.1487; 8.918; 13.5059 82.385; 87.679; 66.909 | 785 | Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu. Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity New Journal of Chemistry, 2017, 41, 6840 |
| 7058671 | CIF | C20 H11 F O2 Se | P -1 | 7.9915; 9.0274; 11.517 103.912; 101.386; 93.706 | 785.11 | Jardim, Guilherme A. M.; Bozzi, Ícaro A. O.; Oliveira, Willian X. C.; Mesquita-Rodrigues, Camila; Menna-Barreto, Rubem F. S.; Kumar, Ramar A.; Gravel, Edmond; Doris, Eric; Braga, Antonio L.; da Silva Júnior, Eufrânio N. Copper complexes and carbon nanotube‒copper ferrite-catalyzed benzenoid A-ring selenation of quinones: an efficient method for the synthesis of trypanocidal agents New Journal of Chemistry, 2019, 43, 13751 |
| 7060967 | CIF | C14 H22 Cu N2 O7 | P 1 21 1 | 11.386; 5.6909; 12.4062 90; 102.327; 90 | 785.35 | Wu, Jialu; Li, Bo; Wang, Hong; Lai, Yingzhen; Ye, Yue; Zou, Yongkang; Tian, Jumei; Xu, Yaohua How the magnetic field impacts the chiroptical activities of helical copper enantiomers New Journal of Chemistry, 2021, 45, 20021-20027 |
| 7057366 | CIF | C18 H17 N4 | P -1 | 6.8527; 9.1813; 13.1091 86.834; 80.616; 74.983 | 785.88 | Takahashi, Yusuke; Tsuchiya, Naoya; Miura, Youhei; Yoshioka, Naoki Magneto-structural correlation of cyano-substituted 3-tert-butyl-1-phenyl-1,2,4-benzotriazin-4-yl: spin transition behaviour observed in a 6-cyano derivative New Journal of Chemistry, 2018, 42, 9949 |
| 7062446 | CIF | C10 H19 N7 O5 S | P -1 | 6.849; 9.0017; 14.0341 92.744; 98.751; 112.305 | 785.89 | Karthick, Kettalu Ananthan; Shankar, Bhaskaran; Gayathri, Santhalingam; Aravind, Manikka Kubendran; Ashokkumar, Balasubramaniem; Tamilselvi, Arunachalam Dual responsive pyridoxal-AHMT based fluorescent sensor towards zinc(ii) and mercury(ii) ions and its bioimaging application New Journal of Chemistry, 2023, 47, 9427-9439 |
| 7050809 | CIF | C42 H0 N2 O2 | P -1 | 6.7388; 8.7259; 14.5005 103.643; 94.729; 106.122 | 785.96 | Tanaka, Koichi; Asami, Masaya; Scott, Janet L. A novel chromogenic host compound that shows sensitive color change upon inclusion crystallization New Journal of Chemistry, 2002, 26, 378-380 |
| 7055728 | CIF | C10 H20 O2 Se Si2 | P -4 | 11.0742; 11.0742; 6.4127 90; 90; 90 | 786.44 | Masuda, Toshiyuki; Inagaki, Yusuke; Momma, Hiroyuki; Kwon, Eunsang; Setaka, Wataru Facile synthesis of 2,5-bis(silyl)selenophene-1,1-dioxide and its photophysical properties New J. Chem., 2016, 40, 8593 |
| 7053050 | CIF | C6 H9 N3 O3 | P 1 21/n 1 | 8.298; 15.1999; 12.458 90; 149.966; 90 | 786.5 | Belmar, Julio; Quezada, José; Jiménez, Claudio A.; Díaz-Gallifa, Pau; Pasán, Jorge; Ruiz-Pérez, Catalina Synthesis, crystal structures and tautomerism in novel oximes based on hydroxyalkylpyrazolones New Journal of Chemistry, 2013, 37, 2002 |
| 7059429 | CIF | C10 H2 N12 O10 | P 1 21/c 1 | 12.622; 5.8838; 11.1302 90; 107.75; 90 | 787.24 | Yan, Tingou; Cheng, Guangbin; Yang, Hongwei 1,3,4-Oxadiazole based thermostable energetic materials: synthesis and structure‒property relationship New Journal of Chemistry, 2020, 44, 6643-6651 |
| 7060966 | CIF | C14 H22 Cu N2 O7 | P 1 21 1 | 11.3916; 5.69116; 12.43561 90; 102.195; 90 | 788.027 | Wu, Jialu; Li, Bo; Wang, Hong; Lai, Yingzhen; Ye, Yue; Zou, Yongkang; Tian, Jumei; Xu, Yaohua How the magnetic field impacts the chiroptical activities of helical copper enantiomers New Journal of Chemistry, 2021, 45, 20021-20027 |
| 7062473 | CIF | C17 H17 F2 N3 O2 | P -1 | 7.85; 10.152; 10.835 108.912; 101.164; 96.073 | 788.1 | Zhao, Wei; Xuan, Liangming; Liu, Yang; Yin, Jiayi; Wang, Haifeng; Yan, Qiongjiao; Wang, Wei; Huang, Jin; Chen, Fener Photoinduced tandem radical cyclization/heteroarylation of N-allylbromodifluoroacetamides with quinoxalin-2(1H)-ones or coumarins under metal- and photocatalyst-free conditions New Journal of Chemistry, 2023, 47, 10744-10750 |
| 7059213 | CIF | C20 H14 O6 | P -1 | 8.1166; 9.7387; 11.3513 70.89; 69.248; 77.97 | 788.47 | Asthana, Sharad Kumar; Pandey, Abha; Kumar, Ajit; Upadhyay, K. K. An incisive optical recognition of monohydrogen phosphate by a fluorescein-based chemodosimeter New Journal of Chemistry, 2020, 44, 2201-2205 |
| 7053431 | CIF | C30 H40 N4 O10 Zn2 | P -1 | 7.889; 9.822; 10.928 87.205; 86.952; 69.015 | 789.08 | Khatua, Snehadrinarayan; Kang, Jina; Churchill, David G. Direct dizinc displacement approach for efficient detection of Cu2+ in aqueous media: acetate versus phenolate bridging platforms New Journal of Chemistry, 2010, 34, 1163 |
| 7063065 | CIF | C18 H8 Br2 N2 | P -1 | 6.7908; 9.4219; 13.421 80.129; 79.462; 70.322 | 789.3 | Ali, Hasrat; van Lier, Johan E. gem-Dibromovinyl phthalonitriles: synthesis, structure elucidation, Hirshfeld surface analysis and energy framework calculations New Journal of Chemistry, 2024, 48, 6350-6366 |
| 7062929 | CIF | H4.2 Mn6.75 O18.845 V4 | P 63 m c | 13.1893; 13.1893; 5.2408 90; 90; 120 | 789.54 | Shvanskaya, Larisa V.; Krikunova, Polina V.; Vasilchikova, Tatyana M.; Borovikova, Elena Y.; Volkova, Olga S.; Vasiliev, Alexander N. Crystal structure, infrared spectroscopy and thermodynamic properties of a manganese member of the ellenbergerite family New Journal of Chemistry, 2024, 48, 1952-1957 |
| 1544798 | CIF | C18 H15 Mo N O5 | P -1 | 7.6444; 9.9107; 11.0535 72.13; 82.196; 88.111 | 789.61 | Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions New J. Chem., 2017, 41, 594 |
| 7059972 | CIF | C19 H13 N3 O3 | P 1 21 1 | 4.98087; 14.0357; 11.32877 90; 94.4463; 90 | 789.611 | Younes, Eyad A.; Hussein, Nour; Shtaiwi, Majed; Shahrokhi, Farshid; Abu Safieh, Kayed A.; Zhao, Yuming N-(Cyano(naphthalen-1-yl)methyl)benzamides: synthesis, crystal structures, and colorimetric sensing of fluoride anions New Journal of Chemistry, 2020, 44, 16546-16556 |
| 7059070 | CIF | C20 H13 Cl S | P -1 | 5.5355; 11.3824; 13.4351 107.316; 94.243; 99.6 | 789.92 | Vaddamanu, Moulali; Velappan, Kavitha; Prabusankar, Ganesan Highly active mesoionic chalcogenone zinc(ii) derivatives for C‒S cross-coupling reactions New Journal of Chemistry, 2020, 44, 129-140 |
| 7052336 | CIF | C30 H44 N8 Ni | P -1 | 8.202; 9.5615; 10.9335 68.098; 84.437; 84.412 | 790.07 | Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions New Journal of Chemistry, 2006, 30, 1403 |
| 7054529 | CIF | C9 H8 N12 O8 | P -1 | 8.0665; 8.3119; 13.9189 90.693; 104.018; 118.084 | 790.11 | Wu, Bo; Wang, Zhixin; Yang, Hongwei; Lin, Qiuhan; Ju, Xuehai; Lu, Chunxu; Cheng, Guangbin Synthesis and characterization of a new family of energetic salts based on a guanidinium cation containing a picryl moiety New J. Chem., 2015, 39, 893 |
| 7059257 | CIF | C32 H30 Cl2 N6 O8 V2 | P -1 | 6.8992; 10.718; 11.0208 103.797; 92.767; 91.011 | 790.15 | Biswas, Nirmalendu; Bera, Sachinath; Sepay, Nayim; Pal, Amrita; Halder, Tanmoy; Ray, Sudipta; Acharyya, Swarnali; Biswas, Anup Kumar; Drew, Michael G. B.; Ghosh, Tapas Simultaneous formation of non-oxidovanadium(iv) and oxidovanadium(v) complexes incorporating phenol-based hydrazone ligands in aerobic conditions New Journal of Chemistry, 2020, 44, 3700-3716 |
| 7062395 | CIF | C21 H14 N2 O | P 1 21 1 | 9.03801; 6.438; 13.5879 90; 90.0399; 90 | 790.635 | Holakovský, Roman; Just, David; Eigner, Václav; Jakubec, Martin; Cuřínová, Petra Binaphthalene-based cyclic homochiral ureas and their structure-related properties New Journal of Chemistry, 2023, 47, 8515-8523 |
| 7051609 | CIF | C20 H8 N6 | P 1 21/n 1 | 8.6134; 6.9065; 13.2991 90; 90.268; 90 | 791.13 | Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K. Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer New Journal of Chemistry, 2009, 33, 545 |
| 7057391 | CIF | C30 H44 Cu2 N4 O8 | P -1 | 8.654; 8.757; 11.861 101.973; 101.335; 109.734 | 792.2 | Maity, Tithi; Mandal, Haridas; Bauzá, Antonio; Samanta, Bidhan Chandra; Frontera, Antonio; Seth, Saikat Kumar Quantifying conventional C‒H⋯π(aryl) and unconventional C‒H⋯π(chelate) interactions in dinuclear Cu(ii) complexes: experimental observations, Hirshfeld surface and theoretical DFT study New Journal of Chemistry, 2018, 42, 10202 |
| 7053845 | CIF | C40 H36 F2 N4 | P -1 | 7.1105; 9.868; 12.576 73.23; 78.56; 70.79 | 792.6 | Javed, Iqbal; Khurshid, Ayub; Arshad, Muhammad Nadeem; Wang, Yue Photophysical and electrochemical properties and temperature dependent geometrical isomerism in alkyl quinacridonediimines New Journal of Chemistry, 2014, 38, 752 |
| 7054550 | CIF | C4 H16 Fe4 N16 O14 S8 | P -1 | 6.2712; 10.4132; 12.1912 86.462; 88.363; 87.613 | 793.65 | Sanina, Nataliya A.; Aldoshin, Sergey M.; Shmatko, Natal'ya Yu.; Korchagin, Denis V.; Shilov, Gennadii V.; Knyazkina, Ekaterine V.; Ovanesyan, Nikolay S.; Kulikov, Alexander V. Nitrosyl iron complexes with enhanced NO donating ability: synthesis, structure and properties of a new type of salt with the DNIC cations [Fe(SC(NH2)2)2(NO)2]+ New J. Chem., 2015, 39, 1022 |
| 7052357 | CIF | C17 H15 N5 O4 | P -1 | 6.8245; 9.5538; 12.6278 77.174; 84.4; 82.637 | 794.13 | Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals New Journal of Chemistry, 2006, 30, 1452 |
| 7050394 | CIF | C24 H40 Cl2 N6 O12 | P -1 | 8.917; 9.765; 10.26 90.08; 111.32; 106.14 | 794.2 | G.Ambrosi; M.Formica; L.Giorgi; S.Lucarini; P.Paoli; P.Rossi New J.Chem.(Nouv.J.Chim.), 2004 |
| 7053192 | CIF | C40 H38 N4 O2 | P 1 | 6.5431; 10.6318; 12.1564 76.976; 74.585; 86.92 | 794.25 | Marets, N.; Bulach, V.; Hosseini, M. W. Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units New Journal of Chemistry, 2013, 37, 3549 |
| 7063194 | CIF | C8 H6 Cl N6 O9 Ru | P -1 | 11.832; 10.309; 7.057 100.36; 103.78; 73.31 | 795 | Alhadhrami, Abdulrahman Nano-Crystallites of Ruthenium(III) Violurate Complex: Synthesis, Characterization, PXRD and DFT Structural Analysis. DNA/ HSA -Binding, Antiviral Activity Against COVID-19 and Molecular Docking Study New Journal of Chemistry, 2024 |
| 7062903 | CIF | C15 H15 N O10 | P -1 | 7.4691; 10.2107; 11.3913 71.336; 78.812; 77.041 | 795.04 | Escalona, Ana; Heinemann, Frank W.; Briceño, Alexander; Alvarado, Ysaias J.; Paz, José Luis; Lossada, Carla; González-Paz, Lenin; Toro, Robert; Henao, José Antonio Hydrogen-bond-assisted topochemical synthesis of a multivalent zwitterionic tetramer via concomitant cross- and homo [2+2] photocycloadditions. Theoretical antiviral activity against SARS-CoV-2 New Journal of Chemistry, 2023, 47, 19925-19932 |
| 7055186 | CIF | C14 H10 Ag F3 N2 O5 S | P -1 | 8.404; 9.573; 10.905 91.915; 111.122; 101.924 | 795.1 | Banerjee, Kaustuv; Biradha, Kumar Two-dimensional coordination polymers and metal‒organic gels of symmetrical and unsymmetrical dipyridyl β-diketones: luminescence, dye absorption and mechanical properties New J. Chem., 2016, 40, 1997 |
| 7053191 | CIF | C40 H38 N4 O2 | P 1 | 6.5426; 10.6326; 12.1705 77.018; 74.588; 87.095 | 795.3 | Marets, N.; Bulach, V.; Hosseini, M. W. Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units New Journal of Chemistry, 2013, 37, 3549 |
| 7057679 | CIF | C3 H4 N9 Na O3 | P b c m | 8.361; 15.124; 6.2921 90; 90; 90 | 795.65 | Zhao, Gang; He, Chunlin; Gao, Haixiang; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M. Improving the density and properties of nitrogen-rich scaffolds by the introduction of a C‒NO2 group New Journal of Chemistry, 2018, 42, 16162 |
| 7056201 | CIF | C16 H17 N2 O4 P | P -1 | 9.5986; 9.7691; 10.0811 102.586; 97.413; 116.651 | 796.22 | Sudhapriya, Narayanasamy; Balachandran, Chandrasekar; Awale, Suresh; Perumal, Paramasivan Thirumalai Sn(II)-mediated facile approach for the synthesis of 2-aryl-2H-indazole-3-phosphonates and their anticancer activity New J. Chem., 2017 |
| 7061119 | CIF | C16 H19 N3 O2 S | P 1 21 1 | 9.6424; 8.0087; 10.9078 90; 109.047; 90 | 796.22 | Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B. Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures New Journal of Chemistry, 2022, 46, 1080-1086 |
| 7058371 | CIF | B3 Ca4 K O9 | A m a 2 | 10.621; 11.489; 6.534 90; 90; 90 | 797 | Ren, Peng; Yang, Yun; Li, Hao; Yang, Zhihua; Pan, Shilie Two alkali calcium borates exhibiting second harmonic generation and deep-UV cutoff edges New Journal of Chemistry, 2019, 43, 9354 |
| 7061444 | CIF | C16 H11 Cl N2 O S2 | P -1 | 8.1736; 8.9413; 12.3309 105.112; 93.31; 111.564 | 797.19 | Dou, Li; Shi, Huabin; Niu, Xue; Zhang, Hong; Zhang, Kankan; Wu, Zhibing Design, synthesis and antifungal mechanism of novel acetophenone derivatives containing 1,3,4-thiadiazole-2-thioethers New Journal of Chemistry, 2022, 46, 9017-9023 |
| 7061108 | CIF | C17 H21 N3 O2 | P 1 21 1 | 9.684; 7.971; 10.899 90; 108.39; 90 | 798.342 | Todorova, Stanislava E.; Rusew, Rusi I.; Petkova, Zhanina S.; Shivachev, Boris L.; Nikolova, Rositsa P.; Kurteva, Vanya B. Acylpyrazolones possessing a heterocyclic moiety in the acyl fragment: intramolecular vs. intermolecular zwitterionic structures New Journal of Chemistry, 2022, 46, 1080-1086 |
| 7052106 | CIF | C5 H11 N3 O4 | P 1 21/c 1 | 6.491; 18.388; 7.23 90; 112.18; 90 | 799.1 | Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates New Journal of Chemistry, 2007, 31, 287 |
| 7053128 | CIF | C6 H9 N5 O2 | P 1 21/a 1 | 10.619; 5.43; 14.639 90; 108.69; 90 | 799.6 | Boland, Yves; Safin, Damir A.; Tinant, Bernard; Babashkina, Maria G.; Marchand-Brynaert, Jacqueline; Garcia, Yann Routes to novel mono- and bis-tetrazole compounds: synthesis, spectroscopic and structural characterization New Journal of Chemistry, 2013, 37, 1174 |
| 7058372 | CIF | B3 Ca4 K0.59 O9 Rb0.41 | A m a 2 | 10.62; 11.543; 6.523 90; 90; 90 | 799.6 | Ren, Peng; Yang, Yun; Li, Hao; Yang, Zhihua; Pan, Shilie Two alkali calcium borates exhibiting second harmonic generation and deep-UV cutoff edges New Journal of Chemistry, 2019, 43, 9354 |
| 7057878 | CIF | C17 H11 Cl N2 O3 | P -1 | 8.0653; 8.4613; 12.124 99.73; 96.54; 97.78 | 800 | Zhang, Honghui; Liu, Rongfang; Liu, Jialin; Fan, Binbin; Li, Ruifeng; Qiao, Yan; Zhou, Rong Chemoselective phosphine-catalyzed cyanoacylation of α-dicarbonyl compounds: a general method for the synthesis of cyanohydrin esters with one quaternary stereocenter New Journal of Chemistry, 2018, 42, 19720 |
| 7062994 | CIF | C17 H11 Cl I N3 O | P -1 | 7.21715; 7.40565; 15.40204 82.061; 79.0302; 89.6967 | 800.23 | Govdi, Anastasia I.; Danilkina, Natalia A.; Shtyrov, Andrey A.; Ryazantsev, Mikhail N.; Kim, Mia D.; Kryukova, Mariya A.; Balova, Irina A. Cu-catalyzed cycloaddition of aryl azides to 1-iodobuta-1,3-diynes: an experimental and quantum chemical study of unusual regiochemistry New Journal of Chemistry, 2024, 48, 4831-4845 |
| 7050323 | CIF | C14 H10 Co N8 O2 | C 1 2/m 1 | 17.329; 7.318; 6.679 90; 109.1; 90 | 800.4 | Nirmalendu Ray Chaudhuri; Debajyoti Ghoshal; Tian-Huey Lu; Tapas Kumar Maji; Golam Mostafa; Joan Ribas; E.Zangrando Synthesis, crystal structure and magnetic behavior of three polynuclear complexes, [Co(pyo)2(dca)2]n, [Co3(ac)4(bpe)3(dca)2]n and [{Co(male)(H2O)2}(H2O)]n (pyo, pyridine-N-oxide; dca, dicyanamide; ac, acetate; bpe, 1,2-bis-(4-pyridyl)ethane and male, maleate) New J.Chem.(Nouv.J.Chim.), 2004 |
| 7050654 | CIF | C7 H5 Fe N O5 | P 1 21/c 1 | 8.791; 10.577; 8.663 90; 95.63; 90 | 801.6 | Zeng, Ming-Hua; Gao, Song; Yu, Xiao-Lan; Chen, Xiao-Ming Crystal structure and magnetic properties of a new three-dimensional coordination polymer constructed from (4,4) layers based on dimeric iron(ii) subunits New Journal of Chemistry, 2003, 27, 1599 |
| 7061335 | CIF | C20 H12 Cu N2 O4 | P 1 21/c 1 | 4.8617; 13.5497; 12.2556 90; 96.467; 90 | 802.2 | Podjed, Nina; Modec, Barbara; Clérac, Rodolphe; Rouzières, Mathieu; Alcaide, María M.; López-Serrano, Joaquín Structural diversity and magnetic properties of copper(ii) quinaldinate compounds with amino alcohols New Journal of Chemistry, 2022, 46, 6899-6920 |
| 7061366 | CIF | C5 H8 I5 N2 S | P -1 | 7.601; 9.536; 11.912 101.98; 104.86; 97.03 | 802.2 | Garau, Alessandra; Aragoni, M. Carla; Arca, Massimiliano; Caltagirone, Claudia; Demartin, Francesco; Isaia, Francesco; Lippolis, Vito; Pivetta, Tiziana A new assembly of diiodine molecules at the 1,3-dimethylimidazole-2-thione (Me2ImS) template: crystal structure of (Me2ImS)2·(I2)5 New Journal of Chemistry, 2022, 46, 6870-6877 |
| 7054303 | CIF | C19 H19 N3 O3 | P -1 | 5.079; 12.8141; 13.2671 70.308; 80.767; 88.005 | 802.26 | Davis, Aaron B.; Lambert, Rachel E.; Fronczek, Frank R.; Cragg, Peter J.; Wallace, Karl J. An activated coumarin-enamine Michael acceptor for CN− New J. Chem., 2014, 38, 4678 |
| 7058328 | CIF | C15 H15 N3 O7 | P 1 21 1 | 7.435; 7.636; 14.212 90; 95.87; 90 | 802.6 | Sharada, Durgam; Saha, Arijit; Saha, Binoy K. Charge transfer complexes as colour changing and disappearing‒reappearing colour materials New Journal of Chemistry, 2019, 43, 7562 |
| 7057067 | CIF | C15 H14 F2 N6 O6 | P -1 | 9.1192; 10.0601; 10.0983 105.212; 112.72; 95.794 | 803.01 | Nechipadappu, Sunil Kumar; Ramachandran, Jeeshma; Shivalingegowda, Naveen; Lokanath, Neratur Krishnappagowda; Trivedi, Darshak R. Synthesis of cocrystals/salts of flucytosine: Structure and stability New Journal of Chemistry, 2018, 42, 5433 |
| 7052338 | CIF | C30 H44 N8 Pt | P -1 | 8.2909; 9.4857; 10.9177 70.191; 84.936; 85.713 | 803.74 | Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions New Journal of Chemistry, 2006, 30, 1403 |
| 7058951 | CIF | C16 H16 Cu N26 O18 | P -1 | 8.613; 9.278; 11.643 106.515; 101.929; 107.829 | 804.01 | Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions New Journal of Chemistry, 2019 |
| 7062552 | CIF | C15 H11 Cl3 N2 O4 | P 1 21 1 | 6.5963; 12.8953; 9.5356 90; 97.461; 90 | 804.24 | Nguyen Tran, Anh Thu; Wu, Zhiyuan; Chung, Duy T. M.; Nalaoh, Phattananawee; Lindsey, Jonathan S. Synthesis of model southern rim structures of photosynthetic tetrapyrroles and phyllobilins New Journal of Chemistry, 2023, 47, 13626-13637 |
| 7053859 | CIF | C12 H19 Cl2 N3 O Pd | P -1 | 8.9793; 9.1591; 11.2703 69.9746; 77.7173; 68.1433 | 804.39 | Mariconda, Annaluisa; Grisi, Fabia; Costabile, Chiara; Falcone, Salvatore; Bertolasi, Valerio; Longo, Pasquale Synthesis, characterization and catalytic behaviour of a palladium complex bearing a hydroxy-functionalized N-heterocyclic carbene ligand New Journal of Chemistry, 2014, 38, 762 |
| 7053376 | CIF | C18 H15 N2 P Se | P -1 | 9.108; 9.656; 10.017 103.676; 107.108; 95.654 | 804.6 | Hua, Guoxiong; Fuller, Amy L.; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek Synthesis and X-ray structures of new phosphorus‒selenium heterocycles with an E‒P(Se)‒E′ (E, E′ = N, S, Se) linkage New Journal of Chemistry, 2010, 34, 1565 |
| 7052337 | CIF | C30 H44 N8 Pd | P -1 | 8.27; 9.5086; 10.937 70.1; 85.07; 85.64 | 804.7 | Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions New Journal of Chemistry, 2006, 30, 1403 |
| 7057365 | CIF | C14 H11 F4 I2 N | P -1 | 8.0923; 8.9366; 12.186 94.666; 92.374; 113.149 | 805 | Bedeković, Nikola; Stilinović, Vladimir; Friščić, Tomislav; Cinčić, Dominik Comparison of isomericmeta- andpara-diiodotetrafluorobenzene as halogen bond donors in crystal engineering New Journal of Chemistry, 2018, 42, 10584 |
| 7058680 | CIF | C3 H3 N9 O3 | P 1 21/n 1 | 10.0066; 6.2343; 13.5638 90; 107.909; 90 | 805.17 | Zhang, Jichuan; Yin, Ping; Pan, Guangxing; Wang, Zhenyuan; Zhang, Jiaheng; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean’ne M. 5-(4-Azidofurazan-3-yl)-1-hydroxytetrazole and its derivatives: from green primary to secondary explosives New Journal of Chemistry, 2019, 43, 12684 |
| 7062553 | CIF | C15 H11 Cl3 N2 O4 | P 1 21 1 | 6.6066; 12.8897; 9.5387 90; 97.422; 90 | 805.48 | Nguyen Tran, Anh Thu; Wu, Zhiyuan; Chung, Duy T. M.; Nalaoh, Phattananawee; Lindsey, Jonathan S. Synthesis of model southern rim structures of photosynthetic tetrapyrroles and phyllobilins New Journal of Chemistry, 2023, 47, 13626-13637 |
| 7058673 | CIF | C20 H11 Cl O2 Se | P -1 | 8.0372; 9.3175; 11.5027 106.318; 102.141; 90.953 | 805.57 | Jardim, Guilherme A. M.; Bozzi, Ícaro A. O.; Oliveira, Willian X. C.; Mesquita-Rodrigues, Camila; Menna-Barreto, Rubem F. S.; Kumar, Ramar A.; Gravel, Edmond; Doris, Eric; Braga, Antonio L.; da Silva Júnior, Eufrânio N. Copper complexes and carbon nanotube‒copper ferrite-catalyzed benzenoid A-ring selenation of quinones: an efficient method for the synthesis of trypanocidal agents New Journal of Chemistry, 2019, 43, 13751 |
| 7062997 | CIF | C18 H14 I N3 O | P 1 | 7.2957; 7.4157; 15.3505 98.052; 101.391; 90.231 | 805.69 | Govdi, Anastasia I.; Danilkina, Natalia A.; Shtyrov, Andrey A.; Ryazantsev, Mikhail N.; Kim, Mia D.; Kryukova, Mariya A.; Balova, Irina A. Cu-catalyzed cycloaddition of aryl azides to 1-iodobuta-1,3-diynes: an experimental and quantum chemical study of unusual regiochemistry New Journal of Chemistry, 2024, 48, 4831-4845 |
| 7055456 | CIF | Al N O8 Si Y4 | P 1 21/c 1 | 7.4491; 10.3933; 11.0563 90; 109.711; 90 | 805.831 | Hua, Youjie; Li, Xiaojun; Zhang, Dawei; Ma, Hongping; Deng, Degang; Xu, Shiqing The crystal structure and luminescence properties of novel Ce3+and Ce3+, Sm3±activated Y4SiAlO8N phosphors for near-UV white LEDs New J. Chem., 2016, 40, 5458 |
| 7059688 | CIF | C7 H12 Fe I3 N O3 | P 1 21/m 1 | 8.2405; 8.0958; 12.6129 90; 106.571; 90 | 806.5 | Yang, Xiuqin; Jin, Jing; Guo, Zhuming; Xiao, Zhiyin; Chen, Naiwen; Jiang, Xiujuan; He, Yi; Liu, Xiaoming The monoiron anion fac-[Fe(CO)3I3]− and its organic aminium salts: their preparation, CO-release, and cytotoxicity New Journal of Chemistry, 2020, 44, 10300-10308 |
| 7056533 | CIF | C17 H17 N3 O3 | P -1 | 9.347; 9.949; 10.194 106.19; 101.69; 110.1 | 806.765 | Valverde, Clodoaldo; Fonseca Vaz, Wesley; Custódio, Jean; Duarte, Vitor; Carvalho Jr, Paulo de Sousa; Figueredo, Andreza; Aquino, Gilberto Lúcio Benedito; Baseia, Basilio; Napolitano, Hamilton Solid State Structure and Environmental Polarization Effect of a Novel Asymmetric Azine New J. Chem., 2017 |
| 7058681 | CIF | C3 H4 N10 O2 | P 21 21 21 | 4.7561; 12.104; 14.0172 90; 90; 90 | 806.94 | Zhang, Jichuan; Yin, Ping; Pan, Guangxing; Wang, Zhenyuan; Zhang, Jiaheng; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean’ne M. 5-(4-Azidofurazan-3-yl)-1-hydroxytetrazole and its derivatives: from green primary to secondary explosives New Journal of Chemistry, 2019, 43, 12684 |
| 7057295 | CIF | C32 H36 Co N8 O8 | P -1 | 8.6876; 8.8285; 11.1967 74.149; 89.728; 78.065 | 807.03 | Liu, Xiangyu; Ma, Xiufang; Cen, Peipei; An, Fengqing; Wang, Zheng; Song, Weiming; Zhang, Yi-Quan One-dimensional cobalt(ii) coordination polymer featuring single-ion-magnet-type field-induced slow magnetic relaxation New Journal of Chemistry, 2018, 42, 9612 |
| 7055030 | CIF | C22 H20 Cu4 I4 N4 Se4 | P -1 | 9.086; 9.1684; 10.5159 70.96; 88.276; 77.37 | 807.25 | Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis New J. Chem., 2015, 39, 7948 |
| 7062091 | CIF | C21 H18 N0 O3 | P 1 21 1 | 9.4483; 9.97; 9.7662 90; 118.501; 90 | 808.48 | Chen, Li; Huang, Huangjiang; Luo, Benlong; Liu, Jinggong; Yang, Shuang; Fang, Xinqiang Catalytic synthesis of seven-membered carbocycles via ring expansion of cyclic β-ketoesters New Journal of Chemistry, 2023, 47, 41-45 |
| 7052167 | CIF | C22 H12 O2 S2 | P -1 | 5.686; 10.21; 14.072 97.506; 92.789; 90.58 | 808.9 | Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine 2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers New Journal of Chemistry, 2007, 31, 1585 |
| 7057328 | CIF | C14 H13 N2 O11 Tb | P -1 | 7.5917; 9.9747; 11.764 106.537; 101.239; 100.824 | 809.08 | Tong, Wen-Quan; Liu, Ting-Ting; Li, Gao-Peng; Liang, Ji-Ye; Hou, Lei; Wang, Yao-Yu Three new super water-stable lanthanide‒organic frameworks for luminescence sensing and magnetic properties New Journal of Chemistry, 2018, 42, 9221 |
| 7054143 | CIF | C5 H4 B F3 N2 O3 | P c a 21 | 11.996; 6.0475; 11.156 90; 90; 90 | 809.3 | Nizhnik, Yakov P.; Lu, Jianjiang; Rosokha, Sergiy V.; Kochi, Jay K. Lewis acid effects on donor‒acceptor associations and redox reactions: ternary complexes of heteroaromatic N-oxides with boron trifluoride and organic donors New Journal of Chemistry, 2009, 33, 2317 |
| 7060295 | CIF | C16 H16 Mn N2 O10 | P 1 2/n 1 | 7.04; 10.055; 11.499 90; 95.072; 90 | 810.8 | Xin, Yu; Zhou, Jun; Xing, Yong Heng; Bai, Feng Ying; Sun, Li Xian A series of porous 3D inorganic‒organic hybrid framework crystalline materials based on 5-aminoisophthalic acid for photocatalytic degradation of crystal violet New Journal of Chemistry, 2021, 45, 3432-3440 |
| 7050789 | CIF | C28 H24 N4 O14 S6 | P -1 | 8.2988; 9.1492; 12.431 93.27; 107.02; 113.53 | 811 | Desroches, Cédric; Parola, Stéphane; Vocanson, Francis; Perrin, Monique; Lamartine, Roger; Létoffé, Jean-Marie; Bouix, Jean Nitration of thiacalix[4]arene using nitrosium nitrate complexes: synthesis and characterization of tetranitro-, tetraamino-, and tetra(4-pyridylimino)tetrahydroxythiacalix[4]arene New Journal of Chemistry, 2002, 26, 651 |
| 7058020 | CIF | C6 H4 N6 O4 | C 1 2/c 1 | 6.1653; 15.7789; 8.7387 90; 107.434; 90 | 811.06 | Domasevitch, Konstantin V.; Gospodinov, Ivan; Krautscheid, Harald; Klapoetke, Thomas M.; Stierstorfer, Joerg Facile and selective polynitrations at the 4-pyrazolyl dual backbone: A straightforward access to a series of high-density energetic materials New Journal of Chemistry, 2018 |
| 7053481 | CIF | C30 H28 Cu N8 O6 S2 | P -1 | 7.3122; 9.953; 12.917 99.909; 105.708; 110.183 | 811.9 | Rajput, Lalit; Biradha, Kumar Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion New Journal of Chemistry, 2010, 34, 2415 |
| 7055277 | CIF | C16 H17 Cl Cu N4 O S | P -1 | 8.984; 9.757; 10.524 105.822; 98.341; 108.844 | 812 | Muralisankar, Mathiyan; Bhuvanesh, Nattamai S. P.; Sreekanth, Anandaram Synthesis, X-ray crystal structure, DNA/protein binding and DNA cleavage studies of novel copper(ii) complexes of N-substituted isatin thiosemicarbazone ligands New J. Chem., 2016, 40, 2661 |
| 7050646 | CIF | C16 H14 B N6 Tl | P 1 21 1 | 10.454; 6.374; 12.338 90; 98.96; 90 | 812.1 | Davies, Graham M.; Jeffery, John C.; Ward, Michael D. Chiral coordination polymers based on thallium(i) complexes of new bis- and tris(pyrazolyl)borate ligands with externally-directed 4-pyridyl groups New Journal of Chemistry, 2003, 27, 1550 |
| 7053819 | CIF | C10 H8 N2 O | P -1 | 7.6509; 9.1569; 12.0975 102.228; 93.332; 99.815 | 812.26 | Johnston, Karen A.; McNab, Hamish Synthesis and properties of 5,6-dihydrodipyrrolo[1,2-d;2′,1′-g][1,4]diazepin-11-one New Journal of Chemistry, 2009, 33, 1703 |
| 7053224 | CIF | C5 H14 N16 O7 | P -1 | 7.3715; 7.4426; 15.3365 101.616; 97.451; 94.214 | 812.91 | Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee Energetic salts based on 1-methoxy-5-nitroiminotetrazole New Journal of Chemistry, 2013, 37, 1180 |
| 7057323 | CIF | C16 H12 N4 O7 Zn | P -1 | 9.0473; 9.988; 10.079 75.074; 67.585; 82.372 | 813 | Yan, Yang-Tian; Cao, Feng; Zhang, Wen-Yan; Zhang, Si-Si; Zhang, Fang; Wang, Yao-Yu Seven luminescent metal‒organic frameworks constructed from 5-(triazol-1-yl)nicotinic acid: luminescent sensors for CrVI and MnO4− ions in an aqueous medium New Journal of Chemistry, 2018, 42, 9865 |
| 7050091 | CIF | C14 H13 Ag B F4 N5 | P -1 | 7.5292; 9.7601; 11.8669 75.444; 74.672; 83.659 | 813.13 | Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes New Journal of Chemistry, 2005, 29, 826 |
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