Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1513667 | CIF | C14 H15 N3 O3 S | P b c a | 7.6612; 13.3624; 28.3524 90; 90; 90 | 2902.49 | Wu, Bin; Gallucci, Judith C.; Parquette, Jon R.; RajanBabu, T. V. Bimetallic catalysis in the highly enantioselective ring‒opening reactions of aziridines Chemical Science, 2014, 5, 1102 |
| 1513668 | CIF | C39 H36 N4 Si | P -1 | 8.265; 11.375; 17.895 105.856; 99.89; 94.67 | 1579.6 | London, Gábor; von Wantoch Rekowski, Margarete; Dumele, Oliver; Schweizer, W. Bernd; Gisselbrecht, Jean-Paul; Boudon, Corinne; Diederich, François Pentalenes with novel topologies: exploiting the cascade carbopalladation reaction between alkynes and gem-dibromoolefins Chemical Science, 2014, 5, 965 |
| 1513669 | CIF | C45 H42 Cl2 N2 O4 Si | P 1 21/c 1 | 20.094; 17.545; 24.43 90; 112.452; 90 | 7960 | London, Gábor; von Wantoch Rekowski, Margarete; Dumele, Oliver; Schweizer, W. Bernd; Gisselbrecht, Jean-Paul; Boudon, Corinne; Diederich, François Pentalenes with novel topologies: exploiting the cascade carbopalladation reaction between alkynes and gem-dibromoolefins Chemical Science, 2014, 5, 965 |
| 1513670 | CIF | C39 H38 O2 Si | P -1 | 14.703; 14.833; 15.051 85.804; 87.16; 66.309 | 2997 | London, Gábor; von Wantoch Rekowski, Margarete; Dumele, Oliver; Schweizer, W. Bernd; Gisselbrecht, Jean-Paul; Boudon, Corinne; Diederich, François Pentalenes with novel topologies: exploiting the cascade carbopalladation reaction between alkynes and gem-dibromoolefins Chemical Science, 2014, 5, 965 |
| 1513671 | CIF | C34 H36.5 O3.25 Si | C 1 2/c 1 | 38.218; 19.296; 8.514 90; 90.665; 90 | 6278 | London, Gábor; von Wantoch Rekowski, Margarete; Dumele, Oliver; Schweizer, W. Bernd; Gisselbrecht, Jean-Paul; Boudon, Corinne; Diederich, François Pentalenes with novel topologies: exploiting the cascade carbopalladation reaction between alkynes and gem-dibromoolefins Chemical Science, 2014, 5, 965 |
| 1513672 | CIF | C33 H36 Si | P 1 21/c 1 | 8.8447; 18.3363; 17.4324 90; 114.902; 90 | 2564.3 | London, Gábor; von Wantoch Rekowski, Margarete; Dumele, Oliver; Schweizer, W. Bernd; Gisselbrecht, Jean-Paul; Boudon, Corinne; Diederich, François Pentalenes with novel topologies: exploiting the cascade carbopalladation reaction between alkynes and gem-dibromoolefins Chemical Science, 2014, 5, 965 |
| 1513673 | CIF | C26 H44 Cl4 N4 P4 | P -1 | 11.5705; 12.2221; 13.6923 111.408; 105.64; 97.431 | 1679.03 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513674 | CIF | C25 H42 Cl2 N4 P4 | C 1 2/c 1 | 18.4786; 10.3968; 16.676 90; 109.266; 90 | 3024.3 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513675 | CIF | C21 H40 Cl10 Ga2 N6 P2 Si2 | P 1 21/c 1 | 18.2251; 16.1902; 16.0587 90; 115.528; 90 | 4275.8 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513676 | CIF | C16 H29 F3 N O3 P S Si | P -1 | 11.1833; 16.4208; 19.4337 67.276; 82.19; 83.223 | 3252.83 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513677 | CIF | C16 H25 F3 N O3 P S Si | P 1 21/n 1 | 8.7479; 10.5358; 42.6705 90; 93.724; 90 | 3924.5 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513678 | CIF | C14 H25 Cl2 F3 N O4 P S | P n a 21 | 17.333; 8.3372; 14.4037 90; 90; 90 | 2081.5 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513679 | CIF | C36.81 H51.21 Mo N4 O3 P4 | P -1 | 9.1199; 13.8435; 17.1181 70.892; 88.485; 89.599 | 2041.39 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513680 | CIF | C27 H40 Mo N4 O3 P4 | P 1 21/c 1 | 9.0715; 18.1902; 18.4948 90; 94.483; 90 | 3042.5 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513681 | CIF | C31 H40 N4 O7 P4 W2 | P 1 21/c 1 | 20.4707; 20.2868; 18.9919 90; 110.519; 90 | 7386.7 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513682 | CIF | C12 H15 Mo N3 O3 | P 1 21/m 1 | 5.9362; 13.8472; 9.4 90; 97.888; 90 | 765.37 | Hering, Christian; Schulz, Axel; Villinger, Alexander Diatomic PN ‒ trapped in a cyclo-tetraphosphazene Chemical Science, 2014, 5, 1064 |
| 1513683 | CIF | C27 H43 B2 Mg N3 O5 | P 1 21/c 1 | 9.29; 24.265; 13.856 90; 106.244; 90 | 2998.8 | Mukherjee, Debabrata; Ellern, Arkady; Sadow, Aaron D. Magnesium-catalyzed hydroboration of esters: evidence for a new zwitterionic mechanism Chemical Science, 2014, 5, 959 |
| 1513684 | CIF | C52 H74 B2 Mg2 N6 O8 | P 1 21/c 1 | 10.4348; 19.441; 14.262 90; 99.963; 90 | 2849.6 | Mukherjee, Debabrata; Ellern, Arkady; Sadow, Aaron D. Magnesium-catalyzed hydroboration of esters: evidence for a new zwitterionic mechanism Chemical Science, 2014, 5, 959 |
| 1513685 | CIF | C120 H162 N2 O12 Se2 U2 | P -1 | 14.6186; 14.8584; 27.0913 90.0175; 93.0811; 116.842 | 5240.86 | Franke, Sebastian M.; Heinemann, Frank W.; Meyer, Karsten Reactivity of uranium(iv) bridged chalcogenido complexes UIV‒E‒UIV (E = S, Se) with elemental sulfur and selenium: synthesis of polychalcogenido-bridged uranium complexes Chemical Science, 2014, 5, 942 |
| 1513686 | CIF | C123.5 H151.5 N2 O6 Se3.86 U2 | P -1 | 11.2872; 16.8161; 28.943 85.729; 87.925; 89.368 | 5474.5 | Franke, Sebastian M.; Heinemann, Frank W.; Meyer, Karsten Reactivity of uranium(iv) bridged chalcogenido complexes UIV‒E‒UIV (E = S, Se) with elemental sulfur and selenium: synthesis of polychalcogenido-bridged uranium complexes Chemical Science, 2014, 5, 942 |
| 1513687 | CIF | C130 H164 N2 O8 Se4.11 U2 | P 1 21/c 1 | 18.092; 12.365; 28.315 90; 118.117; 90 | 5586.8 | Franke, Sebastian M.; Heinemann, Frank W.; Meyer, Karsten Reactivity of uranium(iv) bridged chalcogenido complexes UIV‒E‒UIV (E = S, Se) with elemental sulfur and selenium: synthesis of polychalcogenido-bridged uranium complexes Chemical Science, 2014, 5, 942 |
| 1513688 | CIF | C236 H314 N4 O22 S8 U4 | P -1 | 20.544; 22.5155; 24.1171 88.407; 84.055; 75.504 | 10742.3 | Franke, Sebastian M.; Heinemann, Frank W.; Meyer, Karsten Reactivity of uranium(iv) bridged chalcogenido complexes UIV‒E‒UIV (E = S, Se) with elemental sulfur and selenium: synthesis of polychalcogenido-bridged uranium complexes Chemical Science, 2014, 5, 942 |
| 1513689 | CIF | C34 H28 S2 | P 1 21/c 1 | 14.2992; 7.084; 13.4824 90; 108.84; 90 | 1292.54 | Young, Brian S; Chase, Daniel T; Marshall, Jonathan L; Vonnegut, Chris L; Zakharov, Lev N; Haley, Michael M Synthesis and Properties of Fully-Conjugated Indacenedithiophenes. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1008-1014 |
| 1513690 | CIF | C42 H32 S2 | P 1 21/c 1 | 14.4327; 11.8497; 8.9975 90; 94.02; 90 | 1534.99 | Young, Brian S; Chase, Daniel T; Marshall, Jonathan L; Vonnegut, Chris L; Zakharov, Lev N; Haley, Michael M Synthesis and Properties of Fully-Conjugated Indacenedithiophenes. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1008-1014 |
| 1513691 | CIF | C42 H32 S2 | P 1 21/n 1 | 13.689; 7.3177; 17.167 90; 112.808; 90 | 1585.2 | Young, Brian S; Chase, Daniel T; Marshall, Jonathan L; Vonnegut, Chris L; Zakharov, Lev N; Haley, Michael M Synthesis and Properties of Fully-Conjugated Indacenedithiophenes. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1008-1014 |
| 1513692 | CIF | C34 H28 S2 | P -1 | 7.9092; 8.0857; 10.8326 91.725; 107.227; 105.087 | 634.55 | Young, Brian S; Chase, Daniel T; Marshall, Jonathan L; Vonnegut, Chris L; Zakharov, Lev N; Haley, Michael M Synthesis and Properties of Fully-Conjugated Indacenedithiophenes. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 1008-1014 |
| 1513693 | CIF | C38 H29 N O2 | P -1 | 7.2711; 11.9307; 29.9623 95.055; 95.38; 95.045 | 2565.54 | Shi, Ke; Lei, Ting; Wang, Xiao-Ye; Wang, Jie-Yu; Pei, Jian A bowl-shaped molecule for organic field-effect transistors: crystal engineering and charge transport switching by oxygen doping Chemical Science, 2014, 5, 1041 |
| 1513694 | CIF | C9 H29 Al F3 N3 O4 | P b c a | 8.8131; 13.356; 26.551 90; 90; 90 | 3125.3 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513695 | CIF | C9 H29 F3 Ga N3 O4 | P 1 21/c 1 | 13.42; 8.871; 13.542 90; 97.816; 90 | 1597.2 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513696 | CIF | C9 H29 F3 In N3 O4 | P 1 21/n 1 | 6.8679; 20.187; 12.014 90; 99.482; 90 | 1642.9 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513697 | CIF | C15 H27 F3 In N3 O1.2 | P 1 21/n 1 | 6.7721; 13.666; 18.998 90; 96.106; 90 | 1748.2 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513698 | CIF | C9 H21 Al Cl3 N3 | P 1 21/c 1 | 12.128; 7.185; 15.695 90; 90.07; 90 | 1367.7 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513699 | CIF | C9 H21 Cl3 Ga N3 | P 1 21/c 1 | 12.173; 7.2253; 15.696 90; 90.239; 90 | 1380.5 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513700 | CIF | C10 H23 Br3 Cl2 In N3 | C 1 2/c 1 | 16.276; 16.175; 14.815 90; 105.595; 90 | 3756.7 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513701 | CIF | C15 H25 Cl3 In N3 | P 1 21/c 1 | 7.2893; 15.026; 18.528 90; 100.924; 90 | 1992.6 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513702 | CIF | C21 H51 Br3 Cl6 Ga2 N6 O3 | P 63/m | 12.979; 12.979; 13.565 90; 90; 120 | 1978.9 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513703 | CIF | C12 H36 Al2 F9 N3 | P 63/m | 7.997; 7.997; 18.178 90; 90; 120 | 1006.8 | Bhalla, Rajiv; Darby, Christine; Levason, William; Luthra, Sajinder K.; McRobbie, Graeme; Reid, Gillian; Sanderson, George; Zhang, Wenjian Triaza-macrocyclic complexes of aluminium, gallium and indium halides: fast 18F and 19F incorporation via halide exchange under mild conditions in aqueous solution Chemical Science, 2014, 5, 381 |
| 1513704 | CIF | C19 H14 F3 N O5 | P -1 | 5.512; 10.789; 14.89 88.566; 81.672; 83.072 | 869.7 | Aikawa, Kohsuke; Shimizu, Natsumi; Honda, Kazuya; Hioki, Yūta; Mikami, Koichi Effect of the trifluoromethyl group on torquoselectivity in the 4π ring-opening reaction of oxetenes: stereoselective synthesis of tetrasubstituted olefins Chemical Science, 2014, 5, 410 |
| 1513705 | CIF | C20 H13 F6 N O6 | C 1 2/c 1 | 22.067; 6.117; 29.455 90; 92.449; 90 | 3972 | Aikawa, Kohsuke; Shimizu, Natsumi; Honda, Kazuya; Hioki, Yūta; Mikami, Koichi Effect of the trifluoromethyl group on torquoselectivity in the 4π ring-opening reaction of oxetenes: stereoselective synthesis of tetrasubstituted olefins Chemical Science, 2014, 5, 410 |
| 1513706 | CIF | C19 H14 F3 N O5 | P -1 | 5.877; 11.649; 12.864 87.422; 81.769; 83.004 | 864.8 | Aikawa, Kohsuke; Shimizu, Natsumi; Honda, Kazuya; Hioki, Yūta; Mikami, Koichi Effect of the trifluoromethyl group on torquoselectivity in the 4π ring-opening reaction of oxetenes: stereoselective synthesis of tetrasubstituted olefins Chemical Science, 2014, 5, 410 |
| 1513707 | CIF | C20 H13 F6 N O6 | P 1 21/c 1 | 10.5731; 28.9962; 13.1962 90; 94.339; 90 | 4034.1 | Aikawa, Kohsuke; Shimizu, Natsumi; Honda, Kazuya; Hioki, Yūta; Mikami, Koichi Effect of the trifluoromethyl group on torquoselectivity in the 4π ring-opening reaction of oxetenes: stereoselective synthesis of tetrasubstituted olefins Chemical Science, 2014, 5, 410 |
| 1513708 | CIF | C19 F3 Fe N7 O3 S2 | P n m a | 24.2856; 12.7122; 9.1833 90; 90; 90 | 2835.1 | Hong, Seungwoo; Lee, Yong-Min; Cho, Kyung-Bin; Seo, Mi Sook; Song, Dayoung; Yoon, Jihae; Garcia-Serres, Ricardo; Clémancey, Martin; Ogura, Takashi; Shin, Woonsup; Latour, Jean-Marc; Nam, Wonwoo Conversion of high-spin iron(iii)‒alkylperoxo to iron(iv)‒oxo species via O‒O bond homolysis in nonheme iron models Chemical Science, 2014, 5, 156 |
| 1513709 | CIF | C49 H78 Fe K N2 O3 | P 1 21/n 1 | 12.5266; 15.2138; 25.537 90; 92.315; 90 | 4862.8 | Chiang, Karen P.; Bellows, Sarina M.; Brennessel, William W.; Holland, Patrick L. Multimetallic Cooperativity in Activation of Dinitrogen at Iron-Potassium Sites. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 267 |
| 1513710 | CIF | C82 H116 Fe2 K2 N4 O2 | C 1 2/c 1 | 37.332; 9.7164; 23.2858 90; 111.588; 90 | 7854 | Chiang, Karen P.; Bellows, Sarina M.; Brennessel, William W.; Holland, Patrick L. Multimetallic Cooperativity in Activation of Dinitrogen at Iron-Potassium Sites. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 267 |
| 1513711 | CIF | C105 H142 Fe2 K2 N4 O5 | P 1 21/c 1 | 19.4155; 26.1583; 20.9929 90; 116.455; 90 | 9545.3 | Chiang, Karen P.; Bellows, Sarina M.; Brennessel, William W.; Holland, Patrick L. Multimetallic Cooperativity in Activation of Dinitrogen at Iron-Potassium Sites. Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 267 |
| 1513712 | CIF | C17 H13 Br F2 O2 | P 1 21 1 | 18.0913; 7.5678; 22.361 90; 93.183; 90 | 3056.8 | Zhang, Qi; Nguyen, Hien M. Rhodium-catalyzed regioselective opening of vinyl epoxides with Et3N·3HF reagent ‒ formation of allylic fluorohydrins Chemical Science, 2014, 5, 291 |
| 1513713 | CIF | C34 H55 Cu6 F N12 O5 | P 1 21/m 1 | 9.9429; 22.741; 10.5329 90; 111.939; 90 | 2209.1 | Cañon-Mancisidor, Walter; Gómez-García, Carlos J.; Espallargas, Guillermo Mínguez; Vega, Andres; Spodine, Evgenia; Venegas-Yazigi, Diego; Coronado, Eugenio Structural re-arrangement in two hexanuclear CuII complexes: from a spin frustrated trigonal prism to a strongly coupled antiferromagnetic soluble ring complex with a porous tubular structure Chemical Science, 2014, 5, 324 |
| 1513714 | CIF | C33 H52 Cl3 Cu6 N13 O6 | R -3 :H | 19.873; 19.873; 9.9681 90; 90; 120 | 3409.34 | Cañon-Mancisidor, Walter; Gómez-García, Carlos J.; Espallargas, Guillermo Mínguez; Vega, Andres; Spodine, Evgenia; Venegas-Yazigi, Diego; Coronado, Eugenio Structural re-arrangement in two hexanuclear CuII complexes: from a spin frustrated trigonal prism to a strongly coupled antiferromagnetic soluble ring complex with a porous tubular structure Chemical Science, 2014, 5, 324 |
| 1513715 | CIF | C30 H48 Cu6 N12 O6 | R -3 :H | 20.1726; 20.1726; 10.1341 90; 90; 120 | 3571.4 | Cañon-Mancisidor, Walter; Gómez-García, Carlos J.; Espallargas, Guillermo Mínguez; Vega, Andres; Spodine, Evgenia; Venegas-Yazigi, Diego; Coronado, Eugenio Structural re-arrangement in two hexanuclear CuII complexes: from a spin frustrated trigonal prism to a strongly coupled antiferromagnetic soluble ring complex with a porous tubular structure Chemical Science, 2014, 5, 324 |
| 1513716 | CIF | C30 H48 Cu6 N12 O6 | R -3 :H | 19.8969; 19.8969; 9.9518 90; 90; 120 | 3411.95 | Cañon-Mancisidor, Walter; Gómez-García, Carlos J.; Espallargas, Guillermo Mínguez; Vega, Andres; Spodine, Evgenia; Venegas-Yazigi, Diego; Coronado, Eugenio Structural re-arrangement in two hexanuclear CuII complexes: from a spin frustrated trigonal prism to a strongly coupled antiferromagnetic soluble ring complex with a porous tubular structure Chemical Science, 2014, 5, 324 |
| 1513717 | CIF | C92 H162 Cr7 F8 N Ni O35 | C 1 2/c 1 | 55.3514; 16.6288; 32.7345 90; 115.557; 90 | 27181.7 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513718 | CIF | C94 H167 Cr7 F8 N2 Ni O34 | P 1 21/c 1 | 25.0881; 16.4808; 33.9931 90; 91.685; 90 | 14049.1 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513719 | CIF | C98 H175 Cr7 F8 N2 Ni O34 | P 1 21/n 1 | 16.2899; 30.037; 29.588 90; 97.377; 90 | 14357.6 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513720 | CIF | C359 H630 Cr28 Cu4 F32 N4 Ni4 O141 | P 4/n c c :2 | 42.289; 42.289; 31.7707 90; 90; 90 | 56817.4 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513721 | CIF | C549 H930 Cr42 F48 N6 Ni6 O207 Zn4 | P 1 21/n 1 | 39.9717; 48.6332; 43.5363 90; 91.283; 90 | 84611 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513722 | CIF | C23.5 H56 Si6 | C 1 2/c 1 | 17.135; 9.4044; 20.723 90; 101.54; 90 | 3271.9 | Tibbelin, Julius; Wallner, Andreas; Emanuelsson, Rikard; Heijkenskjöld, Filip; Rosenberg, Martin; Yamazaki, Kaoru; Nauroozi, Djawed; Karlsson, Leif; Feifel, Raimund; Pettersson, Roland; Baumgartner, Judith; Ott, Sascha; Ottosson, Henrik 1,4-Disilacyclohexa-2,5-diene: a molecular building block that allows for remarkably strong neutral cyclic cross-hyperconjugation Chemical Science, 2014, 5, 360 |
| 1513723 | CIF | C79.72 H78.59 F48 N14.86 P8 | P -1 | 16.6223; 22.9236; 29.6344 71.154; 78.075; 73.175 | 10149.1 | Hartlieb, Karel J.; Blackburn, Anthea K.; Schneebeli, Severin T.; Forgan, Ross S.; Sarjeant, Amy A.; Stern, Charlotte L.; Cao, Dennis; Stoddart, J. Fraser Topological isomerism in a chiral handcuff catenane Chemical Science, 2014, 5, 90 |
| 1513724 | CIF | C125 H139 F48 N15 O15 P8 | P -1 | 16.475; 18.609; 25.278 105.106; 99.281; 93.008 | 7348 | Hartlieb, Karel J.; Blackburn, Anthea K.; Schneebeli, Severin T.; Forgan, Ross S.; Sarjeant, Amy A.; Stern, Charlotte L.; Cao, Dennis; Stoddart, J. Fraser Topological isomerism in a chiral handcuff catenane Chemical Science, 2014, 5, 90 |
| 1513725 | CIF | C110 H118 F48 N8 O14 P8 | P 1 21/n 1 | 20.0951; 31.3942; 24.2862 90; 94.082; 90 | 15282.6 | Hartlieb, Karel J.; Blackburn, Anthea K.; Schneebeli, Severin T.; Forgan, Ross S.; Sarjeant, Amy A.; Stern, Charlotte L.; Cao, Dennis; Stoddart, J. Fraser Topological isomerism in a chiral handcuff catenane Chemical Science, 2014, 5, 90 |
| 1513726 | CIF | K19 O223.5 P8 U31 | P -4 21 c | 41; 41; 32.818 90; 90; 90 | 55167 | Qiu, Jie; Ling, Jie; Jouffret, Laurent; Thomas, Rebecca; Szymanowski, Jennifer E. S.; Burns, Peter C. Water-soluble multi-cage super tetrahedral uranyl peroxide phosphate clusters Chemical Science, 2014, 5, 303 |
| 1513727 | CIF | C42 H34 | C 1 2/c 1 | 14.515; 15.214; 13.3114 90; 99.134; 90 | 2902.3 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513728 | CIF | C50 H34 Cl2 N2 O2 | P 1 21/c 1 | 9.251; 18.592; 22.277 90; 94.409; 90 | 3820 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513729 | CIF | C45 H40 O3 | P 1 21/c 1 | 8.266; 18.71; 21.637 90; 90.739; 90 | 3346 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513730 | CIF | C90 H73 Cl | P -1 | 8.5044; 19.248; 20.4545 82.0704; 78.1032; 82.3308 | 3225.9 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513731 | CIF | C36 H33 B F6 N11 O6.5 Pd S2 | P b c a | 17.177; 19.182; 24.723 90; 90; 90 | 8146 | Brandt, Jochen R.; Lee, Eunsung; Boursalian, Gregory B.; Ritter, Tobias Mechanism of Electrophilic Fluorination with Pd(IV): Fluoride Capture and Subsequent Oxidative Fluoride Transfer(.) Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 169 |
| 1513732 | CIF | C24 H27 N3 O5 | P -1 | 8.9819; 10.28; 13.008 86.49; 73.036; 79.688 | 1130.21 | Zhang, Yan; Wu, Qifan; Cui, Sunliang Rh(iii)-catalyzed C‒H activation‒desymmetrization of diazabicycles with arenes: facile synthesis of functionalized cyclopentenes Chemical Science, 2014, 5, 297 |
| 1513762 | CIF | C34 H33 Cl3 N2 Pd | P 1 n 1 | 11.7926; 9.4147; 14.555 90; 101.906; 90 | 1581.19 | Huo, Ping; Liu, Wanyun; He, Xiaohui; Wei, Zhenhong; Chen, Yiwang Substituent effects and activation mechanism of norbornene polymerization catalyzed by three-dimensional geometry α-diimine palladium complexes Polymer Chemistry, 2014, 5, 1210 |
| 1513763 | CIF | C35 H35 Cl N2 Pd | P 1 21/n 1 | 12.0765; 19.5745; 12.7667 90; 90.899; 90 | 3017.6 | Huo, Ping; Liu, Wanyun; He, Xiaohui; Wei, Zhenhong; Chen, Yiwang Substituent effects and activation mechanism of norbornene polymerization catalyzed by three-dimensional geometry α-diimine palladium complexes Polymer Chemistry, 2014, 5, 1210 |
| 1513764 | CIF | C119 H90 Cl18 N8 Pd4 | P -1 | 9.4659; 18.1651; 18.9183 68.501; 75.588; 84.629 | 2931.4 | Huo, Ping; Liu, Wanyun; He, Xiaohui; Wei, Zhenhong; Chen, Yiwang Substituent effects and activation mechanism of norbornene polymerization catalyzed by three-dimensional geometry α-diimine palladium complexes Polymer Chemistry, 2014, 5, 1210 |
| 1513765 | CIF | C32 H30 Fe2 Ru Si2 | P -1 | 14.3465; 14.4684; 14.5968 66.44; 68.64; 86.12 | 2575.74 | Erhard, Maximilian; Lam, Kevin; Haddow, Mairi; Whittell, George R.; Geiger, William E.; Manners, Ian Polyferrocenylsilane homopolymers and diblock copolymers with pendant ruthenocenyl groups by photocontrolled ring-opening polymerisation Polymer Chemistry, 2014, 5, 1264 |
| 1513766 | CIF | C21 H20 Fe Ru Si | P 1 21/c 1 | 12.4947; 8.9461; 31.2176 90; 100.039; 90 | 3436.04 | Erhard, Maximilian; Lam, Kevin; Haddow, Mairi; Whittell, George R.; Geiger, William E.; Manners, Ian Polyferrocenylsilane homopolymers and diblock copolymers with pendant ruthenocenyl groups by photocontrolled ring-opening polymerisation Polymer Chemistry, 2014, 5, 1264 |
| 1513767 | CIF | C10 H9 Br Ru | P 1 21/m 1 | 7.1295; 8.9916; 7.2907 90; 109.503; 90 | 440.56 | Erhard, Maximilian; Lam, Kevin; Haddow, Mairi; Whittell, George R.; Geiger, William E.; Manners, Ian Polyferrocenylsilane homopolymers and diblock copolymers with pendant ruthenocenyl groups by photocontrolled ring-opening polymerisation Polymer Chemistry, 2014, 5, 1264 |
| 1513791 | CIF | C70 H66 Cl6 O4 Os P3 S | P 1 21/c 1 | 23.9712; 10.7966; 25.4621 90; 95.78; 90 | 6556.3 | Zhu, Congqing; Luo, Ming; Zhu, Qin; Zhu, Jun; Schleyer, Paul V. R.; Wu, Judy I-Chia; Lu, Xin; Xia, Haiping Planar Möbius aromatic pentalenes incorporating 16 and 18 valence electron osmiums. Nature communications, 2014, 5, 3265 |
| 1513792 | CIF | C64.5 H57 Al2 Cl12 O3 Os P3 | P 1 21/n 1 | 18.4337; 19.2879; 20.2958 90; 97.813; 90 | 7149.1 | Zhu, Congqing; Luo, Ming; Zhu, Qin; Zhu, Jun; Schleyer, Paul V. R.; Wu, Judy I-Chia; Lu, Xin; Xia, Haiping Planar Möbius aromatic pentalenes incorporating 16 and 18 valence electron osmiums. Nature communications, 2014, 5, 3265 |
| 1513793 | CIF | C66 H58 Cl3 O5 Os P3 | P 1 21/c 1 | 12.6439; 21.0196; 21.9093 90; 96.0021; 90 | 5790.91 | Zhu, Congqing; Luo, Ming; Zhu, Qin; Zhu, Jun; Schleyer, Paul V. R.; Wu, Judy I-Chia; Lu, Xin; Xia, Haiping Planar Möbius aromatic pentalenes incorporating 16 and 18 valence electron osmiums. Nature communications, 2014, 5, 3265 |
| 1513794 | CIF | C21 H29 F5 Si3 | P b c a | 11.6307; 12.5277; 33.4761 90; 90; 90 | 4877.7 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513795 | CIF | C21 H31 F5 Si3 | P b c a | 11.6585; 12.5084; 33.328 90; 90; 90 | 4860.2 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513796 | CIF | C21 H29 F5 Si3 | P c a 21 | 19.1914; 10.6017; 23.3513 90; 90; 90 | 4751.1 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513797 | CIF | C25 H33 F5 Si3 | P -1 | 9.6564; 11.3871; 12.9349 72.1; 81.25; 79.77 | 1324.69 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513798 | CIF | C11 H15 N5 O7 | P 1 21 1 | 5.6548; 27.587; 8.526 90; 95.291; 90 | 1324.4 | Zhao, Hang; Guo, Xiurong; He, Shiliang; Zeng, Xin; Zhou, Xinglong; Zhang, Chaoliang; Hu, Jing; Wu, Xiaohua; Xing, Zhihua; Chu, Liangyin; He, Yang; Chen, Qianming Complex self-assembly of pyrimido[4,5-d]pyrimidine nucleoside supramolecular structures. Nature communications, 2014, 5, 3108 |
| 1513799 | CIF | C11 H13 N5 O5 | P 1 | 4.9116; 8.8528; 13.96 105.332; 93.529; 91.847 | 583.54 | Zhao, Hang; Guo, Xiurong; He, Shiliang; Zeng, Xin; Zhou, Xinglong; Zhang, Chaoliang; Hu, Jing; Wu, Xiaohua; Xing, Zhihua; Chu, Liangyin; He, Yang; Chen, Qianming Complex self-assembly of pyrimido[4,5-d]pyrimidine nucleoside supramolecular structures. Nature communications, 2014, 5, 3108 |
| 1513839 | CIF | C27 H37 N2 P | C 1 2/c 1 | 20.0613; 6.9855; 38.187 90; 102.741; 90 | 5219.7 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513840 | CIF | C58 H80 Cl N4 O P3 | P 1 21/c 1 | 17.0305; 21.4738; 16.7809 90; 115.996; 90 | 5516 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513841 | CIF | C72 H116 Cl N4 O3 P7 Si2 | P 1 21/n 1 | 22.3995; 12.1255; 29.5997 90; 90.82; 90 | 8038.6 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513842 | CIF | C54 H72 N4 P3 | P -1 | 11.9151; 13.5428; 15.8914 85.68; 89.601; 79.255 | 2512.11 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513843 | CIF | C66 H96 As Cl N4 O3 P2 | C 1 2/c 1 | 24.928; 14.103; 17.8654 90; 92.468; 90 | 6274.9 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513844 | CIF | C54 H72 As N4 P2 | C 1 c 1 | 10.2682; 42.469; 24.23 90; 92.756; 90 | 10554 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513845 | CIF | C60 H78 N4 O4 P6 | P 1 21/n 1 | 23.6782; 18.3268; 29.7342 90; 103.981; 90 | 12520.8 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513846 | CIF | C39 H40 Cl4 F6 N3 O6 P2 Pt S2 | C 1 2/c 1 | 20.729; 16.7382; 13.9693 90; 93.679; 90 | 4836.9 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513847 | CIF | C60 H61 F12 K N3 O13 P3 Pt S4 | P -1 | 13.778; 14.772; 17.476 84.622; 82.6; 83.819 | 3495.21 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513848 | CIF | C48 H64 F12 N3 O3.5 P4 Rh | P 1 21/c 1 | 13.854; 22.376; 19.553 90; 109.609; 90 | 5709.8 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513849 | CIF | C38 H40 Cl5 F6 N3 O6 P2 Pt S2 | C 1 2/c 1 | 26.8737; 12.5922; 16.0468 90; 120.726; 90 | 4667.93 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513850 | CIF | C120 H126 F24 N6 O4 P10 Rh2 | P 1 21/c 1 | 15.7239; 17.5295; 23.5911 90; 106.188; 90 | 6244.7 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513851 | CIF | C56 H44 Ca2 F12 N12 O16 S4 | P -1 | 11.2305; 12.1307; 13.8812 97.683; 111.479; 105.007 | 1643.89 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513852 | CIF | C26 H30 Ca Cl2 N8 O | P 1 21/c 1 | 13.9231; 13.4981; 15.7366 90; 104.682; 90 | 2860.9 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513853 | CIF | C13 H10 Ca F6 N4 O6 S2 | P -1 | 8.8738; 10.2258; 11.11 92.066; 98.016; 100.127 | 980.84 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513854 | CIF | C33 H29 Ca Cl2 N12 O8 | C 1 2/c 1 | 11.208; 19.89; 18.423 90; 96.346; 90 | 4081.8 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513855 | CIF | C58 H57 Ca2 N15 O8 | P -1 | 12.8935; 14.4392; 18.0468 92.81; 107.021; 114.714 | 2861 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513856 | CIF | C11 H20 Au Cl N4 O | P -1 | 7.5169; 9.9819; 10.683 113.158; 90.038; 98.162 | 728.12 | Chen, Yong; Cheng, Gang; Li, Kai; Shelar, Deepak P.; Lu, Wei; Che, Chi-Ming Phosphorescent polymeric nanomaterials with metallophilic d10⋯d10 interactions self-assembled from [Au(NHC)2]+ and [M(CN)2]− Chemical Science, 2014, 5, 1348 |
| 1513857 | CIF | C12 H16 Au2 N6 | C 1 2/m 1 | 15.634; 6.3008; 8.0648 90; 108.223; 90 | 754.59 | Chen, Yong; Cheng, Gang; Li, Kai; Shelar, Deepak P.; Lu, Wei; Che, Chi-Ming Phosphorescent polymeric nanomaterials with metallophilic d10⋯d10 interactions self-assembled from [Au(NHC)2]+ and [M(CN)2]− Chemical Science, 2014, 5, 1348 |
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