Crystallography Open Database
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Searching year of publication is 2007
| COD ID: 1101114 | |
| CIF file | Formula: - C56 H48 Cu2 I2 N4 - Comments: Kia, Reza; Mirkhani, Valiollah; Harkema, Sybolt; van Hummel, Gerrit J. Synthesis and characterization of the 1:1 adducts of copper(I) halides with bidentate N,N'-bis(benzophenone)-1,2-diiminoethane Schiff base: Crystal structures of [Cu(bz2en)2][CuX2] (X = Br, I) complexes Inorganica Chimica Acta 360(10) (2007) 3369-3375 Space group: P 1 21/c 1 Cell volume: 5007.6 Cell parameters: 12.28; 27.44; 15.13; 90; 100.82; 90; |
| COD ID: 1500005 | |
| CIF file | Formula: - As3 Co2 H47 N12 O16 - Comments: Ritu Bala; Raj Pal Sharma; Rajni Sharma; Juan M. Salas; Miguel Quirós; William T.A. Harrison Cationic cobaltammines as anion receptors: Synthesis, characterization an X-ray structure of bis-(hexaamminecobalt(III)) tris-(hydrogenarsenate) tetrahydrate Journal of Molecular Structure 828 (2007) 174-180 Space group: P c c n Cell volume: 5242.9 Cell parameters: 27.4534; 13.1997; 14.468; 90; 90; 90; |
| COD ID: 1500019 | |
| CIF file | Formula: - C13 H11 N O2 - Comments: Maria Lalia Kantouri; Christos D. Papadopoulos; Antonios G. Hatzdimitriou; Miguel Quirós Synthesis and characterization of new Co(III) mixed-ligand complexes, containing 2-hydroxy-aryloximes and α-diimines. Crystal and molecular strucutre of [Co(saox)(bipy)~2~]Br Polyhedron 26 (2007) 1292-1302 Space group: P b c a Cell volume: 2165.5 Cell parameters: 9.4668; 8.8177; 25.9413; 90; 90; 90; |
| COD ID: 1500022 | |
| CIF file | Formula: - C28.81 H26.43 Br Co N5.33 O3.9 - Comments: Maria Lalia-Kantouri; Christos D. Papadopoulos; Antonios G. Hatzidimitriou; Miguel Quirós Synthesis and characterization of new Co(III) mixed-ligand complexes, containing 2-hydroxy-aryloximes and α-diimines. Crystal and molecular strucutre of [Co(saox)(bipy)~2~]Br Polyhedron 26 (2007) 1292-1302 Space group: P n m a Cell volume: 11320.9 Cell parameters: 17.7483; 36.829; 17.3196; 90; 90; 90; |
| COD ID: 1500039 | |
| CIF file | Formula: - C7 H7 N O - Comments: Thun, Jürgen; Seyfarth, Lena; Senker, Jürgen; Dinnebier, Robert E.; Breu, Josef Polymorphism in benzamide: solving a 175-year-old riddle. Angewandte Chemie (International ed. in English) 46(35) (2007) 6729-6731 Space group: P 1 21/c 1 Cell volume: 627.5 Cell parameters: 5.05506; 5.51404; 22.95644; 90; 101.291; 90; |
| COD ID: 1501470 | |
| CIF file | Formula: - Li2 O7 Si3 - Comments: Krüger, Hannes; Kahlenberg, Volker; Kaindl, R. Li2Si3O7: Crystal structure and Raman Spectroscopy Journal of Solid State Chemistry 180 (2007) 936-942 Space group: P m c a Cell volume: 573.71 Cell parameters: 19.648; 5.9969; 4.8691; 90; 90; 90; |
| COD ID: 1501565 | |
| CIF file | Formula: - C16 H14 - Comments: Hung Dang; Thierry Maris; Ji-Hyun Yi; Federico Rosei; Antonio Nancy; James D. Wuest Ensuring Homology between 2D and 3D Molecular Crystals Langmuir 23 (2007) 11980-11985 Space group: P 21 21 21 Cell volume: 2224.35 Cell parameters: 8.0049; 8.5815; 32.3805; 90; 90; 90; |
| COD ID: 1501566 | |
| CIF file | Formula: - C18 H14 O4 - Comments: Hung Dang; Thierry Maris; Ji-Hyun Yi; Federico Rosei; Antonio Nancy; James D. Wuest Ensuring Homology between 2D and 3D Molecular Crystals Langmuir 23 (2007) 11980-11985 Space group: P 43 21 2 Cell volume: 1339.54 Cell parameters: 9.7778; 9.7778; 14.0111; 90; 90; 90; |
| COD ID: 1501616 | |
| CIF file | Formula: - C84 H66 N6 O12 - Comments: Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene Tetrahedron 63 (2007) 6603-6613 Space group: P -1 Cell volume: 3524.4 Cell parameters: 11.1911; 13.9932; 24.378; 84.436; 83.004; 68.693; |
| COD ID: 1501617 | |
| CIF file | Formula: - C70 H80 N6 O26 - Comments: Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene Tetrahedron 63 (2007) 6603-6613 Space group: P -1 Cell volume: 1703.7 Cell parameters: 11.533; 13.037; 14.014; 105.1; 108.37; 110.42; |
| COD ID: 1501618 | |
| CIF file | Formula: - C46 H30 N8 O12 - Comments: Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene Tetrahedron 63 (2007) 6603-6613 Space group: C 1 2/c 1 Cell volume: 4253.1 Cell parameters: 11.237; 20.367; 19.002; 90; 102.048; 90; |
| COD ID: 1501619 | |
| CIF file | Formula: - C48 H36 N6 O14 - Comments: Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene Tetrahedron 63 (2007) 6603-6613 Space group: C 1 2/c 1 Cell volume: 4468 Cell parameters: 11.18; 20.59; 20.07; 90; 104.74; 90; |
| COD ID: 1501620 | |
| CIF file | Formula: - C46 H36 N6 O14 - Comments: Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene Tetrahedron 63 (2007) 6603-6613 Space group: P 1 21/n 1 Cell volume: 2090.4 Cell parameters: 10.7355; 13.931; 14.1161; 90; 98.039; 90; |
| COD ID: 1501621 | |
| CIF file | Formula: - C48 H38 N8 O14 - Comments: Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene Tetrahedron 63 (2007) 6603-6613 Space group: P 1 21 1 Cell volume: 2248.5 Cell parameters: 11.6772; 17.9809; 11.9334; 90; 116.183; 90; |
| COD ID: 1505006 | |
| CIF file | Formula: - C37 H47 Cl3 Fe2 N4 O6 S2 - Comments: Khan, Mohammad A. K.; Long, Yi-Tao; Schatte, Gabriele; Kraatz, Heinz-Bernhard Surface Studies of Aminoferrocene Derivatives on Gold: Electrochemical Sensors for Chemical Warfare Agents Analytical Chemistry 79(7) (2007) 2877 Space group: P -1 Cell volume: 2437.19 Cell parameters: 11.8954; 13.3664; 16.6714; 85.6016; 79.3536; 69.328; |
| COD ID: 1505007 | |
| CIF file | Formula: - C29 H34 B N3 O - Comments: Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H. Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse Journal of Combinatorial Chemistry 9(4) (2007) 571 Space group: P 1 21/n 1 Cell volume: 2527.5 Cell parameters: 10.0825; 18.239; 13.8361; 90; 96.606; 90; |
| COD ID: 1505008 | |
| CIF file | Formula: - C36 H39 B N4 O2 - Comments: Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H. Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse Journal of Combinatorial Chemistry 9(4) (2007) 571 Space group: P 1 21/n 1 Cell volume: 3125 Cell parameters: 12.7145; 15.8471; 15.7636; 90; 100.298; 90; |
| COD ID: 1505009 | |
| CIF file | Formula: - C33 H40 B N3 O - Comments: Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H. Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse Journal of Combinatorial Chemistry 9(4) (2007) 571 Space group: P 1 21/c 1 Cell volume: 3021.3 Cell parameters: 16.63; 13.9808; 12.999; 90; 91.48; 90; |
| COD ID: 1505010 | |
| CIF file | Formula: - C33 H39 B N4 O2 - Comments: Soutullo, Morgan D.; Odom, Carl I.; Salter, E. Alan; Stenson, Alexandra C.; Sykora, Richard E.; Wierzbicki, Andrzej; Davis, James H. Ultra-Easy Access to NH2-Functionalized TSILs, Their Potential as Highly Volume-Efficient Electrophile Scavengers, and Insights into the Electronics of Girard's Reagent T, A Venerable Chemical Work Horse Journal of Combinatorial Chemistry 9(4) (2007) 571 Space group: P 1 21/n 1 Cell volume: 3056.6 Cell parameters: 14.1478; 10.2584; 21.693; 90; 103.87; 90; |
| COD ID: 1505011 | |
| CIF file | Formula: - C28 H27 Cl N4 O3 - Comments: Tu, Shujiang; Li, Chunmei; Li, Guigen; Cao, Longji; Shao, Qingqing; Zhou, Dianxiang; Jiang, Bo; Zhou, Jianfeng; Xia, Min Microwave-Assisted Combinatorial Synthesis of Polysubstituent Imidazo[1,2-a]quinoline, Pyrimido[1,2-a]quinoline and Quinolino[1,2-a]quinazoline Derivatives Journal of Combinatorial Chemistry 9(6) (2007) 1144 Space group: C 1 2/c 1 Cell volume: 4957 Cell parameters: 36.34; 11.78; 11.87; 90; 102.714; 90; |
| COD ID: 1505012 | |
| CIF file | Formula: - C21 H20 Cl N3 O2 - Comments: Tu, Shujiang; Li, Chunmei; Li, Guigen; Cao, Longji; Shao, Qingqing; Zhou, Dianxiang; Jiang, Bo; Zhou, Jianfeng; Xia, Min Microwave-Assisted Combinatorial Synthesis of Polysubstituent Imidazo[1,2-a]quinoline, Pyrimido[1,2-a]quinoline and Quinolino[1,2-a]quinazoline Derivatives Journal of Combinatorial Chemistry 9(6) (2007) 1144 Space group: P 1 21/c 1 Cell volume: 1891.6 Cell parameters: 10.378; 10.131; 18.143; 90; 97.406; 90; |
| COD ID: 1505013 | |
| CIF file | Formula: - C18 H14 F N3 O2 - Comments: Tu, Shujiang; Li, Chunmei; Li, Guigen; Cao, Longji; Shao, Qingqing; Zhou, Dianxiang; Jiang, Bo; Zhou, Jianfeng; Xia, Min Microwave-Assisted Combinatorial Synthesis of Polysubstituent Imidazo[1,2-a]quinoline, Pyrimido[1,2-a]quinoline and Quinolino[1,2-a]quinazoline Derivatives Journal of Combinatorial Chemistry 9(6) (2007) 1144 Space group: P 1 21/c 1 Cell volume: 1521 Cell parameters: 10.781; 14.937; 9.839; 90; 106.27; 90; |
| COD ID: 1505014 | |
| CIF file | Formula: - C38 H32 O - Comments: Yao, Liang-Feng; Shi, Min Lewis acid-catalyzed cascade reactions of arylmethylenecyclopropanes with 1,1,3-triarylprop-2-yn-1-ols or their methyl ethers. Organic letters 9(25) (2007) 5187-5190 Space group: P -1 Cell volume: 1452.3 Cell parameters: 10.9684; 11.1701; 12.9433; 87.15; 67.964; 81.135; |
| COD ID: 1505015 | |
| CIF file | Formula: - C39 H34 O2 - Comments: Yao, Liang-Feng; Shi, Min Lewis acid-catalyzed cascade reactions of arylmethylenecyclopropanes with 1,1,3-triarylprop-2-yn-1-ols or their methyl ethers. Organic letters 9(25) (2007) 5187-5190 Space group: P 1 21/c 1 Cell volume: 3065.6 Cell parameters: 11.9815; 28.144; 9.7933; 90; 111.828; 90; |
| COD ID: 1505016 | |
| CIF file | Formula: - C14 H14 Cl4 Cu2 N10 - Comments: Tardito, Saverio; Bussolati, Ovidio; Maffini, Monica; Tegoni, Matteo; Giannetto, Marco; Dall'asta, Valeria; Franchi-Gazzola, Renata; Lanfranchi, Maurizio; Pellinghelli, Maria Angela; Mucchino, Claudio; Mori, Giovanni; Marchio, Luciano Thioamido coordination in a thioxo-1,2,4-triazole copper(II) complex enhances nonapoptotic programmed cell death associated with copper accumulation and oxidative stress in human cancer cells. Journal of medicinal chemistry 50(8) (2007) 1916-1924 Space group: P 1 21/a 1 Cell volume: 996.5 Cell parameters: 8.346; 14.28; 8.376; 90; 93.43; 90; |
| COD ID: 1505017 | |
| CIF file | Formula: - C20 H21 Cl4 Cu2 N10 O1.5 S2 - Comments: Tardito, Saverio; Bussolati, Ovidio; Maffini, Monica; Tegoni, Matteo; Giannetto, Marco; Dall'asta, Valeria; Franchi-Gazzola, Renata; Lanfranchi, Maurizio; Pellinghelli, Maria Angela; Mucchino, Claudio; Mori, Giovanni; Marchio, Luciano Thioamido coordination in a thioxo-1,2,4-triazole copper(II) complex enhances nonapoptotic programmed cell death associated with copper accumulation and oxidative stress in human cancer cells. Journal of medicinal chemistry 50(8) (2007) 1916-1924 Space group: P -1 Cell volume: 1385.4 Cell parameters: 8.827; 10.796; 16.59; 72.92; 85.5; 66.58; |
| COD ID: 1505018 | |
| CIF file | Formula: - C9 H11 Cl2 Cu N5 S - Comments: Tardito, Saverio; Bussolati, Ovidio; Maffini, Monica; Tegoni, Matteo; Giannetto, Marco; Dall'asta, Valeria; Franchi-Gazzola, Renata; Lanfranchi, Maurizio; Pellinghelli, Maria Angela; Mucchino, Claudio; Mori, Giovanni; Marchio, Luciano Thioamido coordination in a thioxo-1,2,4-triazole copper(II) complex enhances nonapoptotic programmed cell death associated with copper accumulation and oxidative stress in human cancer cells. Journal of medicinal chemistry 50(8) (2007) 1916-1924 Space group: P -1 Cell volume: 666 Cell parameters: 8.649; 9.313; 9.371; 68.69; 71.86; 79.27; |
| COD ID: 1505019 | |
| CIF file | Formula: - C14 H19.5 Cl2 N Na O6.75 - Comments: Llinàs, Antonio; Burley, Jonathan C.; Box, Karl J.; Glen, Robert C.; Goodman, Jonathan M. Diclofenac solubility: independent determination of the intrinsic solubility of three crystal forms. Journal of medicinal chemistry 50(5) (2007) 979-983 Space group: P 1 21 1 Cell volume: 3712.75 Cell parameters: 9.554; 39.491; 9.8412; 90; 90.729; 90; |
| COD ID: 1505020 | |
| CIF file | Formula: - C24 H39.5 Cl N8 O8.25 Pt S - Comments: Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity. Journal of medicinal chemistry 50(9) (2007) 2259-2263 Space group: P 1 21 1 Cell volume: 3137 Cell parameters: 10.509; 31.892; 10.564; 90; 117.63; 90; |
| COD ID: 1505021 | |
| CIF file | Formula: - C21 H33 Cl N8 O7 Pt S - Comments: Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity. Journal of medicinal chemistry 50(9) (2007) 2259-2263 Space group: P -1 Cell volume: 1379.1 Cell parameters: 10.6463; 10.9812; 13.1259; 90.642; 99.622; 113.788; |
| COD ID: 1505022 | |
| CIF file | Formula: - C24 H37 Cl N8 O6 Pt S - Comments: Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity. Journal of medicinal chemistry 50(9) (2007) 2259-2263 Space group: P -1 Cell volume: 1461.7 Cell parameters: 7.266; 11.8032; 17.193; 95.598; 92.629; 94.082; |
| COD ID: 1505023 | |
| CIF file | Formula: - C28 H37 Cl N8 O10 Pt S - Comments: Guddneppanavar, Rajsekhar; Choudhury, Jayati Roy; Kheradi, Alexander R.; Steen, Bartlett D.; Saluta, Gilda; Kucera, Gregory L.; Day, Cynthia S.; Bierbach, Ulrich Effect of the diamine nonleaving group in platinum-acridinylthiourea conjugates on DNA damage and cytotoxicity. Journal of medicinal chemistry 50(9) (2007) 2259-2263 Space group: P -1 Cell volume: 5061.2 Cell parameters: 14.4746; 18.7922; 19.543; 103.44; 98.838; 95.471; |
| COD ID: 1505024 | |
| CIF file | Formula: - C68 H58 B Cl N4 Ru - Comments: Vock, Carsten A.; Ang, Wee Han; Scolaro, Claudine; Phillips, Andrew D.; Lagopoulos, Lucienne; Juillerat-Jeanneret, Lucienne; Sava, Gianni; Scopelliti, Rosario; Dyson, Paul J. Development of ruthenium antitumor drugs that overcome multidrug resistance mechanisms. Journal of medicinal chemistry 50(9) (2007) 2166-2175 Space group: P 1 21/c 1 Cell volume: 5374.4 Cell parameters: 10.6994; 29.8522; 18.8571; 90; 116.835; 90; |
| COD ID: 1505025 | |
| CIF file | Formula: - C27 H26 Cl2 N2 Ru - Comments: Vock, Carsten A.; Ang, Wee Han; Scolaro, Claudine; Phillips, Andrew D.; Lagopoulos, Lucienne; Juillerat-Jeanneret, Lucienne; Sava, Gianni; Scopelliti, Rosario; Dyson, Paul J. Development of ruthenium antitumor drugs that overcome multidrug resistance mechanisms. Journal of medicinal chemistry 50(9) (2007) 2166-2175 Space group: P 1 21/c 1 Cell volume: 2394.9 Cell parameters: 14.34; 12.4234; 15.156; 90; 117.502; 90; |
| COD ID: 1505026 | |
| CIF file | Formula: - C35 H37 Cl2 N3 O4 Ru - Comments: Vock, Carsten A.; Ang, Wee Han; Scolaro, Claudine; Phillips, Andrew D.; Lagopoulos, Lucienne; Juillerat-Jeanneret, Lucienne; Sava, Gianni; Scopelliti, Rosario; Dyson, Paul J. Development of ruthenium antitumor drugs that overcome multidrug resistance mechanisms. Journal of medicinal chemistry 50(9) (2007) 2166-2175 Space group: P 1 21/c 1 Cell volume: 3310.9 Cell parameters: 12.658; 14.916; 17.958; 90; 102.445; 90; |
| COD ID: 1505027 | |
| CIF file | Formula: - C22 H29 N O6 - Comments: Saquib, Mohammad; Gupta, Manish K.; Sagar, Ram; Prabhakar, Yenamandra S.; Shaw, Arun K.; Kumar, Rishi; Maulik, Prakas R.; Gaikwad, Anil N.; Sinha, Sudhir; Srivastava, Anil K.; Chaturvedi, Vinita; Srivastava, Ranjana; Srivastava, Brahm S. C-3 alkyl/arylalkyl-2,3-dideoxy hex-2-enopyranosides as antitubercular agents: synthesis, biological evaluation, and QSAR study. Journal of medicinal chemistry 50(13) (2007) 2942-2950 Space group: P 1 21 1 Cell volume: 1152.9 Cell parameters: 14.443; 5.797; 15.243; 90; 115.4; 90; |
| COD ID: 1505028 | |
| CIF file | Formula: - C23 H36 Cl Cu N5 O8 - Comments: Sprague, Jennifer E.; Peng, Yijie; Fiamengo, Ashley L.; Woodin, Katrina S.; Southwick, Evan A.; Weisman, Gary R.; Wong, Edward H.; Golen, James A.; Rheingold, Arnold L.; Anderson, Carolyn J. Synthesis, characterization and in vivo studies of Cu(II)-64-labeled cross-bridged tetraazamacrocycle-amide complexes as models of peptide conjugate imaging agents. Journal of medicinal chemistry 50(10) (2007) 2527-2535 Space group: P b c a Cell volume: 5238.8 Cell parameters: 21.134; 10.7258; 23.111; 90; 90; 90; |
| COD ID: 1505029 | |
| CIF file | Formula: - C22 H27 N3 O5 - Comments: Robins, Morris J.; Nowak, Ireneusz; Rajwanshi, Vivek K.; Miranda, Karl; Cannon, John F.; Peterson, Matt A.; Andrei, Graciela; Snoeck, Robert; De Clercq, Erik; Balzarini, Jan Synthesis and antiviral evaluation of 6-(alkyl-heteroaryl)furo[2,3-d]pyrimidin-2(3H)-one nucleosides and analogues with ethynyl, ethenyl, and ethyl spacers at C6 of the furopyrimidine core. Journal of medicinal chemistry 50(16) (2007) 3897-3905 Space group: P 1 21 1 Cell volume: 1041.1 Cell parameters: 6.6883; 5.6677; 27.611; 90; 95.9; 90; |
| COD ID: 1505030 | |
| CIF file | Formula: - C21 H24 N2 O5 - Comments: Robins, Morris J.; Nowak, Ireneusz; Rajwanshi, Vivek K.; Miranda, Karl; Cannon, John F.; Peterson, Matt A.; Andrei, Graciela; Snoeck, Robert; De Clercq, Erik; Balzarini, Jan Synthesis and antiviral evaluation of 6-(alkyl-heteroaryl)furo[2,3-d]pyrimidin-2(3H)-one nucleosides and analogues with ethynyl, ethenyl, and ethyl spacers at C6 of the furopyrimidine core. Journal of medicinal chemistry 50(16) (2007) 3897-3905 Space group: P 1 21 1 Cell volume: 978.3 Cell parameters: 6.6665; 5.7707; 25.533; 90; 95.15; 90; |
| COD ID: 1505031 | |
| CIF file | Formula: - C23 H32 O8 - Comments: Simpson, Denise S.; Katavic, Peter L.; Lozama, Anthony; Harding, Wayne W.; Parrish, Damon; Deschamps, Jeffrey R.; Dersch, Christina M.; Partilla, John S.; Rothman, Richard B.; Navarro, Hernan; Prisinzano, Thomas E. Synthetic studies of neoclerodane diterpenes from Salvia divinorum: preparation and opioid receptor activity of salvinicin analogues. Journal of medicinal chemistry 50(15) (2007) 3596-3603 Space group: P 21 21 21 Cell volume: 2141.4 Cell parameters: 6.3428; 10.563; 31.962; 90; 90; 90; |
| COD ID: 1505032 | |
| CIF file | Formula: - C30 H48 N2 O3 - Comments: Sauvaître, Thibault; Barlier, Mireille; Herlem, Denyse; Gresh, Nohad; Chiaroni, Angèle; Guenard, Daniel; Guillou, Catherine New potent acetylcholinesterase inhibitors in the tetracyclic triterpene series. Journal of medicinal chemistry 50(22) (2007) 5311-5323 Space group: P 1 Cell volume: 695.6 Cell parameters: 6.135; 6.77; 17.17; 92.3; 97.87; 99.35; |
| COD ID: 1505033 | |
| CIF file | Formula: - C28 H35 N O6 - Comments: Vyavahare, Vinod P.; Chakraborty, Chaitali; Maity, Biswanath; Chattopadhyay, Subrata; Puranik, Vedavati G.; Dhavale, Dilip D. Synthesis of 1-deoxy-1-hydroxymethyl- and 1-deoxy-1-epi-hydroxymethyl castanospermine as new potential immunomodulating agents. Journal of medicinal chemistry 50(22) (2007) 5519-5523 Space group: P 21 21 21 Cell volume: 2711 Cell parameters: 8.6763; 14.897; 20.9747; 90; 90; 90; |
| COD ID: 1505034 | |
| CIF file | Formula: - C9 H17 N O4 - Comments: Vyavahare, Vinod P.; Chakraborty, Chaitali; Maity, Biswanath; Chattopadhyay, Subrata; Puranik, Vedavati G.; Dhavale, Dilip D. Synthesis of 1-deoxy-1-hydroxymethyl- and 1-deoxy-1-epi-hydroxymethyl castanospermine as new potential immunomodulating agents. Journal of medicinal chemistry 50(22) (2007) 5519-5523 Space group: P 1 21 1 Cell volume: 513.77 Cell parameters: 7.1718; 6.9079; 10.864; 90; 107.338; 90; |
| COD ID: 1505035 | |
| CIF file | Formula: - C10 H4 O2 S2 - Comments: Hyatt, Janice L.; Wadkins, Randy M.; Tsurkan, Lyudmila; Hicks, Latorya D.; Hatfield, M. Jason; Edwards, Carol C.; Ross, 2nd, Charles R; Cantalupo, Stephanie A.; Crundwell, Guy; Danks, Mary K.; Guy, R. Kip; Potter, Philip M. Planarity and constraint of the carbonyl groups in 1,2-diones are determinants for selective inhibition of human carboxylesterase 1. Journal of medicinal chemistry 50(23) (2007) 5727-5734 Space group: P 1 21/c 1 Cell volume: 874.11 Cell parameters: 8.96; 14.8156; 6.7569; 90; 102.962; 90; |
| COD ID: 1505036 | |
| CIF file | Formula: - C12 H26 Cl2 N2 O9 Pt - Comments: Reithofer, Michael R.; Valiahdi, Seied M.; Jakupec, Michael A.; Arion, Vladimir B.; Egger, Alexander; Galanski, Markus; Keppler, Bernhard K. Novel di- and tetracarboxylatoplatinum(IV) complexes. Synthesis, characterization, cytotoxic activity, and DNA platination. Journal of medicinal chemistry 50(26) (2007) 6692-6699 Space group: P n a 21 Cell volume: 2047.79 Cell parameters: 23.5231; 10.6395; 8.1822; 90; 90; 90; |
| COD ID: 1505037 | |
| CIF file | Formula: - C22 H17 N5 O2 - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P 1 21/c 1 Cell volume: 1887.6 Cell parameters: 10.8951; 20.05; 8.6412; 90; 90.16; 90; |
| COD ID: 1505038 | |
| CIF file | Formula: - C35 H36 Cl2 N4 O2 Ru - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P 1 c 1 Cell volume: 1606.3 Cell parameters: 9.872; 9.6208; 17.434; 90; 104.05; 90; |
| COD ID: 1505039 | |
| CIF file | Formula: - C36 H43 Cl2 N5 O4 Ru - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P -1 Cell volume: 1780.65 Cell parameters: 12.2485; 12.6418; 14.3132; 95.421; 108.122; 118.054; |
| COD ID: 1505040 | |
| CIF file | Formula: - C35 H36 Cl2 N4 O2 Os - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P 1 c 1 Cell volume: 1608.3 Cell parameters: 9.876; 9.6263; 17.46; 90; 104.32; 90; |
| COD ID: 1505041 | |
| CIF file | Formula: - C130 H133 Br4 Cl8 N16 O3.5 Os4 - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P -1 Cell volume: 3271.8 Cell parameters: 13.8319; 14.1376; 18.3912; 98.511; 107.338; 102.012; |
| COD ID: 1505042 | |
| CIF file | Formula: - C35.9 H42.95 Cl2 N5 O4.08 Os - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P -1 Cell volume: 1784.59 Cell parameters: 12.2836; 12.6756; 14.2592; 95.491; 107.998; 118.072; |
| COD ID: 1505043 | |
| CIF file | Formula: - C32 H32.5 Cl2 N4 O0.25 Os - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P -1 Cell volume: 3292.9 Cell parameters: 13.958; 14.0949; 18.3531; 96.749; 108.022; 102.05; |
| COD ID: 1505044 | |
| CIF file | Formula: - C36 H45 Cl2 N5 O5 Ru - Comments: Schmid, Wolfgang F.; John, Roland O.; Mühlgassner, Gerhard; Heffeter, Petra; Jakupec, Michael A.; Galanski, Markus; Berger, Walter; Arion, Vladimir B.; Keppler, Bernhard K. Metal-based paullones as putative CDK inhibitors for antitumor chemotherapy. Journal of medicinal chemistry 50(25) (2007) 6343-6355 Space group: P 1 21/c 1 Cell volume: 3568.5 Cell parameters: 10.771; 25.04; 13.238; 90; 91.84; 90; |
| COD ID: 1505045 | |
| CIF file | Formula: - C26 H16 - Comments: Tong, H.; Dong, Y.; Hong, Y.; Haussler, M.; Lam, J.W.Y.; Sung, H.H.-Y.; Yu, X.; Sun, J.; Williams, I.D.; Kwok, H.S.; Tang, B.Z. Aggregation-Induced Emission: Effects of Molecular Structure, Solid-State Conformation, and Morphological Packing Arrangement on Light-Emitting Behaviors of Diphenyldibenzofulvene Derivatives Journal of Physical Chemistry C 111(5) (2007) 2287 Space group: C 1 c 1 Cell volume: 1650.22 Cell parameters: 11.9998; 18.2129; 7.9427; 90; 108.075; 90; |
| COD ID: 1505046 | |
| CIF file | Formula: - C78 H75 Dy N6 O8 P2 - Comments: Li, Z.-F.; Zhou, L.; Yu, J.-B.; Zhang, H.-J.; Deng, R.-P.; Peng, Z.-P.; Guo, Z.-Y. Synthesis, Structure, Photoluminescence, and Electroluminescence Properties of a New Dysprosium Complex Journal of Physical Chemistry C 111(5) (2007) 2295 Space group: P 1 21/n 1 Cell volume: 7011 Cell parameters: 13.263; 23.046; 22.945; 90; 91.51; 90; |
| COD ID: 1505047 | |
| CIF file | Formula: - Ca1.9 Mg0.17 O44.11 Si16 - Comments: Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S. In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta Journal of Physical Chemistry C 111(12) (2007) 4503 Space group: C 1 2/c 1 Cell volume: 4308 Cell parameters: 17.982; 17.985; 14.619; 90; 114.33; 90; |
| COD ID: 1505048 | |
| CIF file | Formula: - Ca1.9 Mg0.17 O36.44 Si16 - Comments: Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S. In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta Journal of Physical Chemistry C 111(12) (2007) 4503 Space group: C 1 2/c 1 Cell volume: 4264.5 Cell parameters: 17.879; 17.888; 14.635; 90; 114.34; 90; |
| COD ID: 1505049 | |
| CIF file | Formula: - Ca1.84 K0 Mg0.11 Na0 O33.96 Si16 - Comments: Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S. In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta Journal of Physical Chemistry C 111(12) (2007) 4503 Space group: C 1 2/c 1 Cell volume: 4253.3 Cell parameters: 17.863; 17.857; 14.636; 90; 114.35; 90; |
| COD ID: 1505050 | |
| CIF file | Formula: - Ca1.86 Mg0.18 O32 Si16 - Comments: Alberti, A.; Cruciani, G.; Galli, E.; Millini, R.; Zanardi, S. In Situ X-ray Single-Crystal Study on the Dehydration Mechanism in the Monoclinic Polytype of Tschernichite, the Mineral Analog of Zeolite Beta Journal of Physical Chemistry C 111(12) (2007) 4503 Space group: C 1 2/c 1 Cell volume: 4252.8 Cell parameters: 17.829; 17.828; 14.671; 90; 114.22; 90; |
| COD ID: 1505051 | |
| CIF file | Formula: - C9 H18 N2 O3 S - Comments: Santos, C.S.; Rivera-Rubero, S.; Dibrov, S.; Baldelli, S. Ions at the Surface of a Room-Temperature Ionic Liquid Journal of Physical Chemistry C 111(21) (2007) 7682 Space group: P -1 Cell volume: 600.67 Cell parameters: 7.9343; 8.4797; 10.2782; 103.404; 99.567; 111.62; |
| COD ID: 1505052 | |
| CIF file | Formula: - C9 H18 N2 O4 S - Comments: Santos, C.S.; Rivera-Rubero, S.; Dibrov, S.; Baldelli, S. Ions at the Surface of a Room-Temperature Ionic Liquid Journal of Physical Chemistry C 111(21) (2007) 7682 Space group: P 1 21/c 1 Cell volume: 1313 Cell parameters: 8.624; 20.82; 7.967; 90; 113.38; 90; |
| COD ID: 1505053 | |
| CIF file | Formula: - C32 H24 Ar1.15 N2 O8 Rh2 - Comments: Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S. Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR Journal of Physical Chemistry C 111(3) (2007) 1524 Space group: P -1 Cell volume: 856 Cell parameters: 9.588; 10.322; 10.861; 72.139; 64.783; 62.722; |
| COD ID: 1505054 | |
| CIF file | Formula: - C32 H24 Kr1.51 N2 O8 Rh2 - Comments: Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S. Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR Journal of Physical Chemistry C 111(3) (2007) 1524 Space group: P -1 Cell volume: 863.4 Cell parameters: 9.587; 10.364; 10.822; 71.867; 65.518; 63.237; |
| COD ID: 1505055 | |
| CIF file | Formula: - C32 H24 N2 O8 Rh2 Xe2 - Comments: Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S. Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR Journal of Physical Chemistry C 111(3) (2007) 1524 Space group: P -1 Cell volume: 865.7 Cell parameters: 9.578; 10.408; 10.837; 70.593; 65.599; 63.48; |
| COD ID: 1505056 | |
| CIF file | Formula: - C32 H24 Ar1.04 Cu2 N2 O8 - Comments: Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S. Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR Journal of Physical Chemistry C 111(3) (2007) 1524 Space group: C 1 2/c 1 Cell volume: 3391.3 Cell parameters: 18.396; 9.702; 19.188; 90; 98.001; 90; |
| COD ID: 1505057 | |
| CIF file | Formula: - C32 H24 Cu2 Kr1.72 N2 O8 - Comments: Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S. Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR Journal of Physical Chemistry C 111(3) (2007) 1524 Space group: C 1 2/c 1 Cell volume: 3442 Cell parameters: 18.631; 9.7039; 19.276; 90; 99.002; 90; |
| COD ID: 1505058 | |
| CIF file | Formula: - C32 H24 Cu2 N2 O8 Xe2 - Comments: Ueda, T.; Kurokawa, K.; Eguchi, T.; Kachi-Terajima, C.; Takamizawa, S. Local Structure and Xenon Adsorption Behavior of Metal-Organic Framework System [M2(O2CPh)4(pyz)]n (M = Rh and Cu) As Studied with Use of Single-Crystal X-ray Diffraction, Adsorption Isotherm, and Xenon-129 NMR Journal of Physical Chemistry C 111(3) (2007) 1524 Space group: P -1 Cell volume: 888.7 Cell parameters: 9.74; 10.471; 10.867; 70.741; 65.519; 63.558; |
| COD ID: 1505059 | |
| CIF file | Formula: - Cl H4 N O - Comments: Nelyubina, Yulia V.; Antipin, Mikhail Yu; Lyssenko, Konstantin A. Are halide...halide contacts a feature of rock-salts only? The journal of physical chemistry. A 111(6) (2007) 1091-1095 Space group: P 1 21/n 1 Cell volume: 268.75 Cell parameters: 6.8955; 5.9218; 7.2123; 90; 114.141; 90; |
| COD ID: 1505060 | |
| CIF file | Formula: - C51 H31 Eu F18 O8 P2 - Comments: Nakamura, Kazuki; Hasegawa, Yasuchika; Kawai, Hideki; Yasuda, Naoki; Kanehisa, Nobuko; Kai, Yasushi; Nagamura, Toshihiko; Yanagida, Shozo; Wada, Yuji Enhanced lasing properties of dissymmetric Eu(III) complex with bidentate phosphine ligands. The journal of physical chemistry. A 111(16) (2007) 3029-3037 Space group: P 1 21/n 1 Cell volume: 5328.81 Cell parameters: 13.3063; 31.7409; 13.5077; 90; 110.924; 90; |
| COD ID: 1505061 | |
| CIF file | Formula: - C9 H18 N2 O5 S - Comments: Nockemann, Peter; Thijs, Ben; Driesen, Kris; Janssen, Colin R.; Van Hecke, Kristof; Van Meervelt, Luc; Kossmann, Simone; Kirchner, Barbara; Binnemans, Koen Choline saccharinate and choline acesulfamate: ionic liquids with low toxicities. The journal of physical chemistry. B 111(19) (2007) 5254-5263 Space group: P 1 21/n 1 Cell volume: 1260.86 Cell parameters: 7.1338; 14.2416; 12.8338; 90; 104.758; 90; |
| COD ID: 1505062 | |
| CIF file | Formula: - C12 H18 N2 O4 S - Comments: Nockemann, Peter; Thijs, Ben; Driesen, Kris; Janssen, Colin R.; Van Hecke, Kristof; Van Meervelt, Luc; Kossmann, Simone; Kirchner, Barbara; Binnemans, Koen Choline saccharinate and choline acesulfamate: ionic liquids with low toxicities. The journal of physical chemistry. B 111(19) (2007) 5254-5263 Space group: P b c a Cell volume: 2754.3 Cell parameters: 25.654; 10.4439; 10.2801; 90; 90; 90; |
| COD ID: 1505063 | |
| CIF file | Formula: - C8 H18 N4 S2 - Comments: Munshi, Parthapratim; Cameron, Elinor; Row, Tayur N Guru; Ferrara, Joseph D.; Cameron, T. Stanley Investigation of inter-ion interactions in N,N,N',N'-tetramethylethylenediammonium dithiocyanate via experimental and theoretical charge density studies. The journal of physical chemistry. A 111(32) (2007) 7888-7897 Space group: P -1 Cell volume: 314.412 Cell parameters: 5.8915; 6.8875; 8.2113; 73.895; 79.228; 85.917; |
| COD ID: 1505064 | |
| CIF file | Formula: - C42 H54 Cl6 N2 O2 - Comments: Wang, Jia; Zhao, Yunfeng; Dou, Chuandong; Sun, Hui; Xu, Peng; Ye, Kaiqi; Zhang, Jingying; Jiang, Shimei; Li, Fei; Wang, Yue Alkyl and dendron substituted quinacridones: synthesis, structures, and luminescent properties. The journal of physical chemistry. B 111(19) (2007) 5082-5089 Space group: P 1 21/c 1 Cell volume: 2197.17 Cell parameters: 5.6794; 18.1714; 21.4441; 90; 96.877; 90; |
| COD ID: 1505065 | |
| CIF file | Formula: - C6 H7 N3 O2 - Comments: Kolev, Tsonko; Koleva, Bojidarka B.; Spiteller, Michael; Mayer-Figge, Heike; Sheldrick, William S. 2-amino-4-nitroaniline, a known compound with unexpected properties. The journal of physical chemistry. A 111(40) (2007) 10084-10089 Space group: P 21 21 21 Cell volume: 669.9 Cell parameters: 3.759; 10.307; 17.29; 90; 90; 90; |
| COD ID: 1505066 | |
| CIF file | Formula: - C25 H14 Cl4 N2 O10 - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P -1 Cell volume: 1263 Cell parameters: 10.241; 10.262; 12.302; 96.838; 94.763; 98.469; |
| COD ID: 1505067 | |
| CIF file | Formula: - C22 H21 Cl N O7 - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P -1 Cell volume: 1041.6 Cell parameters: 10.188; 10.745; 10.888; 72.261; 66.57; 83.284; |
| COD ID: 1505068 | |
| CIF file | Formula: - C21 H16 Cl4 N2 O6 - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P -1 Cell volume: 1158.7 Cell parameters: 10.422; 10.711; 10.787; 87.701; 74.392; 89.976; |
| COD ID: 1505069 | |
| CIF file | Formula: - C8 H6 O4 - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P 1 21/n 1 Cell volume: 342.76 Cell parameters: 6.5845; 5.2356; 9.99; 90; 95.582; 90; |
| COD ID: 1505070 | |
| CIF file | Formula: - C8 H6 Cl6 O4 Sb - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P -1 Cell volume: 584.1 Cell parameters: 7.982; 7.9976; 10.609; 96.96; 107.75; 110.499; |
| COD ID: 1505071 | |
| CIF file | Formula: - C12 H14 O4 - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P -1 Cell volume: 287.6 Cell parameters: 5.8509; 6.7912; 7.6199; 75.221; 85.481; 79.402; |
| COD ID: 1505072 | |
| CIF file | Formula: - C19 H22 Cl6 N0 O4 Sb - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P -1 Cell volume: 1423 Cell parameters: 7.8863; 14.082; 14.387; 113.899; 101.326; 91.302; |
| COD ID: 1505073 | |
| CIF file | Formula: - C16 H16 N6 - Comments: Sun, Duoli; Rosokha, Sergiy V.; Kochi, Jay K. Reversible interchange of charge-transfer versus electron-transfer states in organic electron transfer via cross-exchanges between diamagnetic (donor/acceptor) dyads. The journal of physical chemistry. B 111(24) (2007) 6655-6666 Space group: P 1 21/n 1 Cell volume: 1490 Cell parameters: 10.448; 8.208; 17.462; 90; 95.726; 90; |
| COD ID: 1505074 | |
| CIF file | Formula: - C28 H7 Cl F12 Hg3 - Comments: Elbjeirami, O.; Burress, C.N.; Gabbai, F.P.; Omary, M.A. Simultaneous External and Internal Heavy-Atom Effects in Binary Adducts of 1-Halonaphthalenes with Trinuclear Perfluoro-ortho-phenylene Mercury(II): A Structural and Photophysical Study Journal of Physical Chemistry C 111(26) (2007) 9522 Space group: P 1 21/n 1 Cell volume: 2622.9 Cell parameters: 20.069; 6.8937; 20.918; 90; 115; 90; |
| COD ID: 1505075 | |
| CIF file | Formula: - C28 H7 Br F12 Hg3 - Comments: Elbjeirami, O.; Burress, C.N.; Gabbai, F.P.; Omary, M.A. Simultaneous External and Internal Heavy-Atom Effects in Binary Adducts of 1-Halonaphthalenes with Trinuclear Perfluoro-ortho-phenylene Mercury(II): A Structural and Photophysical Study Journal of Physical Chemistry C 111(26) (2007) 9522 Space group: P -1 Cell volume: 2703.5 Cell parameters: 7.5525; 15.968; 22.542; 88.35; 85; 86.94; |
| COD ID: 1505076 | |
| CIF file | Formula: - C28 H7 F12 Hg3 I - Comments: Elbjeirami, O.; Burress, C.N.; Gabbai, F.P.; Omary, M.A. Simultaneous External and Internal Heavy-Atom Effects in Binary Adducts of 1-Halonaphthalenes with Trinuclear Perfluoro-ortho-phenylene Mercury(II): A Structural and Photophysical Study Journal of Physical Chemistry C 111(26) (2007) 9522 Space group: P 1 21/c 1 Cell volume: 2723.3 Cell parameters: 15.993; 7.5544; 22.787; 90; 98.43; 90; |
| COD ID: 1505077 | |
| CIF file | Formula: - C33 H32 O S2 - Comments: Liu, Y.; Tao, X.; Wang, F.; Shi, J.; Sun, J.; Yu, W.; Ren, Y.; Zou, D.; Jiang, M. Intermolecular Hydrogen Bonds Induce Highly Emissive Excimers: Enhancement of Solid-State Luminescence Journal of Physical Chemistry C 111(17) (2007) 6544 Space group: C 1 2/c 1 Cell volume: 5430.9 Cell parameters: 44.525; 6.2063; 19.6664; 90; 92.087; 90; |
| COD ID: 1505078 | |
| CIF file | Formula: - C H11 B10 P - Comments: Balaz, Snjezana; Caruso, A. N.; Platt, N. P.; Dimov, D. I.; Boag, N. M.; Brand, J. I.; Losovyj, Ya B.; Dowben, P. A. The influence of the molecular dipole on the electronic structure of isomeric icosahedral dicarbadodecaborane and phosphacarbadodecaborane molecular films. The journal of physical chemistry. B 111(25) (2007) 7009-7016 Space group: P a -3 Cell volume: 924.5 Cell parameters: 9.7418; 9.7418; 9.7418; 90; 90; 90; |
| COD ID: 1505079 | |
| CIF file | Formula: - C45 H54 N4 O11 S2 - Comments: Yuan, C.-X.; Tao, X.-T.; Ren, Y.; Li, Y.; Yang, J.-X.; Yu, W.-T.; Wang, L.; Jiang, M.-H. Synthesis, Structure, and Aggregation-Induced Emission of a Novel Lambda (Λ)-Shaped Pyridinium Salt Based on Tröger's Base Journal of Physical Chemistry C 111(34) (2007) 12811 Space group: C 1 2/c 1 Cell volume: 9065 Cell parameters: 34.527; 10.543; 29.876; 90; 123.54; 90; |
| COD ID: 1505080 | |
| CIF file | Formula: - C3 H21.33 O8.67 - Comments: Udachin, Konstantin A.; Ratcliffe, Christopher I.; Ripmeester, John A. Structure, dynamics and ordering in structure i ether clathrate hydrates from single-crystal X-ray diffraction and 2H NMR spectroscopy. The journal of physical chemistry. B 111(39) (2007) 11366-11372 Space group: P m -3 n Cell volume: 1758 Cell parameters: 12.069; 12.069; 12.069; 90; 90; 90; |
| COD ID: 1505081 | |
| CIF file | Formula: - C2.28 H19.9 O8.81 - Comments: Udachin, Konstantin A.; Ratcliffe, Christopher I.; Ripmeester, John A. Structure, dynamics and ordering in structure i ether clathrate hydrates from single-crystal X-ray diffraction and 2H NMR spectroscopy. The journal of physical chemistry. B 111(39) (2007) 11366-11372 Space group: P m -3 n Cell volume: 1704.5 Cell parameters: 11.9454; 11.9454; 11.9454; 90; 90; 90; |
| COD ID: 1505082 | |
| CIF file | Formula: - C25 H38 N2 O Si - Comments: Busygin, I.; Tkachenko, O.P.; Nieminen, V.; Borokov, V.Yu.; Sillanpaa, R.; Toukoniitty, E.; Kustov, L.M.; Murzin, D.Yu.; Leino, R. Interaction of Cinchonidine and 1-Phenyl-1,2-Propanedione on the Surface of a Chirally Modified Pt/Al2O3 Hydrogenation Catalyst Journal of Physical Chemistry C 111(26) (2007) 9374 Space group: P 1 21 1 Cell volume: 1192.63 Cell parameters: 9.9567; 7.9025; 15.4975; 90; 102.025; 90; |
| COD ID: 1505083 | |
| CIF file | Formula: - C36 H44 N2 O2 - Comments: Wang, J.; Zhao, Y.; Zhang, J.; Zhang, J.; Yang, B.; Wang, Y.; Zhang, D.; You, H.; Ma, D. Assembly of One-Dimensional Organic Luminescent Nanowires Based on Quinacridone Derivatives Journal of Physical Chemistry C 111(26) (2007) 9177 Space group: P 1 21/n 1 Cell volume: 1517.35 Cell parameters: 9.9439; 11.0047; 13.9991; 90; 97.908; 90; |
| COD ID: 1505084 | |
| CIF file | Formula: - C190 H175 Au25 Cl2 F12 P10 S5 Sb2 - Comments: Shichibu, Y.; Negishi, Y.; Watanabe, T.; Chaki, N.K.; Kawaguchi, H.; Tsukuda, T. Biicosahedral Gold Clusters [Au25(PPh3)10(SCnH2n+1)5Cl2]2+ (n = 2-18): A Stepping Stone to Cluster-Assembled Materials Journal of Physical Chemistry C 111(22) (2007) 7845 Space group: P -1 Cell volume: 10489 Cell parameters: 16.53; 20.372; 31.649; 89.77; 79.83; 89.14; |
| COD ID: 1505085 | |
| CIF file | Formula: - C28 H24 O2 - Comments: Tong, Hui; Hong, Yuning; Dong, Yongqiang; Häussler, Matthias; Li, Zhen; Lam, Jacky W. Y.; Dong, Yuping; Sung, Herman H.-Y.; Williams, Ian D.; Tang, Ben Zhong Protein detection and quantitation by tetraphenylethene-based fluorescent probes with aggregation-induced emission characteristics. The journal of physical chemistry. B 111(40) (2007) 11817-11823 Space group: P 1 21 1 Cell volume: 1045.6 Cell parameters: 9.6751; 10.2214; 10.6522; 90; 96.993; 90; |
| COD ID: 1505086 | |
| CIF file | Formula: - C7 H18 Cl2 N2 - Comments: Regler, Brian P.; Emge, Thomas J.; Elliott, James J.; Sauers, Ronald R.; Potenza, Joseph A.; Romsted, Laurence S. Structural, infrared, and density functional theory studies of N,N,N',N'-Tetramethylimidazolidinium dichloride: a model for cation-anion association of headgroups and counterions in the interfacial regions of gemini micelles. The journal of physical chemistry. B 111(49) (2007) 13668-13674 Space group: P 1 21/c 1 Cell volume: 1036.81 Cell parameters: 8.1775; 11.2472; 11.474; 90; 100.745; 90; |
| COD ID: 1505087 | |
| CIF file | Formula: - C6 H11 I N2 O - Comments: Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J. Revisiting ether-derivatized imidazolium-based ionic liquids. The journal of physical chemistry. B 111(34) (2007) 10095-10108 Space group: P 1 21/n 1 Cell volume: 940.13 Cell parameters: 8.3743; 12.0821; 9.6014; 90; 104.59; 90; |
| COD ID: 1505088 | |
| CIF file | Formula: - C7 H13 I N2 O - Comments: Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J. Revisiting ether-derivatized imidazolium-based ionic liquids. The journal of physical chemistry. B 111(34) (2007) 10095-10108 Space group: P 1 21/n 1 Cell volume: 2090.46 Cell parameters: 9.4059; 16.3399; 13.6066; 90; 91.547; 90; |
| COD ID: 1505089 | |
| CIF file | Formula: - C7 H13 I N2 O - Comments: Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J. Revisiting ether-derivatized imidazolium-based ionic liquids. The journal of physical chemistry. B 111(34) (2007) 10095-10108 Space group: P c a 21 Cell volume: 4114.2 Cell parameters: 15.2411; 8.2598; 32.681; 90; 90; 90; |
| COD ID: 1505090 | |
| CIF file | Formula: - C8 H15 I N2 O2 - Comments: Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J. Revisiting ether-derivatized imidazolium-based ionic liquids. The journal of physical chemistry. B 111(34) (2007) 10095-10108 Space group: P 1 21/n 1 Cell volume: 1139.65 Cell parameters: 9.5223; 8.0828; 15.406; 90; 106.029; 90; |
| COD ID: 1505091 | |
| CIF file | Formula: - C9 H17 Br N2 O2 - Comments: Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J. Revisiting ether-derivatized imidazolium-based ionic liquids. The journal of physical chemistry. B 111(34) (2007) 10095-10108 Space group: P 1 21/c 1 Cell volume: 1195.5 Cell parameters: 7.155; 14.609; 11.88; 90; 105.698; 90; |
| COD ID: 1505092 | |
| CIF file | Formula: - C9 H17 I N2 O2 - Comments: Fei, Zhaofu; Ang, Wee Han; Zhao, Dongbin; Scopelliti, Rosario; Zvereva, Elena E.; Katsyuba, Sergey A.; Dyson, Paul J. Revisiting ether-derivatized imidazolium-based ionic liquids. The journal of physical chemistry. B 111(34) (2007) 10095-10108 Space group: P 1 21/n 1 Cell volume: 1237.4 Cell parameters: 9.7948; 13.0859; 9.9372; 90; 103.711; 90; |
| COD ID: 1505093 | |
| CIF file | Formula: - C48 H52 N4 O16 Re4 - Comments: Thanasekaran, P.; Wu, Jing-Yun; Manimaran, Bala; Rajendran, T.; Chang, I-Jy; Rajagopal, S.; Lee, Gene-Hsiang; Peng, Shie-Ming; Lu, Kuang-Lieh Aggregate of alkoxy-bridged Re(I)-rectangles as a probe for photoluminescence quenching. The journal of physical chemistry. A 111(43) (2007) 10953-10960 Space group: P 1 21/n 1 Cell volume: 2617.6 Cell parameters: 9.2803; 18.613; 15.189; 90; 93.9; 90; |
| COD ID: 1505094 | |
| CIF file | Formula: - C32 H16 - Comments: Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T. Enantiotropic Polymorphism in Di-indenoperylene Journal of Physical Chemistry C 111(51) (2007) 18878 Space group: P -1 Cell volume: 1916.9 Cell parameters: 11.4616; 12.8653; 14.7649; 97.696; 98.263; 114.376; |
| COD ID: 1505095 | |
| CIF file | Formula: - C32 H16 - Comments: Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T. Enantiotropic Polymorphism in Di-indenoperylene Journal of Physical Chemistry C 111(51) (2007) 18878 Space group: P -1 Cell volume: 1937.4 Cell parameters: 11.5164; 12.9066; 14.8197; 97.872; 98.19; 114.443; |
| COD ID: 1505096 | |
| CIF file | Formula: - C32 H16 - Comments: Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T. Enantiotropic Polymorphism in Di-indenoperylene Journal of Physical Chemistry C 111(51) (2007) 18878 Space group: P -1 Cell volume: 1962.3 Cell parameters: 11.5824; 12.9617; 14.8812; 98.128; 98.091; 114.516; |
| COD ID: 1505097 | |
| CIF file | Formula: - C32 H16 - Comments: Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T. Enantiotropic Polymorphism in Di-indenoperylene Journal of Physical Chemistry C 111(51) (2007) 18878 Space group: P -1 Cell volume: 1979.7 Cell parameters: 11.6284; 12.9916; 14.9311; 98.294; 98.05; 114.543; |
| COD ID: 1505098 | |
| CIF file | Formula: - C32 H16 - Comments: Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T. Enantiotropic Polymorphism in Di-indenoperylene Journal of Physical Chemistry C 111(51) (2007) 18878 Space group: P -1 Cell volume: 1985.2 Cell parameters: 11.6432; 13.0004; 14.948; 98.36; 98.042; 114.545; |
| COD ID: 1505099 | |
| CIF file | Formula: - C32 H16 - Comments: Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T. Enantiotropic Polymorphism in Di-indenoperylene Journal of Physical Chemistry C 111(51) (2007) 18878 Space group: P -1 Cell volume: 1991.3 Cell parameters: 11.6592; 13.0102; 14.9663; 98.44; 98.023; 114.548; |
| COD ID: 1505100 | |
| CIF file | Formula: - C32 H16 - Comments: Heinrich, M.A.; Pflaum, J.; Tripathi, A.K.; Frey, W.; Steigerwald, M.L.; Siegrist, T. Enantiotropic Polymorphism in Di-indenoperylene Journal of Physical Chemistry C 111(51) (2007) 18878 Space group: P 1 21/a 1 Cell volume: 1028.95 Cell parameters: 7.1709; 8.5496; 16.7981; 90; 92.416; 90; |
| COD ID: 1505101 | |
| CIF file | Formula: - C28 H14 Br2 N6 O2 - Comments: Patra, A.; Hebalkar, N.; Sreedhar, B.; Radhakrishnan, T.P. Formation and Growth of Molecular Nanocrystals Probed by their Optical Properties Journal of Physical Chemistry C 111(44) (2007) 16184 Space group: P -1 Cell volume: 1427.54 Cell parameters: 9.2737; 12.4464; 14.1679; 94.581; 107.837; 110.335; |
| COD ID: 1505102 | |
| CIF file | Formula: - C12 H8 N2 S2 - Comments: Dufresne, Stéphane; Hanan, Garry S.; Skene, W. G. Preparation, photophysics, and electrochemistry of segmented comonomers consisting of thiophene and pyrimidine units: new monomers for hybrid copolymers. The journal of physical chemistry. B 111(39) (2007) 11407-11418 Space group: P 1 21/c 1 Cell volume: 2237.9 Cell parameters: 19.194; 11.297; 10.366; 90; 95.35; 90; |
| COD ID: 1505103 | |
| CIF file | Formula: - C2 H10 N8 O6 S2 Zn - Comments: Novaković, Sladjana B; Bogdanović, Goran A; Fraisse, Bernard; Ghermani, Nour Eddine; Bouhmaida, Nouzha; Spasojević-de Biré, Anne Topological features of both electron density and electrostatic potential in the bis(thiosemicarbazide)zinc(II) dinitrate complex. The journal of physical chemistry. A 111(51) (2007) 13492-13505 Space group: C 1 2/c 1 Cell volume: 1150.91 Cell parameters: 10.9541; 7.5673; 14.1753; 90; 101.63; 90; |
| COD ID: 1505104 | |
| CIF file | Formula: - C12 H29 N O49 Si24 - Comments: Schmidt, Wolfgang; Wilczok, Ursula; Weidenthaler, Claudia; Medenbach, Olaf; Goddard, Richard; Buth, Gernot; Cepak, Alexander Preparation and morphology of pyramidal MFI single-crystal segments. The journal of physical chemistry. B 111(48) (2007) 13538-13543 Space group: P n m a Cell volume: 5363.94 Cell parameters: 20.0578; 19.9466; 13.407; 90; 90; 90; |
| COD ID: 1505105 | |
| CIF file | Formula: - C12 H29 N O49 Si24 - Comments: Schmidt, Wolfgang; Wilczok, Ursula; Weidenthaler, Claudia; Medenbach, Olaf; Goddard, Richard; Buth, Gernot; Cepak, Alexander Preparation and morphology of pyramidal MFI single-crystal segments. The journal of physical chemistry. B 111(48) (2007) 13538-13543 Space group: P n m a Cell volume: 5380.2 Cell parameters: 20.0837; 19.97; 13.4146; 90; 90; 90; |
| COD ID: 1505106 | |
| CIF file | Formula: - O2 Si - Comments: Schmidt, Wolfgang; Wilczok, Ursula; Weidenthaler, Claudia; Medenbach, Olaf; Goddard, Richard; Buth, Gernot; Cepak, Alexander Preparation and morphology of pyramidal MFI single-crystal segments. The journal of physical chemistry. B 111(48) (2007) 13538-13543 Space group: P 1 21/n 1 Cell volume: 5356 Cell parameters: 13.382; 20.125; 19.89; 90; 90.547; 90; |
| COD ID: 1505107 | |
| CIF file | Formula: - C14 H18 O7 - Comments: Nath, K.G.; Ivasenko, O.; MacLeod, J.M.; Miwa, J.A.; Wuest, J.D.; Nanci, A.; Perepichka, D.F.; Rosei, F. Crystal Engineering in Two Dimensions: An Approach to Molecular Nanopatterning Journal of Physical Chemistry C 111(45) (2007) 16996 Space group: P -1 Cell volume: 745.69 Cell parameters: 8.2498; 8.4731; 11.977; 94.3739; 104.872; 110.386; |
| COD ID: 1505108 | |
| CIF file | Formula: - C13 H16 O7 - Comments: Nath, K.G.; Ivasenko, O.; MacLeod, J.M.; Miwa, J.A.; Wuest, J.D.; Nanci, A.; Perepichka, D.F.; Rosei, F. Crystal Engineering in Two Dimensions: An Approach to Molecular Nanopatterning Journal of Physical Chemistry C 111(45) (2007) 16996 Space group: P -1 Cell volume: 675.9 Cell parameters: 9.0542; 9.0561; 9.2927; 63.157; 88.488; 83.962; |
| COD ID: 1505109 | |
| CIF file | Formula: - C15 H20 O7 - Comments: Nath, K.G.; Ivasenko, O.; MacLeod, J.M.; Miwa, J.A.; Wuest, J.D.; Nanci, A.; Perepichka, D.F.; Rosei, F. Crystal Engineering in Two Dimensions: An Approach to Molecular Nanopatterning Journal of Physical Chemistry C 111(45) (2007) 16996 Space group: P -1 Cell volume: 765.37 Cell parameters: 8.2763; 8.6205; 11.993; 104.199; 93.133; 110.892; |
| COD ID: 1505110 | |
| CIF file | Formula: - C36 H22 F10 - Comments: Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki Fluorinated diphenylpolyenes: crystal structures and emission properties. The journal of physical chemistry. A 111(51) (2007) 13441-13451 Space group: P -1 Cell volume: 715.1 Cell parameters: 6.062; 8.22; 14.48; 85.41; 89.54; 83.89; |
| COD ID: 1505111 | |
| CIF file | Formula: - C18 H14 F2 - Comments: Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki Fluorinated diphenylpolyenes: crystal structures and emission properties. The journal of physical chemistry. A 111(51) (2007) 13441-13451 Space group: P -1 Cell volume: 1370.7 Cell parameters: 9.582; 11.523; 12.89; 85.425; 84.296; 75.81; |
| COD ID: 1505112 | |
| CIF file | Formula: - C18 H12 F4 - Comments: Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki Fluorinated diphenylpolyenes: crystal structures and emission properties. The journal of physical chemistry. A 111(51) (2007) 13441-13451 Space group: P -1 Cell volume: 353.8 Cell parameters: 6.752; 7.414; 7.515; 85.677; 73.17; 79.341; |
| COD ID: 1505113 | |
| CIF file | Formula: - C18 H10 F6 - Comments: Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki Fluorinated diphenylpolyenes: crystal structures and emission properties. The journal of physical chemistry. A 111(51) (2007) 13441-13451 Space group: P -1 Cell volume: 355.15 Cell parameters: 6.9822; 7.2167; 7.3338; 88.901; 79.877; 77.54; |
| COD ID: 1505114 | |
| CIF file | Formula: - C18 H6 F10 - Comments: Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki Fluorinated diphenylpolyenes: crystal structures and emission properties. The journal of physical chemistry. A 111(51) (2007) 13441-13451 Space group: P -1 Cell volume: 384.39 Cell parameters: 5.9392; 8.1021; 8.5594; 80.335; 78.54; 73.542; |
| COD ID: 1505115 | |
| CIF file | Formula: - C18 H11 F5 - Comments: Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki Fluorinated diphenylpolyenes: crystal structures and emission properties. The journal of physical chemistry. A 111(51) (2007) 13441-13451 Space group: P -1 Cell volume: 714.2 Cell parameters: 6.0911; 8.179; 14.72; 78.667; 87.639; 83.47; |
| COD ID: 1505116 | |
| CIF file | Formula: - C28 H11 F18 N O2 - Comments: Yu, Sze-Man; Berkefeld, Andreas; Göttker-Schnetmann, Inigo; Müller, Gerhard; Mecking, Stefan Synthesis of Aqueous Polyethylene Dispersions with Electron-Deficient Neutral Nickel(II) Catalysts with Enolatoimine Ligands Macromolecules 40(3) (2007) 421 Space group: P 1 21 1 Cell volume: 1389.7 Cell parameters: 8.2269; 15.4634; 11.0881; 90; 99.872; 90; |
| COD ID: 1505117 | |
| CIF file | Formula: - C21 H14 B I2 N O - Comments: Nagata, Yuuya; Chujo, Yoshiki Main-Chain-Type Organoboron Quinolate Polymers: Synthesis and Photoluminescence Properties Macromolecules 40(1) (2007) 6 Space group: P -1 Cell volume: 1872.9 Cell parameters: 10.152; 11.566; 17.265; 99.561; 90.613; 110.05; |
| COD ID: 1505118 | |
| CIF file | Formula: - C36 H55 Al N2 O2 - Comments: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity Macromolecules 40(6) (2007) 1904 Space group: P 1 21/c 1 Cell volume: 3443.8 Cell parameters: 11.4152; 26.7147; 11.664; 90; 104.492; 90; |
| COD ID: 1505119 | |
| CIF file | Formula: - C24.5 H29 Al N2 O2 - Comments: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity Macromolecules 40(6) (2007) 1904 Space group: C 1 2/c 1 Cell volume: 4448.9 Cell parameters: 28.122; 10.3119; 18.5167; 90; 124.053; 90; |
| COD ID: 1505120 | |
| CIF file | Formula: - C21 H21 Al Cl4 N2 O2 - Comments: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity Macromolecules 40(6) (2007) 1904 Space group: P 1 21/n 1 Cell volume: 2291.5 Cell parameters: 11.3955; 17.6046; 11.5904; 90; 99.763; 90; |
| COD ID: 1505121 | |
| CIF file | Formula: - C22 H23 Al Cl4 N2 O3 - Comments: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity Macromolecules 40(6) (2007) 1904 Space group: C 1 c 1 Cell volume: 4883.9 Cell parameters: 13.7448; 17.259; 21.561; 90; 107.278; 90; |
| COD ID: 1505122 | |
| CIF file | Formula: - C18 H15 Al Cl4 N2 O2 - Comments: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity Macromolecules 40(6) (2007) 1904 Space group: P 1 21/c 1 Cell volume: 1937.8 Cell parameters: 13.4404; 14.5891; 10.7266; 90; 112.879; 90; |
| COD ID: 1505123 | |
| CIF file | Formula: - C22 H27 Al N2 O3 - Comments: Du, Hongzhi; Pang, Xuan; Yu, Haiyang; Zhuang, Xiuli; Chen, Xuesi; Cui, Dongmei; Wang, Xianhong; Jing, Xiabin Polymerization ofrac-Lactide Using Schiff Base Aluminum Catalysts: Structure, Activity, and Stereoselectivity Macromolecules 40(6) (2007) 1904 Space group: P 1 21/c 1 Cell volume: 2064.2 Cell parameters: 11.0321; 10.2287; 18.3383; 90; 94.061; 90; |
| COD ID: 1505124 | |
| CIF file | Formula: - C70 H100 F10 O4 - Comments: Woody, Kathy B.; Bullock, Joseph E.; Parkin, Sean R.; Watson, Mark D. Alternating Arene−Perfluoroarene Poly(phenylene ethynylenes) Macromolecules 40(13) (2007) 4470 Space group: P -1 Cell volume: 1629.96 Cell parameters: 7.476; 10.075; 21.871; 92.96; 96.22; 94.345; |
| COD ID: 1505125 | |
| CIF file | Formula: - C46 H62 O4 - Comments: Woody, Kathy B.; Bullock, Joseph E.; Parkin, Sean R.; Watson, Mark D. Alternating Arene−Perfluoroarene Poly(phenylene ethynylenes) Macromolecules 40(13) (2007) 4470 Space group: P 1 21/n 1 Cell volume: 2020.79 Cell parameters: 18.0411; 4.3133; 26.474; 90; 101.214; 90; |
| COD ID: 1505126 | |
| CIF file | Formula: - C45 H54 Hf N2 - Comments: Domski, Gregory J.; Lobkovsky, Emil B.; Coates, Geoffrey W. Polymerization of α-Olefins with Pyridylamidohafnium Catalysts: Living Behavior and Unexpected Isoselectivity from aCs-Symmetric Catalyst Precursor Macromolecules 40(9) (2007) 3510 Space group: P -1 Cell volume: 1929 Cell parameters: 11.0552; 12.727; 14.9106; 84.318; 83.423; 68.015; |
| COD ID: 1505127 | |
| CIF file | Formula: - C33 H40 Hf N2 - Comments: Domski, Gregory J.; Lobkovsky, Emil B.; Coates, Geoffrey W. Polymerization of α-Olefins with Pyridylamidohafnium Catalysts: Living Behavior and Unexpected Isoselectivity from aCs-Symmetric Catalyst Precursor Macromolecules 40(9) (2007) 3510 Space group: P -1 Cell volume: 1446.09 Cell parameters: 11.0762; 11.953; 12.8362; 79.555; 66.82; 67.872; |
| COD ID: 1505128 | |
| CIF file | Formula: - C32 H36 Hf N2 - Comments: Domski, Gregory J.; Lobkovsky, Emil B.; Coates, Geoffrey W. Polymerization of α-Olefins with Pyridylamidohafnium Catalysts: Living Behavior and Unexpected Isoselectivity from aCs-Symmetric Catalyst Precursor Macromolecules 40(9) (2007) 3510 Space group: P -1 Cell volume: 1371.63 Cell parameters: 9.3898; 10.7845; 13.8529; 87.005; 78.576; 86.78; |
| COD ID: 1505129 | |
| CIF file | Formula: - C16 H13 N3 O - Comments: Qin, Anjun; Jim, Cathy K. W.; Lu, Weixin; Lam, Jacky W. Y.; Häussler, Matthias; Dong, Yongqiang; Sung, Herman H. Y.; Williams, Ian D.; Wong, George K. L.; Tang, Ben Zhong Click Polymerization: Facile Synthesis of Functional Poly(aroyltriazole)s by Metal-Free, Regioselective 1,3-Dipolar Polycycloaddition Macromolecules 40(7) (2007) 2308 Space group: P -1 Cell volume: 1320.1 Cell parameters: 10.921; 11.414; 11.879; 86.788; 63.327; 86.606; |
| COD ID: 1505130 | |
| CIF file | Formula: - C24 H15 N O2 - Comments: Qin, Anjun; Lam, Jacky W. Y.; Dong, Hongchen; Lu, Weixin; Jim, Cathy K. W.; Dong, Yongqiang; Häussler, Matthias; Sung, Herman H. Y.; Williams, Ian D.; Wong, George K. L.; Tang, Ben Zhong Metal-Free, Regioselective Diyne Polycyclotrimerization: Synthesis, Photoluminescence, Solvatochromism, and Two-Photon Absorption of a Triphenylamine-Containing Hyperbranched Poly(aroylarylene) Macromolecules 40(14) (2007) 4879 Space group: P 1 21/n 1 Cell volume: 1824.7 Cell parameters: 10.3535; 10.2064; 17.3231; 90; 94.573; 90; |
| COD ID: 1505131 | |
| CIF file | Formula: - C21 H15 N O - Comments: Qin, Anjun; Lam, Jacky W. Y.; Dong, Hongchen; Lu, Weixin; Jim, Cathy K. W.; Dong, Yongqiang; Häussler, Matthias; Sung, Herman H. Y.; Williams, Ian D.; Wong, George K. L.; Tang, Ben Zhong Metal-Free, Regioselective Diyne Polycyclotrimerization: Synthesis, Photoluminescence, Solvatochromism, and Two-Photon Absorption of a Triphenylamine-Containing Hyperbranched Poly(aroylarylene) Macromolecules 40(14) (2007) 4879 Space group: P 1 21/c 1 Cell volume: 1530.8 Cell parameters: 15.3215; 10.6382; 9.4347; 90; 95.448; 90; |
| COD ID: 1505132 | |
| CIF file | Formula: - C21 H14 Br2 F9 O4.5 - Comments: Sakakibara, Ken; Nakano, Koji; Nozaki, Kyoko Regioregular Polymerization of Fluorine-Containing Epoxides Macromolecules 40(17) (2007) 6136 Space group: I 4 Cell volume: 4891 Cell parameters: 29.61; 29.61; 5.579; 90; 90; 90; |
| COD ID: 1505133 | |
| CIF file | Formula: - C16 H10 F5 I O4 - Comments: Sakakibara, Ken; Nakano, Koji; Nozaki, Kyoko Regioregular Polymerization of Fluorine-Containing Epoxides Macromolecules 40(17) (2007) 6136 Space group: P 1 21 1 Cell volume: 823 Cell parameters: 5.32; 8.24; 18.92; 90; 96.93; 90; |
| COD ID: 1505134 | |
| CIF file | Formula: - C23 H13 F5 I2 O4 - Comments: Sakakibara, Ken; Nakano, Koji; Nozaki, Kyoko Regioregular Polymerization of Fluorine-Containing Epoxides Macromolecules 40(17) (2007) 6136 Space group: P 21 21 21 Cell volume: 2308.7 Cell parameters: 5.7; 19.459; 20.815; 90; 90; 90; |
| COD ID: 1505135 | |
| CIF file | Formula: - C20 H30 N O - Comments: Debuigne, Antoine; Chan-Seng, Delphine; Li, Lichun; Hamer, Gordon K.; Georges, Michael K. Synthesis and Evaluation of Sterically Hindered 1,1-Diadamantyl Nitroxide as a Low-Temperature Mediator for the Stable Free Radical Polymerization Process Macromolecules 40(17) (2007) 6224 Space group: P n m a Cell volume: 1605.5 Cell parameters: 20.64; 6.718; 11.579; 90; 90; 90; |
| COD ID: 1505136 | |
| CIF file | Formula: - C35 H43 N O3 - Comments: Debuigne, Antoine; Chan-Seng, Delphine; Li, Lichun; Hamer, Gordon K.; Georges, Michael K. Synthesis and Evaluation of Sterically Hindered 1,1-Diadamantyl Nitroxide as a Low-Temperature Mediator for the Stable Free Radical Polymerization Process Macromolecules 40(17) (2007) 6224 Space group: P -1 Cell volume: 1372.57 Cell parameters: 6.3916; 14.6153; 15.2826; 75.722; 84.056; 84.58; |
| COD ID: 1505137 | |
| CIF file | Formula: - C24 H31 N O3 - Comments: Debuigne, Antoine; Chan-Seng, Delphine; Li, Lichun; Hamer, Gordon K.; Georges, Michael K. Synthesis and Evaluation of Sterically Hindered 1,1-Diadamantyl Nitroxide as a Low-Temperature Mediator for the Stable Free Radical Polymerization Process Macromolecules 40(17) (2007) 6224 Space group: P -1 Cell volume: 2106.44 Cell parameters: 6.3039; 15.2176; 22.4312; 80.19; 85.752; 84.344; |
| COD ID: 1505138 | |
| CIF file | Formula: - C12 H32 Cl4 O6 Ti2 - Comments: Gueta-Neyroud, Tal; Tumanskii, Boris; Kapon, Moshe; Eisen, Moris S. Synthesis and Characterization of Dichlorotitanium Alkoxide Complex and Its Activity in the Polymerization of α-Olefins Macromolecules 40(15) (2007) 5261 Space group: P -1 Cell volume: 595.87 Cell parameters: 7.186; 9.546; 9.894; 63.082; 86.77; 80.046; |
| COD ID: 1505139 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1901.5 Cell parameters: 35.233; 5.694; 9.603; 90; 99.248; 90; |
| COD ID: 1505140 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1982 Cell parameters: 36.6; 5.488; 10.054; 90; 101.03; 90; |
| COD ID: 1505141 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1845.1 Cell parameters: 34.738; 5.7074; 9.4062; 90; 98.357; 90; |
| COD ID: 1505142 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1846.3 Cell parameters: 34.714; 5.7047; 9.4233; 90; 98.352; 90; |
| COD ID: 1505143 | |
| CIF file | Formula: - C24 H26 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 2185 Cell parameters: 39.539; 5.7087; 9.6807; 90; 90.464; 90; |
| COD ID: 1505144 | |
| CIF file | Formula: - C24 H26 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 2165.9 Cell parameters: 40.046; 5.616; 9.632; 90; 91.05; 90; |
| COD ID: 1505145 | |
| CIF file | Formula: - C24 H26 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 2081.7 Cell parameters: 38.96; 5.714; 9.351; 90; 90.27; 90; |
| COD ID: 1505146 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1905 Cell parameters: 35.4; 5.677; 9.614; 90; 99.59; 90; |
| COD ID: 1505147 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1944 Cell parameters: 35.66; 5.712; 9.662; 90; 99; 90; |
| COD ID: 1505148 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1898.8 Cell parameters: 35.33; 5.687; 9.574; 90; 99.224; 90; |
| COD ID: 1505149 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1914.2 Cell parameters: 35.436; 5.7178; 9.566; 90; 99.033; 90; |
| COD ID: 1505150 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1901.6 Cell parameters: 35.254; 5.714; 9.551; 90; 98.736; 90; |
| COD ID: 1505151 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1893.6 Cell parameters: 35.339; 5.699; 9.517; 90; 98.9; 90; |
| COD ID: 1505152 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1890.6 Cell parameters: 35.289; 5.6995; 9.516; 90; 98.96; 90; |
| COD ID: 1505153 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1879.8 Cell parameters: 35.223; 5.6846; 9.5; 90; 98.793; 90; |
| COD ID: 1505154 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1865 Cell parameters: 35.066; 5.687; 9.466; 90; 98.89; 90; |
| COD ID: 1505155 | |
| CIF file | Formula: - C22 H22 O6 - Comments: Furukawa, Daisuke; Matsumoto, Akikazu Reaction Mechanism Based on X-ray Crystal Structure Analysis during the Solid-State Polymerization of Muconic Esters Macromolecules 40(17) (2007) 6048 Space group: C 1 2/c 1 Cell volume: 1850 Cell parameters: 34.68; 5.714; 9.43; 90; 98.21; 90; |
| COD ID: 1505156 | |
| CIF file | Formula: - C23 H19 N3 O2 - Comments: Fujii, Toru; Shiotsuki, Masashi; Inai, Yoshihito; Sanda, Fumio; Masuda, Toshio Synthesis of Helical Poly(N-propargylamides) Carrying Azobenzene Moieties in Side Chains. Reversible Arrangement-Disarrangement of Helical Side Chain Arrays upon Photoirradiation Keeping Helical Main Chain Intact Macromolecules 40(20) (2007) 7079 Space group: P 1 21 1 Cell volume: 951.6 Cell parameters: 12.132; 5.2501; 14.966; 90; 93.362; 90; |
| COD ID: 1505157 | |
| CIF file | Formula: - C33 H36 Cl2 Ir2 Mo2 O10 - Comments: Randles, Michael D.; Lucas, Nigel T.; Cifuentes, Marie P.; Humphrey, Mark G.; Smith, Matthew K.; Willis, Anthony C.; Samoc, Marek Mixed-Metal Cluster Chemistry. 30.1Syntheses and Optical Limiting Properties of Cluster-Containing Oligo- and Polyurethanes Macromolecules 40(22) (2007) 7807 Space group: P 1 21/n 1 Cell volume: 3718.28 Cell parameters: 9.3573; 27.8567; 14.4282; 90; 98.634; 90; |
| COD ID: 1505158 | |
| CIF file | Formula: - C42.5 H56 Cl Ir2 Mo2 N2 O12.5 - Comments: Randles, Michael D.; Lucas, Nigel T.; Cifuentes, Marie P.; Humphrey, Mark G.; Smith, Matthew K.; Willis, Anthony C.; Samoc, Marek Mixed-Metal Cluster Chemistry. 30.1Syntheses and Optical Limiting Properties of Cluster-Containing Oligo- and Polyurethanes Macromolecules 40(22) (2007) 7807 Space group: P 1 21/n 1 Cell volume: 4930.5 Cell parameters: 9.2483; 14.1908; 37.5723; 90; 90.836; 90; |
| COD ID: 1505159 | |
| CIF file | Formula: - C22 H30 N2 S3 - Comments: Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B. Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains Macromolecules 40(18) (2007) 6585 Space group: P b c n Cell volume: 4492.1 Cell parameters: 38.741; 12.0548; 9.6188; 90; 90; 90; |
| COD ID: 1505160 | |
| CIF file | Formula: - C22 H30 N2 S Se2 - Comments: Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B. Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains Macromolecules 40(18) (2007) 6585 Space group: P b c n Cell volume: 4544.1 Cell parameters: 38.796; 12.1462; 9.6432; 90; 90; 90; |
| COD ID: 1505161 | |
| CIF file | Formula: - C14 H10 N2 S7 - Comments: Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B. Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains Macromolecules 40(18) (2007) 6585 Space group: P 1 21/n 1 Cell volume: 1648.47 Cell parameters: 9.0402; 15.3519; 11.8801; 90; 91.095; 90; |
| COD ID: 1505162 | |
| CIF file | Formula: - C30 H46 N2 S3 - Comments: Pang, Hao; Skabara, Peter J.; Crouch, David J.; Duffy, Warren; Heeney, Martin; McCulloch, Iain; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B. Structural and Electronic Effects of 1,3,4-Thiadiazole Units Incorporated into Polythiophene Chains Macromolecules 40(18) (2007) 6585 Space group: P -1 Cell volume: 1454.2 Cell parameters: 7.6833; 10.8879; 18.395; 92.007; 100.266; 105.411; |
| COD ID: 1505163 | |
| CIF file | Formula: - C16 H24 Mg N2 O2 - Comments: Tang, Hui-Yi; Chen, Hsuan-Ying; Huang, Jui-Hsien; Lin, Chu-Chieh Synthesis and Structural Characterization of Magnesium Ketiminate Complexes: Efficient Initiators for the Ring-Opening Polymerization ofl-Lactide Macromolecules 40(25) (2007) 8855 Space group: P -1 Cell volume: 864.7 Cell parameters: 9.729; 9.983; 10.716; 72.516; 65.094; 68.434; |
| COD ID: 1505164 | |
| CIF file | Formula: - C44 H40 Br2 N4 Ni O4 - Comments: Tarte, Naresh H.; Cho, Hyun Yong; Woo, Seong Ihl Efficient Route for Cyclic Olefin Polymerization: Nonchelated Monodentate Benzimidazole Nickel(II) Complex Catalysts for Vinyl Polymerization of Norbornene Macromolecules 40(23) (2007) 8162 Space group: P 1 21/c 1 Cell volume: 3931.1 Cell parameters: 14.27; 12.986; 21.712; 90; 102.302; 90; |
| COD ID: 1505165 | |
| CIF file | Formula: - C30 H22 Br2 F4 N6 Ni - Comments: Tarte, Naresh H.; Cho, Hyun Yong; Woo, Seong Ihl Efficient Route for Cyclic Olefin Polymerization: Nonchelated Monodentate Benzimidazole Nickel(II) Complex Catalysts for Vinyl Polymerization of Norbornene Macromolecules 40(23) (2007) 8162 Space group: P 1 21/c 1 Cell volume: 3146.38 Cell parameters: 10.0205; 24.0291; 13.9318; 90; 110.291; 90; |
| COD ID: 1505166 | |
| CIF file | Formula: - C22 H20 N2 O2 - Comments: Tarte, Naresh H.; Cho, Hyun Yong; Woo, Seong Ihl Efficient Route for Cyclic Olefin Polymerization: Nonchelated Monodentate Benzimidazole Nickel(II) Complex Catalysts for Vinyl Polymerization of Norbornene Macromolecules 40(23) (2007) 8162 Space group: P 1 21/n 1 Cell volume: 1828.98 Cell parameters: 9.6638; 10.4904; 18.0444; 90; 91.062; 90; |
| COD ID: 1505167 | |
| CIF file | Formula: - C31 H20 O4 - Comments: Al-Kaysi, Rabih O.; Dillon, Robert J.; Kaiser, J. Michael; Mueller, Leonard J.; Guirado, Gonzalo; Bardeen, Christopher J. Photopolymerization of Organic Molecular Crystal Nanorods Macromolecules 40(25) (2007) 9040 Space group: P 1 21/c 1 Cell volume: 2246.7 Cell parameters: 15.31; 11.863; 12.988; 90; 107.74; 90; |
| COD ID: 1505168 | |
| CIF file | Formula: - C31 H20 O4 - Comments: Al-Kaysi, Rabih O.; Dillon, Robert J.; Kaiser, J. Michael; Mueller, Leonard J.; Guirado, Gonzalo; Bardeen, Christopher J. Photopolymerization of Organic Molecular Crystal Nanorods Macromolecules 40(25) (2007) 9040 Space group: P b c a Cell volume: 4341.2 Cell parameters: 13.8475; 16.2027; 19.3485; 90; 90; 90; |
| COD ID: 1505169 | |
| CIF file | Formula: - C32 H44 S4 - Comments: San Miguel, Lidaris; Matzger, Adam J. Dialkyl-Substituted Thieno[3,2-b]thiophene-Based Polymers Containing 2,2‘-Bithiophene, Thieno[3,2-b]thiophene, and Ethynylene Spacers Macromolecules 40(26) (2007) 9233 Space group: P -1 Cell volume: 788.26 Cell parameters: 4.80255; 9.70196; 17.3834; 95.195; 99.137; 97.232; |
| COD ID: 1505170 | |
| CIF file | Formula: - C40 H38 N8 O4 - Comments: Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John Cocrystal or Salt: Does It Really Matter? Molecular Pharmaceutics 4(3) (2007) 317 Space group: P 1 21/n 1 Cell volume: 1712.1 Cell parameters: 5.6367; 32.91; 9.4476; 90; 102.342; 90; |
| COD ID: 1505171 | |
| CIF file | Formula: - C15 H11 F2 N3 O2 - Comments: Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John Cocrystal or Salt: Does It Really Matter? Molecular Pharmaceutics 4(3) (2007) 317 Space group: P 1 21/n 1 Cell volume: 1382.1 Cell parameters: 7.1555; 17.958; 10.9686; 90; 101.301; 90; |
| COD ID: 1505172 | |
| CIF file | Formula: - C32 H39 N3 O4 - Comments: Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John Cocrystal or Salt: Does It Really Matter? Molecular Pharmaceutics 4(3) (2007) 317 Space group: P -1 Cell volume: 1364.42 Cell parameters: 8.8864; 11.9875; 13.7015; 99.38; 93.191; 107.556; |
| COD ID: 1505173 | |
| CIF file | Formula: - C32 H24 N8 O12 - Comments: Aakeröy, Christer B.; Fasulo, Meg E.; Desper, John Cocrystal or Salt: Does It Really Matter? Molecular Pharmaceutics 4(3) (2007) 317 Space group: P -1 Cell volume: 1551.53 Cell parameters: 9.7657; 11.7691; 14.0803; 86.227; 74.163; 86.202; |
| COD ID: 1505174 | |
| CIF file | Formula: - C13 H16 N4 O4 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P 1 21/m 1 Cell volume: 686.98 Cell parameters: 8.7478; 6.5361; 12.5842; 90; 107.296; 90; |
| COD ID: 1505175 | |
| CIF file | Formula: - C14 H15 N4 O5 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P 1 21/n 1 Cell volume: 1382.32 Cell parameters: 6.9183; 25.9086; 7.9749; 90; 104.754; 90; |
| COD ID: 1505176 | |
| CIF file | Formula: - C18 H16 N4 O5 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P 1 21/c 1 Cell volume: 3308.2 Cell parameters: 11.814; 31.707; 8.92; 90; 98.072; 90; |
| COD ID: 1505177 | |
| CIF file | Formula: - C14 H14 N4 O5 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P 1 21/c 1 Cell volume: 1397.2 Cell parameters: 7.1201; 7.928; 24.763; 90; 91.66; 90; |
| COD ID: 1505178 | |
| CIF file | Formula: - C15 H17 N5 O4 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P 1 21/n 1 Cell volume: 1528.59 Cell parameters: 8.7337; 15.3838; 11.5271; 90; 99.256; 90; |
| COD ID: 1505179 | |
| CIF file | Formula: - C8 H12 N5 O2 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P 1 21/c 1 Cell volume: 906.04 Cell parameters: 8.7804; 6.5989; 16.0041; 90; 102.292; 90; |
| COD ID: 1505180 | |
| CIF file | Formula: - C16 H26 N10 O5 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P -1 Cell volume: 966.87 Cell parameters: 8.3936; 10.2277; 11.8295; 78.839; 77.795; 81.075; |
| COD ID: 1505181 | |
| CIF file | Formula: - C17 H13 F3 N2 O6 - Comments: Childs, Scott L.; Stahly, G. Patrick; Park, Aeri The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State Molecular Pharmaceutics 4(3) (2007) 323 Space group: P 1 21/c 1 Cell volume: 1688.73 Cell parameters: 8.1434; 20.7559; 10.6511; 90; 110.276; 90; |
| COD ID: 1505182 | |
| CIF file | Formula: - C19 H18 N4 O5 - Comments: Bučar, Dejan-Krešimir; Henry, Rodger F.; Lou, Xiaochun; Duerst, Richard W.; Borchardt, Thomas B.; MacGillivray, Leonard R.; Zhang, Geoff G. Z. Co-Crystals of Caffeine and Hydroxy-2-naphthoic Acids: Unusual Formation of the Carboxylic Acid Dimer in the Presence of a Heterosynthon Molecular Pharmaceutics 4(3) (2007) 339 Space group: P 1 21/n 1 Cell volume: 1739.5 Cell parameters: 7.6063; 14.042; 16.327; 90; 94.03; 90; |
| COD ID: 1505183 | |
| CIF file | Formula: - C19 H18 N4 O5 - Comments: Bučar, Dejan-Krešimir; Henry, Rodger F.; Lou, Xiaochun; Duerst, Richard W.; Borchardt, Thomas B.; MacGillivray, Leonard R.; Zhang, Geoff G. Z. Co-Crystals of Caffeine and Hydroxy-2-naphthoic Acids: Unusual Formation of the Carboxylic Acid Dimer in the Presence of a Heterosynthon Molecular Pharmaceutics 4(3) (2007) 339 Space group: P 1 21/c 1 Cell volume: 1702 Cell parameters: 9.04; 24.42; 8.654; 90; 117.015; 90; |
| COD ID: 1505184 | |
| CIF file | Formula: - C19 H18 N4 O5 - Comments: Bučar, Dejan-Krešimir; Henry, Rodger F.; Lou, Xiaochun; Duerst, Richard W.; Borchardt, Thomas B.; MacGillivray, Leonard R.; Zhang, Geoff G. Z. Co-Crystals of Caffeine and Hydroxy-2-naphthoic Acids: Unusual Formation of the Carboxylic Acid Dimer in the Presence of a Heterosynthon Molecular Pharmaceutics 4(3) (2007) 339 Space group: P -1 Cell volume: 870.3 Cell parameters: 8.029; 8.592; 13.996; 106.475; 98.162; 104.904; |
| COD ID: 1505185 | |
| CIF file | Formula: - C13 H18 N4 O10 - Comments: Karki, Shyam; Friščić, Tomislav; Jones, William; Motherwell, W. D. Samuel Screening for Pharmaceutical Cocrystal Hydrates via Neat and Liquid-Assisted Grinding Molecular Pharmaceutics 4(3) (2007) 347 Space group: P 1 21/c 1 Cell volume: 1642.32 Cell parameters: 17.9217; 6.1766; 15.3751; 90; 105.212; 90; |
| COD ID: 1505186 | |
| CIF file | Formula: - C14 H18 N4 O9 - Comments: Karki, Shyam; Friščić, Tomislav; Jones, William; Motherwell, W. D. Samuel Screening for Pharmaceutical Cocrystal Hydrates via Neat and Liquid-Assisted Grinding Molecular Pharmaceutics 4(3) (2007) 347 Space group: P -1 Cell volume: 814.72 Cell parameters: 7.3874; 8.3967; 13.5053; 91.333; 99.04; 99.588; |
| COD ID: 1505187 | |
| CIF file | Formula: - C2 H5 O5.5 - Comments: Wenger, Mazal; Bernstein, Joel Cocrystal Design Gone Awry? A New Dimorphic Hydrate of Oxalic Acid Molecular Pharmaceutics 4(3) (2007) 355 Space group: P n m a Cell volume: 956.6 Cell parameters: 11.231; 12.33; 6.9082; 90; 90; 90; |
| COD ID: 1505188 | |
| CIF file | Formula: - C4 H9 O11 - Comments: Wenger, Mazal; Bernstein, Joel Cocrystal Design Gone Awry? A New Dimorphic Hydrate of Oxalic Acid Molecular Pharmaceutics 4(3) (2007) 355 Space group: P -1 Cell volume: 471 Cell parameters: 6.337; 7.247; 10.571; 94.345; 100.244; 97.674; |
| COD ID: 1505189 | |
| CIF file | Formula: - C26 H22 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P 1 21/c 1 Cell volume: 1098.1 Cell parameters: 13.223; 6.1971; 14.63; 90; 113.661; 90; |
| COD ID: 1505190 | |
| CIF file | Formula: - C19 H15 N3 O - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: C 1 2/c 1 Cell volume: 3139 Cell parameters: 18.715; 7.228; 23.208; 90; 90.478; 90; |
| COD ID: 1505191 | |
| CIF file | Formula: - C26 H20 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P 1 21/n 1 Cell volume: 2224.2 Cell parameters: 16.5421; 7.5056; 18.709; 90; 106.763; 90; |
| COD ID: 1505192 | |
| CIF file | Formula: - C24 H18 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P 1 21/c 1 Cell volume: 1039.4 Cell parameters: 20.866; 7.437; 6.7662; 90; 98.142; 90; |
| COD ID: 1505193 | |
| CIF file | Formula: - C18 H14 N2 O - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P 1 21/c 1 Cell volume: 1508 Cell parameters: 9.906; 21.65; 7.59; 90; 112.14; 90; |
| COD ID: 1505194 | |
| CIF file | Formula: - C24 H18 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P 1 21/n 1 Cell volume: 4139 Cell parameters: 12.7871; 7.2838; 44.445; 90; 90.895; 90; |
| COD ID: 1505195 | |
| CIF file | Formula: - C18 H14 N2 O - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: C 1 2/c 1 Cell volume: 2987 Cell parameters: 26.217; 7.481; 19.41; 90; 128.31; 90; |
| COD ID: 1505196 | |
| CIF file | Formula: - C24 H18 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P -1 Cell volume: 476.5 Cell parameters: 3.8483; 8.755; 14.364; 96.647; 94.498; 95.474; |
| COD ID: 1505197 | |
| CIF file | Formula: - C26 H22 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P 1 21/c 1 Cell volume: 1095.9 Cell parameters: 11.195; 7.335; 13.53; 90; 99.465; 90; |
| COD ID: 1505198 | |
| CIF file | Formula: - C19 H15 N3 O - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: C 1 c 1 Cell volume: 3047.5 Cell parameters: 18.503; 7.5019; 21.971; 90; 92.181; 90; |
| COD ID: 1505199 | |
| CIF file | Formula: - C19 H15 N3 O - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P -1 Cell volume: 1588.1 Cell parameters: 7.616; 10.003; 22.497; 87.342; 81.024; 69.737; |
| COD ID: 1505200 | |
| CIF file | Formula: - C26 H20 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P 1 21/c 1 Cell volume: 1101.9 Cell parameters: 14.66; 4.11; 18.29; 90; 90.74; 90; |
| COD ID: 1505201 | |
| CIF file | Formula: - C24 H18 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: C 1 2/c 1 Cell volume: 2090 Cell parameters: 39.87; 7.586; 6.915; 90; 91.972; 90; |
| COD ID: 1505202 | |
| CIF file | Formula: - C24 H18 N6 O3 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P -1 Cell volume: 1125.9 Cell parameters: 7.889; 8.156; 19.673; 83.866; 85.627; 63.512; |
| COD ID: 1505203 | |
| CIF file | Formula: - C18 H14 N4 O2 - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P -1 Cell volume: 836.9 Cell parameters: 9.171; 9.941; 10.265; 95.674; 94.987; 114.784; |
| COD ID: 1505204 | |
| CIF file | Formula: - C30 H24 F4 N4 O4 S - Comments: Bis, Joanna A.; Vishweshwar, Peddy; Weyna, David; Zaworotko, Michael J. Hierarchy of Supramolecular Synthons: Persistent Hydroxyl···Pyridine Hydrogen Bonds in Cocrystals That Contain a Cyano Acceptor Molecular Pharmaceutics 4(3) (2007) 401 Space group: P -1 Cell volume: 1449.4 Cell parameters: 8.274; 10.172; 18.601; 87.521; 78.256; 71.067; |
| COD ID: 1505205 | |
| CIF file | Formula: - C12 H10 N4 O5 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P 1 21/n 1 Cell volume: 1225.72 Cell parameters: 10.385; 7.2222; 16.3763; 90; 93.686; 90; |
| COD ID: 1505206 | |
| CIF file | Formula: - C16 H18 N4 O5 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P -1 Cell volume: 811.64 Cell parameters: 8.4083; 9.8893; 10.6761; 73.201; 79.022; 74.182; |
| COD ID: 1505207 | |
| CIF file | Formula: - C6 H6 N3 O4 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P 1 21/n 1 Cell volume: 749.5 Cell parameters: 5.258; 6.478; 22.118; 90; 95.795; 90; |
| COD ID: 1505208 | |
| CIF file | Formula: - C24 H18 N4 O8 S2 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P 1 21/n 1 Cell volume: 1164.12 Cell parameters: 6.5207; 14.0377; 13.1232; 90; 104.28; 90; |
| COD ID: 1505209 | |
| CIF file | Formula: - C13 H17 N3 O4 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P 1 21/c 1 Cell volume: 1399.99 Cell parameters: 7.2276; 19.5811; 9.9928; 90; 98.136; 90; |
| COD ID: 1505210 | |
| CIF file | Formula: - C20 H26 N4 O5 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P 1 21/c 1 Cell volume: 4024 Cell parameters: 8.2106; 23.9166; 20.6318; 90; 96.67; 90; |
| COD ID: 1505211 | |
| CIF file | Formula: - C24 H22 N4 O6 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P -1 Cell volume: 541.2 Cell parameters: 5.692; 9.482; 10.751; 69.893; 84.232; 84.969; |
| COD ID: 1505212 | |
| CIF file | Formula: - C9 H11 N2 O4 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P -1 Cell volume: 494.7 Cell parameters: 6.409; 7.372; 11.064; 96.127; 97.22; 105.35; |
| COD ID: 1505213 | |
| CIF file | Formula: - C23 H18 N4 O3 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P -1 Cell volume: 977.8 Cell parameters: 7.284; 10.688; 14.132; 100.25; 102.463; 109.079; |
| COD ID: 1505214 | |
| CIF file | Formula: - C17 H14 N3 O2 - Comments: Babu, N. Jagadeesh; Reddy, L. Sreenivas; Nangia, Ashwini Amide−N-Oxide Heterosynthon and Amide Dimer Homosynthon in Cocrystals of Carboxamide Drugs and PyridineN-Oxides Molecular Pharmaceutics 4(3) (2007) 417 Space group: P 1 21/c 1 Cell volume: 1397.2 Cell parameters: 10.237; 27.247; 5.135; 90; 102.708; 90; |
| COD ID: 1505215 | |
| CIF file | Formula: - C40 H42 N2 O4 - Comments: Briseno, Alejandro L.; Mannsfeld, Stefan C. B.; Reese, Colin; Hancock, Jessica M.; Xiong, Yujie; Jenekhe, Samson A.; Bao, Zhenan; Xia, Younan Perylenediimide nanowires and their use in fabricating field-effect transistors and complementary inverters. Nano letters 7(9) (2007) 2847-2853 Space group: P -1 Cell volume: 775.6 Cell parameters: 4.6757; 8.502; 19.718; 85.993; 88.432; 82.788; |
| COD ID: 1505216 | |
| CIF file | Formula: - C19 H29 N O4 - Comments: Stadler, Marc; Bitzer, Jens; Mayer-Bartschmid, Anke; Müller, Hartwig; Benet-Buchholz, Jordi; Gantner, Florian; Tichy, Hans-Volker; Reinemer, Peter; Bacon, Kevin B. Cinnabaramides A-G: analogues of lactacystin and salinosporamide from a terrestrial streptomycete. Journal of natural products 70(2) (2007) 246-252 Space group: P 21 21 21 Cell volume: 22178.2 Cell parameters: 13.0624; 29.0453; 58.4559; 90; 90; 90; |
| COD ID: 1505217 | |
| CIF file | Formula: - C22 H22 O9 - Comments: Lang, Gerhard; Cole, Anthony L. J.; Blunt, John W.; Robinson, Ward T.; Munro, Murray H. G. Excelsione, a depsidone from an endophytic fungus isolated from the New Zealand endemic tree Knightia excelsa. Journal of natural products 70(2) (2007) 310-311 Space group: C 1 2/c 1 Cell volume: 3968.2 Cell parameters: 34.5928; 6.8066; 16.9849; 90; 97.148; 90; |
| COD ID: 1505218 | |
| CIF file | Formula: - C15 H16 O5 - Comments: Fei, Dong-Qing; Li, Shi-Gang; Liu, Chun-Mei; Wu, Gang; Gao, Kun Eremophilane-type sesquiterpene derivatives from the roots of Ligularia lapathifolia. Journal of natural products 70(2) (2007) 241-245 Space group: P 1 21 1 Cell volume: 672.2 Cell parameters: 7.34; 9.715; 9.555; 90; 99.39; 90; |
| COD ID: 1505219 | |
| CIF file | Formula: - C15 H22 O2 - Comments: Harinantenaina, Liva; Asakawa, Yoshinori; De Clercq, Erik Cinnamacrins A-C, cinnafragrin D, and cytostatic metabolites with alpha-glucosidase inhibitory activity from Cinnamosma macrocarpa. Journal of natural products 70(2) (2007) 277-282 Space group: P 21 21 21 Cell volume: 1335.24 Cell parameters: 7.631; 12.049; 14.522; 90; 90; 90; |
| COD ID: 1505220 | |
| CIF file | Formula: - C9 H14 O6 - Comments: Valladares, María Guadalupe; Rios, María Yolanda Iridoids from Crescentia alata. Journal of natural products 70(1) (2007) 100-102 Space group: P 1 21 1 Cell volume: 474.62 Cell parameters: 8.7505; 5.1734; 10.6057; 90; 98.682; 90; |
| COD ID: 1505221 | |
| CIF file | Formula: - C50 H88 Cl6 O15 - Comments: Wagenaar, Melissa M.; Williamson, R. Thomas; Ho, Douglas M.; Carter, Guy T. Structure and absolute stereochemistry of 21-hydroxyoligomycin A. Journal of natural products 70(3) (2007) 367-371 Space group: P 1 Cell volume: 1568.77 Cell parameters: 10.0874; 12.5229; 13.6632; 65.648; 88.15; 86.102; |
| COD ID: 1505222 | |
| CIF file | Formula: - C25 H40.5 Cl O4.75 - Comments: Nguyen, Hung Phi; Zhang, Dahai; Lee, Uk; Kang, Jung Sook; Choi, Hong Dae; Son, Byeng Wha Dehydroxychlorofusarielin B, an antibacterial polyoxygenated decalin derivative from the marine-derived fungus Aspergillus sp. Journal of natural products 70(7) (2007) 1188-1190 Space group: P 21 21 21 Cell volume: 5646.9 Cell parameters: 11.0682; 17.38; 29.355; 90; 90; 90; |
| COD ID: 1505223 | |
| CIF file | Formula: - C31 H53 N5 O11 - Comments: Huang, Huarong; She, Zhigang; Lin, Yongcheng; Vrijmoed, L. L. P.; Lin, Wenhan Cyclic peptides from an endophytic fungus obtained from a mangrove leaf (Kandelia candel). Journal of natural products 70(11) (2007) 1696-1699 Space group: P 1 21 1 Cell volume: 1817.9 Cell parameters: 7.156; 30.155; 8.678; 90; 103.888; 90; |
| COD ID: 1505224 | |
| CIF file | Formula: - C30 H49 N5 O9 - Comments: Huang, Huarong; She, Zhigang; Lin, Yongcheng; Vrijmoed, L. L. P.; Lin, Wenhan Cyclic peptides from an endophytic fungus obtained from a mangrove leaf (Kandelia candel). Journal of natural products 70(11) (2007) 1696-1699 Space group: P 1 21 1 Cell volume: 1734.8 Cell parameters: 7.089; 28.71; 8.77; 90; 103.606; 90; |
| COD ID: 1505225 | |
| CIF file | Formula: - C35 H48 O17 - Comments: Yin, Sheng; Wang, Xiao-Ning; Fan, Cheng-Qi; Lin, Li-Ping; Ding, Jian; Yue, Jian-Min Limonoids from the seeds of the marine mangrove Xylocarpus granatum. Journal of natural products 70(4) (2007) 682-685 Space group: P 1 21 1 Cell volume: 1849.5 Cell parameters: 10.8338; 12.2421; 14.0333; 90; 96.445; 90; |
| COD ID: 1505226 | |
| CIF file | Formula: - C24 H39 N O8 - Comments: Gao, Feng; Chen, Qiao-Hong; Wang, Feng-Peng C19-diterpenoid alkaloids from Aconitum hemsleyanum var. circinatum. Journal of natural products 70(5) (2007) 876-879 Space group: C 2 2 21 Cell volume: 4595.5 Cell parameters: 13.491; 15.501; 21.975; 90; 90; 90; |
| COD ID: 1505227 | |
| CIF file | Formula: - C26 H43 N O8 - Comments: Gao, Feng; Chen, Qiao-Hong; Wang, Feng-Peng C19-diterpenoid alkaloids from Aconitum hemsleyanum var. circinatum. Journal of natural products 70(5) (2007) 876-879 Space group: P 21 21 21 Cell volume: 5139.9 Cell parameters: 9.186; 10.212; 54.792; 90; 90; 90; |
| COD ID: 1505228 | |
| CIF file | Formula: - C28 H40 O8 - Comments: Pan, Yuanhu; Wang, Xiaochuan; Hu, Xianming Cytotoxic withanolides from the flowers of Datura metel. Journal of natural products 70(7) (2007) 1127-1132 Space group: P 21 21 21 Cell volume: 2588.4 Cell parameters: 10.6156; 11.2307; 21.7108; 90; 90; 90; |
| COD ID: 1505229 | |
| CIF file | Formula: - C20 H26 O5 - Comments: Wang, Qi; Mu, Qing; Shibano, Makio; Morris-Natschke, Susan L; Lee, Kuo-Hsiung; Chen, Dao-Feng Eremophilane sesquiterpenes from Ligularia macrophylla. Journal of natural products 70(8) (2007) 1259-1262 Space group: P 21 21 21 Cell volume: 1806.7 Cell parameters: 7.687; 14.383; 16.341; 90; 90; 90; |
| COD ID: 1505230 | |
| CIF file | Formula: - C32 H56 O11 - Comments: Socolsky, Cecilia; Asakawa, Yoshinori; Bardón, Alicia Diterpenoid glycosides from the bitter fern Gleichenia quadripartita. Journal of natural products 70(12) (2007) 1837-1845 Space group: P 1 21 1 Cell volume: 1965.9 Cell parameters: 11.136; 11.655; 15.148; 90; 90.617; 90; |
| COD ID: 1505231 | |
| CIF file | Formula: - C28 H40 O3 - Comments: Amagata, Taro; Tanaka, Makoto; Yamada, Takeshi; Doi, Mitsunobu; Minoura, Katsuhiko; Ohishi, Hirofumi; Yamori, Takao; Numata, Atsushi Variation in cytostatic constituents of a sponge-derived Gymnascella dankaliensis by manipulating the carbon source. Journal of natural products 70(11) (2007) 1731-1740 Space group: P 21 21 21 Cell volume: 2455.2 Cell parameters: 12.667; 23.829; 8.134; 90; 90; 90; |
| COD ID: 1505232 | |
| CIF file | Formula: - C28 H38 O2 - Comments: Amagata, Taro; Tanaka, Makoto; Yamada, Takeshi; Doi, Mitsunobu; Minoura, Katsuhiko; Ohishi, Hirofumi; Yamori, Takao; Numata, Atsushi Variation in cytostatic constituents of a sponge-derived Gymnascella dankaliensis by manipulating the carbon source. Journal of natural products 70(11) (2007) 1731-1740 Space group: P 21 21 21 Cell volume: 4904 Cell parameters: 22.038; 34.524; 6.446; 90; 90; 90; |
| COD ID: 1505233 | |
| CIF file | Formula: - C18 H20 N2 O7 S3 - Comments: Zhang, Yonggang; Liu, Shuchun; Che, Yongsheng; Liu, Xingzhong Epicoccins A-D, epipolythiodioxopiperazines from a Cordyceps-colonizing isolate of Epicoccum nigrum. Journal of natural products 70(9) (2007) 1522-1525 Space group: P 21 21 21 Cell volume: 1919.5 Cell parameters: 7.5523; 11.1218; 22.853; 90; 90; 90; |
| COD ID: 1505234 | |
| CIF file | Formula: - C20 H19 Br O - Comments: Sniady, Adam; Durham, Audrey; Morreale, Marco S.; Wheeler, Kraig A.; Dembinski, Roman Room temperature zinc chloride-catalyzed cycloisomerization of Alk-3-yn-1-ones: synthesis of substituted furans. Organic letters 9(7) (2007) 1175-1178 Space group: P 1 21/n 1 Cell volume: 1700.2 Cell parameters: 7.7441; 6.2696; 35.046; 90; 92.327; 90; |
| COD ID: 1505235 | |
| CIF file | Formula: - C22 H15 N O - Comments: Basavaiah, Deevi; Reddy, Kanumuri Ramesh Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions. Organic letters 9(1) (2007) 57-60 Space group: P 1 21/c 1 Cell volume: 1660.9 Cell parameters: 12.2411; 8.0506; 16.9934; 90; 97.352; 90; |
| COD ID: 1505236 | |
| CIF file | Formula: - C24 H19 N O3 - Comments: Basavaiah, Deevi; Reddy, Kanumuri Ramesh Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions. Organic letters 9(1) (2007) 57-60 Space group: P 1 21/c 1 Cell volume: 3788.7 Cell parameters: 23.3988; 9.0998; 19.3653; 90; 113.243; 90; |
| COD ID: 1505237 | |
| CIF file | Formula: - C24 H19 N O - Comments: Basavaiah, Deevi; Reddy, Kanumuri Ramesh Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions. Organic letters 9(1) (2007) 57-60 Space group: P 1 21/n 1 Cell volume: 1863.4 Cell parameters: 12.038; 12.112; 14.089; 90; 114.892; 90; |
| COD ID: 1505238 | |
| CIF file | Formula: - C36 H27 N O - Comments: Basavaiah, Deevi; Reddy, Kanumuri Ramesh Simple and one-pot protocol for synthesis of indene-spiro-oxindoles involving tandem Prins and Friedel-Crafts reactions. Organic letters 9(1) (2007) 57-60 Space group: P 1 21/n 1 Cell volume: 2780.7 Cell parameters: 11.237; 17.495; 14.195; 90; 94.841; 90; |
| COD ID: 1505239 | |
| CIF file | Formula: - C82 H66 - Comments: Kubo, Takashi; Shimizu, Akihiro; Uruichi, Mikio; Yakushi, Kyuya; Nakano, Masayoshi; Shiomi, Daisuke; Sato, Kazunobu; Takui, Takeji; Morita, Yasushi; Nakasuji, Kazuhiro Singlet biradical character of phenalenyl-based Kekulé hydrocarbon with naphthoquinoid structure. Organic letters 9(1) (2007) 81-84 Space group: P 1 21/n 1 Cell volume: 2812.5 Cell parameters: 16.109; 9.036; 19.383; 90; 94.544; 90; |
| COD ID: 1505240 | |
| CIF file | Formula: - C26 H22 S2 Si2 - Comments: Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties. Organic letters 9(1) (2007) 93-96 Space group: P 1 21/c 1 Cell volume: 1131.9 Cell parameters: 8.9171; 10.8286; 11.756; 90; 94.3574; 90; |
| COD ID: 1505241 | |
| CIF file | Formula: - C26 H22 S2 Si2 - Comments: Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties. Organic letters 9(1) (2007) 93-96 Space group: P 1 21/c 1 Cell volume: 1169.6 Cell parameters: 11.383; 6.8442; 15.037; 90; 93.264; 90; |
| COD ID: 1505242 | |
| CIF file | Formula: - C26 H22 Se2 Si2 - Comments: Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties. Organic letters 9(1) (2007) 93-96 Space group: P 1 21/n 1 Cell volume: 2291.1 Cell parameters: 8.8891; 9.8528; 26.162; 90; 90.8205; 90; |
| COD ID: 1505243 | |
| CIF file | Formula: - C26 H22 O4 S2 Si2 - Comments: Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties. Organic letters 9(1) (2007) 93-96 Space group: P 1 21/a 1 Cell volume: 1250.6 Cell parameters: 13.042; 6.878; 14.555; 90; 106.698; 90; |
| COD ID: 1505244 | |
| CIF file | Formula: - C26 H22 O4 S2 Si2 - Comments: Mouri, Kazuhiro; Wakamiya, Atsushi; Yamada, Hiroshi; Kajiwara, Takashi; Yamaguchi, Shigehiro Ladder distyrylbenzenes with silicon and chalcogen bridges: synthesis, structures, and properties. Organic letters 9(1) (2007) 93-96 Space group: P 1 21/n 1 Cell volume: 1233.2 Cell parameters: 9.057; 13.776; 10.813; 90; 113.927; 90; |
| COD ID: 1505245 | |
| CIF file | Formula: - C11 H19 N O4 - Comments: Shing, Tony K. M.; Wong, Wai F.; Ikeno, Taketo; Yamada, Tohru trans-acetonide controlled endo-selective intramolecular nitrone-alkene cycloaddition of hept-6-enoses: a facile entry to calystegines, tropanes, and hydroxylated aminocycloheptanes. Organic letters 9(2) (2007) 207-209 Space group: P 1 21 1 Cell volume: 578.9 Cell parameters: 5.9407; 10.466; 9.3103; 90; 90; 90; |
| COD ID: 1505246 | |
| CIF file | Formula: - C24 H29 N O5 - Comments: Shing, Tony K. M.; Wong, Wai F.; Ikeno, Taketo; Yamada, Tohru trans-acetonide controlled endo-selective intramolecular nitrone-alkene cycloaddition of hept-6-enoses: a facile entry to calystegines, tropanes, and hydroxylated aminocycloheptanes. Organic letters 9(2) (2007) 207-209 Space group: P 21 21 21 Cell volume: 2202 Cell parameters: 9.6762; 11.9288; 19.077; 90; 90; 90; |
| COD ID: 1505247 | |
| CIF file | Formula: - C17 H33 N O4 Si - Comments: Shing, Tony K. M.; Wong, Wai F.; Ikeno, Taketo; Yamada, Tohru trans-acetonide controlled endo-selective intramolecular nitrone-alkene cycloaddition of hept-6-enoses: a facile entry to calystegines, tropanes, and hydroxylated aminocycloheptanes. Organic letters 9(2) (2007) 207-209 Space group: P 21 21 21 Cell volume: 2011.7 Cell parameters: 8.3847; 10.637; 22.556; 90; 90; 90; |
| COD ID: 1505248 | |
| CIF file | Formula: - C25 H22 - Comments: Shao, Li-Xiong; Zhang, Yun-Peng; Qi, Ming-Hui; Shi, Min Lewis acid catalyzed rearrangement of vinylcyclopropenes for the construction of naphthalene and indene skeletons. Organic letters 9(1) (2007) 117-120 Space group: P -1 Cell volume: 916.9 Cell parameters: 8.1168; 10.068; 11.493; 93.001; 98.563; 98.08; |
| COD ID: 1505249 | |
| CIF file | Formula: - C25 H20 F2 - Comments: Shao, Li-Xiong; Zhang, Yun-Peng; Qi, Ming-Hui; Shi, Min Lewis acid catalyzed rearrangement of vinylcyclopropenes for the construction of naphthalene and indene skeletons. Organic letters 9(1) (2007) 117-120 Space group: P 1 21/n 1 Cell volume: 1986.6 Cell parameters: 12.5896; 9.1294; 17.6833; 90; 102.192; 90; |
| COD ID: 1505250 | |
| CIF file | Formula: - C18 H20 Br N3 O4 - Comments: Suga, Hiroyuki; Funyu, Akira; Kakehi, Akikazu Highly enantioselective and diastereoselective 1,3-dipolar cycloaddition reactions between azomethine imines and 3-acryloyl-2-oxazolidinone catalyzed by binaphthyldiimine-Ni(II) complexes. Organic letters 9(1) (2007) 97-100 Space group: P 1 21 1 Cell volume: 898.5 Cell parameters: 5.51; 15.22; 10.76; 90; 95.3; 90; |
| COD ID: 1505251 | |
| CIF file | Formula: - C11 H12 Br2 - Comments: Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H. Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal. Organic letters 9(1) (2007) 113-115 Space group: P 21 21 21 Cell volume: 2078.04 Cell parameters: 6.2966; 12.3168; 26.7947; 90; 90; 90; |
| COD ID: 1505252 | |
| CIF file | Formula: - C11 H12 Br2 - Comments: Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H. Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal. Organic letters 9(1) (2007) 113-115 Space group: P 1 21/n 1 Cell volume: 1013.18 Cell parameters: 9.6375; 10.0279; 11.1469; 90; 109.864; 90; |
| COD ID: 1505253 | |
| CIF file | Formula: - C11 H12 Br2 - Comments: Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H. Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal. Organic letters 9(1) (2007) 113-115 Space group: P n a 21 Cell volume: 2078.5 Cell parameters: 13.0891; 10.9312; 14.527; 90; 90; 90; |
| COD ID: 1505254 | |
| CIF file | Formula: - C11 H12 Br2 - Comments: Su, Kuan-Jen; Mieusset, Jean-Luc; Arion, Vladimir B.; Brecker, Lothar; Brinker, Udo H. Cope rearrangement versus a novel tandem retro-Diels-Alder-Diels-Alder reaction with role reversal. Organic letters 9(1) (2007) 113-115 Space group: P n a 21 Cell volume: 1030.6 Cell parameters: 12.886; 11.131; 7.185; 90; 90; 90; |
| COD ID: 1505255 | |
| CIF file | Formula: - C20 H17 I O4 - Comments: Bi, Hai-Peng; Guo, Li-Na; Duan, Xin-Hua; Gou, Fa-Rong; Huang, Shu-Hao; Liu, Xue-Yuan; Liang, Yong-Min Highly regio- and stereoselective synthesis of indene derivatives via electrophilic cyclization. Organic letters 9(3) (2007) 397-400 Space group: P -1 Cell volume: 906 Cell parameters: 7.615; 9.91; 12.33; 98.11; 96.8; 96.62; |
| COD ID: 1505256 | |
| CIF file | Formula: - C41 H43 N11 O14 Zn2 - Comments: Lee, Han Na; Swamy, K. M. K.; Kim, Sook Kyung; Kwon, Ji-Young; Kim, Youngmee; Kim, Sung-Jin; Yoon, Yeo Joon; Yoon, Juyoung Simple but effective way to sense pyrophosphate and inorganic phosphate by fluorescence changes. Organic letters 9(2) (2007) 243-246 Space group: P -1 Cell volume: 2199.8 Cell parameters: 10.437; 14.854; 15.209; 78.149; 73.206; 81.63; |
| COD ID: 1505257 | |
| CIF file | Formula: - C12 H19 Ni P S - Comments: Hua, Ruimao; Takeda, Hideaki; Onozawa, Shun-ya; Abe, Yoshimoto; Tanaka, Masato Nickel-catalyzed thioallylation of alkynes with allyl phenyl sulfides. Organic letters 9(2) (2007) 263-266 Space group: P 1 21/c 1 Cell volume: 1391.3 Cell parameters: 9.153; 15.111; 10.39; 90; 104.49; 90; |
| COD ID: 1505258 | |
| CIF file | Formula: - C23 H20 S - Comments: Hua, Ruimao; Takeda, Hideaki; Onozawa, Shun-ya; Abe, Yoshimoto; Tanaka, Masato Nickel-catalyzed thioallylation of alkynes with allyl phenyl sulfides. Organic letters 9(2) (2007) 263-266 Space group: P 21 21 21 Cell volume: 1772.2 Cell parameters: 16.382; 17.248; 6.272; 90; 90; 90; |
| COD ID: 1505259 | |
| CIF file | Formula: - C14 H14 I N O3 - Comments: Conreaux, David; Bossharth, Emmanuel; Monteiro, Nuno; Desbordes, Philippe; Vors, Jean-Pierre; Balme, Geneviève Flexible strategy for differentially 3,5-disubstituted 4-oxypyridin-2(1H)-ones based on site-selective Pd-catalyzed cross-coupling reactions. Organic letters 9(2) (2007) 271-274 Space group: P 1 21/c 1 Cell volume: 1427.9 Cell parameters: 7.296; 26.087; 9.364; 90; 126.758; 90; |
| COD ID: 1505260 | |
| CIF file | Formula: - C20 H26 O4 - Comments: Xu, Gang; Hou, Ai-Jun; Zheng, Yong-Tang; Zhao, Yu; Li, Xiao-Li; Peng, Li-Yan; Zhao, Qin-Shi Przewalskin B, a novel diterpenoid with an unprecedented skeleton from Salvia przewalskii maxim. Organic letters 9(2) (2007) 291-293 Space group: P 21 21 21 Cell volume: 1856.22 Cell parameters: 6.751; 11.662; 23.577; 90; 90; 90; |
| COD ID: 1505261 | |
| CIF file | Formula: - C20 H16 N2 - Comments: Liu, Yuanhong; Song, Zhiquan; Yan, Bin General and direct synthesis of 3-aminoindolizines and their analogues via Pd/Cu-catalyzed sequential cross-coupling/cycloisomerization reactions. Organic letters 9(3) (2007) 409-412 Space group: P 1 21 1 Cell volume: 774.02 Cell parameters: 8.6574; 6.3454; 14.4396; 90; 102.638; 90; |
| COD ID: 1505262 | |
| CIF file | Formula: - C42 H28 N6 - Comments: Han, Fu She; Higuchi, Masayoshi; Kurth, Dirk G. Diverse synthesis of novel Bisterpyridines via Suzuki-type cross-coupling. Organic letters 9(4) (2007) 559-562 Space group: C 1 2/c 1 Cell volume: 3201.6 Cell parameters: 28.02; 10.6337; 10.9221; 90; 100.33; 90; |
| COD ID: 1505263 | |
| CIF file | Formula: - C42 H48 O6 - Comments: Ko, Haye Min; Lee, Dong Gil; Kim, Min Ah; Kim, Hak Joong; Park, Jaejoon; Lah, Myoung Soo; Lee, Eun Total synthesis of (-)-blepharocalyxin D. Organic letters 9(1) (2007) 141-144 Space group: P 21 21 21 Cell volume: 3570.8 Cell parameters: 6.0896; 22.401; 26.176; 90; 90; 90; |
| COD ID: 1505264 | |
| CIF file | Formula: - C15 H20 Cl2 Ir N O - Comments: Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols. Organic letters 9(1) (2007) 109-111 Space group: P -1 Cell volume: 800.33 Cell parameters: 7.251; 8.4985; 14.7866; 96.0595; 106.766; 109.7; |
| COD ID: 1505265 | |
| CIF file | Formula: - C15 H20 Cl2 Ir N O - Comments: Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols. Organic letters 9(1) (2007) 109-111 Space group: P 1 21 1 Cell volume: 784.94 Cell parameters: 7.2559; 13.5691; 8.4425; 90; 109.208; 90; |
| COD ID: 1505266 | |
| CIF file | Formula: - C15 H20 Cl2 Ir N O - Comments: Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols. Organic letters 9(1) (2007) 109-111 Space group: P b c a Cell volume: 3228.8 Cell parameters: 14.1344; 14.996; 15.2331; 90; 90; 90; |
| COD ID: 1505267 | |
| CIF file | Formula: - C15 H19 Cl Ir N O - Comments: Fujita, Ken-ichi; Tanino, Nobuhide; Yamaguchi, Ryohei Ligand-promoted dehydrogenation of alcohols catalyzed by Cp*Ir complexes. A new catalytic system for oxidant-free oxidation of alcohols. Organic letters 9(1) (2007) 109-111 Space group: P 21 21 21 Cell volume: 1519 Cell parameters: 7.848; 12.7189; 15.2177; 90; 90; 90; |
| COD ID: 1505268 | |
| CIF file | Formula: - C47 H50 O7 S - Comments: Yakovenko, Anton V.; Boyko, Vyacheslav I.; Danylyuk, Oksana; Suwinska, Kinga; Lipkowski, Janusz; Kalchenko, Vitaly I. Diastereoselective lower rim (1S)-camphorsulfonylation as the shortest way to the inherently chiral calix[4]arene. Organic letters 9(7) (2007) 1183-1185 Space group: P 21 21 21 Cell volume: 3920.09 Cell parameters: 11.7745; 16.8129; 19.8021; 90; 90; 90; |
| COD ID: 1505269 | |
| CIF file | Formula: - C42 H45 Cl3 O7 S - Comments: Yakovenko, Anton V.; Boyko, Vyacheslav I.; Danylyuk, Oksana; Suwinska, Kinga; Lipkowski, Janusz; Kalchenko, Vitaly I. Diastereoselective lower rim (1S)-camphorsulfonylation as the shortest way to the inherently chiral calix[4]arene. Organic letters 9(7) (2007) 1183-1185 Space group: P 1 21 1 Cell volume: 1949.82 Cell parameters: 11.1455; 15.2453; 11.5346; 90; 95.8198; 90; |
| COD ID: 1505270 | |
| CIF file | Formula: - C48.5 H60 O10 S2 - Comments: Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination. Organic letters 9(3) (2007) 493-496 Space group: P 1 21/n 1 Cell volume: 4680.8 Cell parameters: 14.0769; 10.8418; 30.997; 90; 98.333; 90; |
| COD ID: 1505271 | |
| CIF file | Formula: - C48 H60 O8 S4 - Comments: Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination. Organic letters 9(3) (2007) 493-496 Space group: P c a 21 Cell volume: 4698.3 Cell parameters: 18.5095; 11.1086; 22.85; 90; 90; 90; |
| COD ID: 1505272 | |
| CIF file | Formula: - C27 H37 Ag F6 N O5 P S2 - Comments: Lee, Jai Young; Kwon, Jongchul; Park, Chul Soon; Lee, Ji-Eun; Sim, Wonbo; Kim, Jong Seung; Seo, Joobeom; Yoon, Il; Jung, Jong Hwa; Lee, Shim Sung Calix[4]thiacrowns as ditopic hosts for homo- and heterobinuclear accommodation: first report of a chopsticks-type pi-coordination. Organic letters 9(3) (2007) 493-496 Space group: C 1 2/c 1 Cell volume: 6102.3 Cell parameters: 16.4451; 17.1416; 21.7675; 90; 96.026; 90; |
| COD ID: 1505273 | |
| CIF file | Formula: - C16 H19 N O4 - Comments: Souweha, Michael Santos; Arab, Akram; ApSimon, Megan; Fallis, Alex G. Diene-transmissive cycloadditions: control of monocycloaddition by self-assembly on a Lewis acid template. Organic letters 9(4) (2007) 615-618 Space group: P b c a Cell volume: 2873.6 Cell parameters: 10.9278; 10.6803; 24.621; 90; 90; 90; |
| COD ID: 1505274 | |
| CIF file | Formula: - C16 H19 N O4 - Comments: Souweha, Michael Santos; Arab, Akram; ApSimon, Megan; Fallis, Alex G. Diene-transmissive cycloadditions: control of monocycloaddition by self-assembly on a Lewis acid template. Organic letters 9(4) (2007) 615-618 Space group: P n a 21 Cell volume: 1373.8 Cell parameters: 7.434; 11.335; 16.304; 90; 90; 90; |
| COD ID: 1505275 | |
| CIF file | Formula: - C18 H22 N2 O5 - Comments: Souweha, Michael Santos; Arab, Akram; ApSimon, Megan; Fallis, Alex G. Diene-transmissive cycloadditions: control of monocycloaddition by self-assembly on a Lewis acid template. Organic letters 9(4) (2007) 615-618 Space group: P -1 Cell volume: 823 Cell parameters: 8.2927; 9.8597; 10.814; 104.025; 103.657; 95.315; |
| COD ID: 1505276 | |
| CIF file | Formula: - C11 H15 N O5 - Comments: Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H. Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s). Organic letters 9(5) (2007) 753-756 Space group: P 21 21 21 Cell volume: 1206.7 Cell parameters: 8.6357; 9.0665; 15.412; 90; 90; 90; |
| COD ID: 1505277 | |
| CIF file | Formula: - C12 H17 N O5 - Comments: Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H. Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s). Organic letters 9(5) (2007) 753-756 Space group: P 21 21 21 Cell volume: 1322.3 Cell parameters: 8.0623; 10.3743; 15.809; 90; 90; 90; |
| COD ID: 1505278 | |
| CIF file | Formula: - C10 H15 N O4 - Comments: Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H. Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s). Organic letters 9(5) (2007) 753-756 Space group: P 1 21 1 Cell volume: 512.18 Cell parameters: 7.241; 8.3118; 9.2383; 90; 112.902; 90; |
| COD ID: 1505279 | |
| CIF file | Formula: - C13 H21 N O6 - Comments: Shing, Tony K. M.; Wong, Wai F.; Cheng, Hau M.; Kwok, Wun S.; So, King H. Intramolecular nitrile oxide-alkene cycloaddition of sugar derivatives with unmasked hydroxyl group(s). Organic letters 9(5) (2007) 753-756 Space group: P 1 21 1 Cell volume: 736.7 Cell parameters: 7.1732; 7.1417; 14.467; 90; 96.269; 90; |
| COD ID: 1505280 | |
| CIF file | Formula: - C18 H17 N O3 S - Comments: Li, Hao; Wang, Jian; Xie, Hexin; Zu, Liansuo; Jiang, Wei; Duesler, Eileen N.; Wang, Wei Chiral Diphenylprolinol TES ether promoted conjugate addition-aldol-dehydration reactions between alpha,beta-unsaturated aldehydes and 2-N-protected amino benzaldehydes. Organic letters 9(6) (2007) 965-968 Space group: P 1 21 1 Cell volume: 812.61 Cell parameters: 7.6885; 13.6801; 8.0672; 90; 106.725; 90; |
| COD ID: 1505281 | |
| CIF file | Formula: - C26 H36 N2 O3 - Comments: Sünnemann, Hans Wolf; Hofmeister, Anja; Magull, Jörg; Banwell, Martin G.; de Meijere, Armin Stille/Diels-Alder reaction sequences: diversity-oriented access to novel steroids. Organic letters 9(3) (2007) 517-520 Space group: P 21 21 21 Cell volume: 2413.6 Cell parameters: 8.6266; 14.638; 19.114; 90; 90; 90; |
| COD ID: 1505282 | |
| CIF file | Formula: - C26 H36 O6 - Comments: Sünnemann, Hans Wolf; Hofmeister, Anja; Magull, Jörg; Banwell, Martin G.; de Meijere, Armin Stille/Diels-Alder reaction sequences: diversity-oriented access to novel steroids. Organic letters 9(3) (2007) 517-520 Space group: P 21 21 21 Cell volume: 2267.52 Cell parameters: 5.9811; 11.312; 33.5143; 90; 90; 90; |
| COD ID: 1505283 | |
| CIF file | Formula: - C22 H26 N2 O7 - Comments: Watanabe, Hideaki; Takano, Masashi; Umino, Akinori; Ito, Toshiya; Ishikawa, Hiroyuki; Nakada, Masahisa Enantioselective total synthesis of (-)-erinacine B. Organic letters 9(2) (2007) 359-362 Space group: C 1 2 1 Cell volume: 2049.9 Cell parameters: 23.8; 6.428; 15.69; 90; 121.35; 90; |
| COD ID: 1505284 | |
| CIF file | Formula: - C148 H176 O26 - Comments: Srinivasan, Kannupal; Gibb, Bruce C. Electrophilic substitution of deep cavity cavitands: selective exo functionalization of molecular concavity. Organic letters 9(5) (2007) 745-748 Space group: P 1 21/c 1 Cell volume: 14039.1 Cell parameters: 14.8357; 27.4469; 34.5254; 90; 93.01; 90; |
| COD ID: 1505285 | |
| CIF file | Formula: - C44 H54 Cl2 N6 O16 - Comments: Li, Liwei; Clarkson, Guy J. New bis(benzimidazole) cations for threading through dibenzo-24-crown-8. Organic letters 9(3) (2007) 497-500 Space group: P 1 21/c 1 Cell volume: 2347.1 Cell parameters: 11.681; 14.113; 14.416; 90; 99.034; 90; |
| COD ID: 1505286 | |
| CIF file | Formula: - C44 H54 F12 N6 O8 P2 - Comments: Li, Liwei; Clarkson, Guy J. New bis(benzimidazole) cations for threading through dibenzo-24-crown-8. Organic letters 9(3) (2007) 497-500 Space group: P 1 21/c 1 Cell volume: 2441.2 Cell parameters: 12.05; 14.681; 13.807; 90; 91.924; 90; |
| COD ID: 1505287 | |
| CIF file | Formula: - C42 H54 Cl2 N6 O20 - Comments: Li, Liwei; Clarkson, Guy J. New bis(benzimidazole) cations for threading through dibenzo-24-crown-8. Organic letters 9(3) (2007) 497-500 Space group: P -1 Cell volume: 1152.09 Cell parameters: 8.9434; 11.1496; 12.0657; 81.761; 80.448; 77.741; |
| COD ID: 1505288 | |
| CIF file | Formula: - C44 H54 F6 N6 O18 S2 - Comments: Li, Liwei; Clarkson, Guy J. New bis(benzimidazole) cations for threading through dibenzo-24-crown-8. Organic letters 9(3) (2007) 497-500 Space group: P -1 Cell volume: 1287 Cell parameters: 9.087; 11.84; 12.043; 87.468; 86.957; 84.55; |
| COD ID: 1505289 | |
| CIF file | Formula: - C44 H54 B2 F8 N6 O8 - Comments: Li, Liwei; Clarkson, Guy J. New bis(benzimidazole) cations for threading through dibenzo-24-crown-8. Organic letters 9(3) (2007) 497-500 Space group: P 1 21/c 1 Cell volume: 2306 Cell parameters: 11.526; 14.191; 14.332; 90; 100.314; 90; |
| COD ID: 1505290 | |
| CIF file | Formula: - C42 H54 F12 N6 O12 P2 - Comments: Li, Liwei; Clarkson, Guy J. New bis(benzimidazole) cations for threading through dibenzo-24-crown-8. Organic letters 9(3) (2007) 497-500 Space group: P 1 21/c 1 Cell volume: 2490 Cell parameters: 11.863; 14.597; 14.378; 90; 90.232; 90; |
| COD ID: 1505291 | |
| CIF file | Formula: - C42 H54 B2 F8 N6 O12 - Comments: Li, Liwei; Clarkson, Guy J. New bis(benzimidazole) cations for threading through dibenzo-24-crown-8. Organic letters 9(3) (2007) 497-500 Space group: P -1 Cell volume: 1125.2 Cell parameters: 8.8787; 11.0339; 12.038; 81.477; 79.33; 77.735; |
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