Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1514681 | CIF | C13 H11 Cl3 N2 O | P 21 21 21 | 11.2235; 11.7597; 20.531 90; 90; 90 | 2709.8 | Brindle, Cheyenne S.; Yeung, Charles S.; Jacobsen, Eric N. Chiral β-Iodoamines by Urea-Catalyzed Iodocyclization of Trichloroacetimidates. Chemical sciences journal, 2013, 4, 2100 |
| 1514682 | CIF | C28 H27 Cl N2 O S | P 21 21 21 | 11.741; 12.62; 15.891 90; 90; 90 | 2354.6 | Robinson, Emily R. T.; Fallan, Charlene; Simal, Carmen; Slawin, Alexandra M. Z.; Smith, Andrew D. Anhydrides as α,β-unsaturated acyl ammonium precursors: isothiourea-promoted catalytic asymmetric annulation processes Chemical Science, 2013, 4, 2193 |
| 1514683 | CIF | C44 H28 Cl3 F20 N O4 P Rh | P -1 | 11.5246; 12.6819; 17.2832 68.867; 84.99; 77.05 | 2296.1 | Dalton, Derek M.; Rappé, Anthony K; Rovis, Tomislav Perfluorinated Taddol Phosphoramidite as an L,Z-Ligand on Rh(I) and Co(-I): Evidence for Bidentate Coordination via Metal-C6F5 Interaction. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2062-2070 |
| 1514684 | CIF | C44 H28 Cl F23 N O7 P Rh S | P -1 | 10.4903; 14.3946; 15.5781 78.012; 84.045; 72.01 | 2186.6 | Dalton, Derek M.; Rappé, Anthony K; Rovis, Tomislav Perfluorinated Taddol Phosphoramidite as an L,Z-Ligand on Rh(I) and Co(-I): Evidence for Bidentate Coordination via Metal-C6F5 Interaction. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2062-2070 |
| 1514685 | CIF | C50 H33 F20 N O7 P Rh S | P -1 | 11.7155; 12.1131; 18.2303 70.901; 89.025; 83.198 | 2426.82 | Dalton, Derek M.; Rappé, Anthony K; Rovis, Tomislav Perfluorinated Taddol Phosphoramidite as an L,Z-Ligand on Rh(I) and Co(-I): Evidence for Bidentate Coordination via Metal-C6F5 Interaction. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2062-2070 |
| 1514686 | CIF | C54 H52 Co F20 N2 O7 P | P -1 | 13.4123; 14.8876; 16.7728 94.268; 90.34; 97.344 | 3312.1 | Dalton, Derek M.; Rappé, Anthony K; Rovis, Tomislav Perfluorinated Taddol Phosphoramidite as an L,Z-Ligand on Rh(I) and Co(-I): Evidence for Bidentate Coordination via Metal-C6F5 Interaction. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 2062-2070 |
| 1514687 | CIF | C35 H48 Cl N3 O2 | P 1 21/c 1 | 10.3948; 12.9525; 25.0752 90; 92.424; 90 | 3373.1 | Despagnet-Ayoub, Emmanuelle; Miqueu, Karinne; Sotiropoulos, Jean-Marc; Henling, Lawrence M.; Day, Michael W.; Labinger, Jay A.; Bercaw, John E. Unexpected rearrangements in the synthesis of an unsymmetrical tridentate dianionic N-heterocyclic carbene Chemical Science, 2013, 4, 2117 |
| 1514688 | CIF | C39 H53 B2 F8 N3 O3 | P -1 | 8.9329; 15.3817; 16.3064 79.606; 81.358; 75.254 | 2118.34 | Despagnet-Ayoub, Emmanuelle; Miqueu, Karinne; Sotiropoulos, Jean-Marc; Henling, Lawrence M.; Day, Michael W.; Labinger, Jay A.; Bercaw, John E. Unexpected rearrangements in the synthesis of an unsymmetrical tridentate dianionic N-heterocyclic carbene Chemical Science, 2013, 4, 2117 |
| 1514689 | CIF | C79 H48 Cl5 | P -1 | 12.2674; 13.4426; 19.906 83.633; 76.942; 65.569 | 2910.8 | Xiao, Shengxiong; Kang, Seok Ju; Wu, Ying; Ahn, Seokhoon; Kim, Jong Bok; Loo, Yueh-Lin; Siegrist, Theo; Steigerwald, Michael L.; Li, Hexing; Nuckolls, Colin Supersized contorted aromatics Chemical Science, 2013, 4, 2018 |
| 1514690 | CIF | C16 H23 N O2 | P -1 | 8.796; 8.8679; 10.3885 75.311; 80.306; 71.263 | 738.95 | Millet, Anthony; Larini, Paolo; Clot, Eric; Baudoin, Olivier Ligand-controlled β-selective C(sp3)–H arylation of N-Boc-piperidines Chemical Science, 2013, 4, 2241 |
| 1514691 | CIF | C24 H28 F3 N O2 | P 1 21/c 1 | 9.7796; 10.0791; 21.9689 90; 96.101; 90 | 2153.2 | Millet, Anthony; Larini, Paolo; Clot, Eric; Baudoin, Olivier Ligand-controlled β-selective C(sp3)–H arylation of N-Boc-piperidines Chemical Science, 2013, 4, 2241 |
| 1514692 | CIF | C20 H29 N O2 | P -1 | 10.7367; 11.183; 16.106 76.241; 75.622; 77.643 | 1794.66 | Millet, Anthony; Larini, Paolo; Clot, Eric; Baudoin, Olivier Ligand-controlled β-selective C(sp3)–H arylation of N-Boc-piperidines Chemical Science, 2013, 4, 2241 |
| 1514693 | CIF | C21 H27 Br N O3.5 | P -1 | 8.953; 9.856; 14.208 89.921; 72.269; 70.983 | 1122.3 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514694 | CIF | C19 H22 Br N O4 | C 1 2 1 | 28.468; 6.5087; 10.903 90; 101.161; 90 | 1982 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514695 | CIF | C20 H27 N O4 | P n a 21 | 16.349; 11.424; 20.499 90; 90; 90 | 3828.6 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514696 | CIF | C21 H26 Cl N O4 | P 1 21/n 1 | 13.807; 9.648; 15.895 90; 95.425; 90 | 2107.9 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514697 | CIF | C19 H22 Cl N O3 | P 1 21/n 1 | 12.2391; 13.5132; 12.6257 90; 118.77; 90 | 1830.4 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514698 | CIF | C21 H26 Br N O3 | P 1 21/n 1 | 19.981; 10.4357; 20.133 90; 104.963; 90 | 4055.7 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514699 | CIF | C19 H25 N O3 | P 1 21/c 1 | 9.0052; 19.3148; 11.0511 90; 110.477; 90 | 1800.7 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514700 | CIF | C19 H25 N O3 | P 21 21 21 | 8.2536; 12.3017; 17.9593 90; 90; 90 | 1823.47 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514701 | CIF | C16 H20 N2 O3.33 | P 1 21 1 | 9.4884; 7.3139; 12.2804 90; 105.801; 90 | 820.02 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514702 | CIF | C19 H27 N O4 | P 1 21 1 | 10.7474; 7.1883; 12.3435 90; 112.278; 90 | 882.42 | Eitel, Simon H.; Jautze, Sascha; Frey, Wolfgang; Peters, René Asymmetric Michael additions of α-cyanoacetates by soft Lewis acid/hard Brønsted acid catalysis: stereodivergency with bi- vs. monometallic catalysts Chemical Science, 2013, 4, 2218 |
| 1514703 | CIF | C42 H34 B F15 O2 Sc | C 1 2/c 1 | 29.7078; 13.6826; 21.4688 90; 114.327; 90 | 7951.8 | Berkefeld, Andreas; Piers, Warren E.; Parvez, Masood; Castro, Ludovic; Maron, Laurent; Eisenstein, Odile Decamethylscandocinium-hydrido-(perfluorophenyl)borate: fixation and tandem tris(perfluorophenyl)borane catalysed deoxygenative hydrosilation of carbon dioxide Chemical Science, 2013, 4, 2152 |
| 1514704 | CIF | C42 H36 B F15 Sc | P 1 21/n 1 | 13.9542; 16.0174; 17.9508 90; 97.5764; 90 | 3977.16 | Berkefeld, Andreas; Piers, Warren E.; Parvez, Masood; Castro, Ludovic; Maron, Laurent; Eisenstein, Odile Decamethylscandocinium-hydrido-(perfluorophenyl)borate: fixation and tandem tris(perfluorophenyl)borane catalysed deoxygenative hydrosilation of carbon dioxide Chemical Science, 2013, 4, 2152 |
| 1514705 | CIF | C19 H21 N O3 | P -1 | 6.229; 11.758; 12.009 88.61; 77.64; 83.8 | 854.1 | McBurney, Roy T.; Eisenschmidt, Annika; Slawin, Alexandra M. Z.; Walton, John C. Rapid and selective spiro-cyclisations of O-centred radicals onto aromatic acceptors Chemical Science, 2013, 4, 2028 |
| 1514706 | CIF | C15 H12 F N O3 | P 1 21/n 1 | 14.6982; 4.5311; 19.448 90; 97.309; 90 | 1284.7 | McBurney, Roy T.; Eisenschmidt, Annika; Slawin, Alexandra M. Z.; Walton, John C. Rapid and selective spiro-cyclisations of O-centred radicals onto aromatic acceptors Chemical Science, 2013, 4, 2028 |
| 1514707 | CIF | C17 H17 N O6 S | P -1 | 5.707; 7.877; 18.99 98.61; 91.4; 91.03 | 844 | McBurney, Roy T.; Eisenschmidt, Annika; Slawin, Alexandra M. Z.; Walton, John C. Rapid and selective spiro-cyclisations of O-centred radicals onto aromatic acceptors Chemical Science, 2013, 4, 2028 |
| 1514708 | CIF | C15 H8 F5 N O3 | P 1 21 1 | 7.89; 5.6; 16.51 90; 102.65; 90 | 712 | McBurney, Roy T.; Eisenschmidt, Annika; Slawin, Alexandra M. Z.; Walton, John C. Rapid and selective spiro-cyclisations of O-centred radicals onto aromatic acceptors Chemical Science, 2013, 4, 2028 |
| 1514709 | CIF | C92 H96 Mo2 N4 O10 S2 | P -1 | 12.6203; 13.1151; 13.4075 81.395; 89.382; 84.039 | 2182.29 | Brown-Xu, Samantha E.; Chisholm, Malcolm H.; Durr, Christopher B.; Lewis, Sharlene A.; Naseri, Vesal; Spilker, Thomas F. MM quadruple bonds supported by cyanoacrylate ligands. Extending photon harvesting into the near infrared and studies of the MLCT states Chemical Science, 2013, 4, 2105 |
| 1514710 | CIF | C88 H100 Mo2 N4 O11 | P -1 | 12.843; 16.816; 21.696 74.31; 76.48; 72.72 | 4247 | Brown-Xu, Samantha E.; Chisholm, Malcolm H.; Durr, Christopher B.; Lewis, Sharlene A.; Naseri, Vesal; Spilker, Thomas F. MM quadruple bonds supported by cyanoacrylate ligands. Extending photon harvesting into the near infrared and studies of the MLCT states Chemical Science, 2013, 4, 2105 |
| 1514711 | CIF | C14 H12 N2 | P 1 21 1 | 12.1824; 7.56; 12.3739 90; 106.815; 90 | 1090.9 | Liu, Bo; Huang, Yumin; Lan, Jingbo; Song, Feijie; You, Jingsong Pd-catalyzed oxidative C–H/C–H cross-coupling of pyridines with heteroarenes Chemical Science, 2013, 4, 2163 |
| 1514712 | CIF | C15 H17 N5 O2 | P 1 21/c 1 | 10.8034; 6.9959; 19.4702 90; 102.269; 90 | 1437.94 | Liu, Bo; Huang, Yumin; Lan, Jingbo; Song, Feijie; You, Jingsong Pd-catalyzed oxidative C–H/C–H cross-coupling of pyridines with heteroarenes Chemical Science, 2013, 4, 2163 |
| 1514713 | CIF | C16 H11 N O S | P n a 21 | 23.0013; 5.0777; 11.154 90; 90; 90 | 1302.72 | Liu, Bo; Huang, Yumin; Lan, Jingbo; Song, Feijie; You, Jingsong Pd-catalyzed oxidative C–H/C–H cross-coupling of pyridines with heteroarenes Chemical Science, 2013, 4, 2163 |
| 1514714 | CIF | C10 H5 F N2 S | P 1 21/n 1 | 6.7553; 9.2885; 14.5501 90; 95.168; 90 | 909.26 | Liu, Bo; Huang, Yumin; Lan, Jingbo; Song, Feijie; You, Jingsong Pd-catalyzed oxidative C–H/C–H cross-coupling of pyridines with heteroarenes Chemical Science, 2013, 4, 2163 |
| 1514715 | CIF | C16 H12 N O2 S | P 1 | 6.0479; 8.1021; 14.5564 81.543; 83.748; 72.375 | 670.83 | Liu, Bo; Huang, Yumin; Lan, Jingbo; Song, Feijie; You, Jingsong Pd-catalyzed oxidative C‒H/C‒H cross-coupling of pyridines with heteroarenes Chemical Science, 2013, 4, 2163 |
| 1514716 | CIF | C13 H13 F3 N2 O4 S | P -1 | 6.2339; 8.9683; 14.0067 81.624; 89.228; 75.671 | 750.42 | Samanta, Ramesh C.; De Sarkar, Suman; Fröhlich, Roland; Grimme, Stefan; Studer, Armido N-Heterocyclic carbene (NHC) catalyzed chemoselective acylation of alcohols in the presence of amines with various acylating reagents Chemical Science, 2013, 4, 2177 |
| 1514717 | CIF | C15 H17 F3 N2 O4 S | P 1 21/c 1 | 9.6013; 7.0186; 25.4572 90; 92.806; 90 | 1713.44 | Samanta, Ramesh C.; De Sarkar, Suman; Fröhlich, Roland; Grimme, Stefan; Studer, Armido N-Heterocyclic carbene (NHC) catalyzed chemoselective acylation of alcohols in the presence of amines with various acylating reagents Chemical Science, 2013, 4, 2177 |
| 1514718 | CIF | C37 H49.95 Ga Mn N2 O2 | P 1 21/n 1 | 10.1814; 20.4882; 16.7346 90; 103.158; 90 | 3399.16 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514719 | CIF | C34 H41 Ga Mo N2 O5 | P 43 21 2 | 9.083; 9.083; 41.8928 90; 90; 90 | 3456.19 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514720 | CIF | C34 H41 Ga N2 O5 W | P b n m | 9.15777; 35.5896; 21.105 90; 90; 90 | 6878.57 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514721 | CIF | C36 H41 Co2 Ga N2 O7 | P -1 | 8.8239; 19.5134; 21.404 90.0148; 89.9906; 90.0029 | 3685.43 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514722 | CIF | C33 H42 Ga Mn N2 O4 | P 1 21/m 1 | 8.86; 21.5544; 9.0818 90; 108.601; 90 | 1643.77 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514723 | CIF | C33 H41 Cl Co Ga N2 O4 | C 1 2/c 1 | 21.4272; 16.8902; 21.5723 90; 108.729; 90 | 7393.79 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514724 | CIF | C37 H48 Ga Mn N2 O2 | P -1 | 8.8327; 18.3781; 20.6752 90.0077; 90.0065; 85.7423 | 3346.91 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514725 | CIF | C65 H53 B Co F24 Ga N2 O4 | P -1 | 12.5663; 13.2686; 20.7262 78.4857; 83.9447; 83.4912 | 3352.25 | Turner, Joshua; Abdalla, Joseph A. B.; Bates, Joshua I.; Tirfoin, Remi; Kelly, Michael J.; Phillips, Nicholas; Aldridge, Simon Formation of sub-valent carbenoid ligands by metal-mediated dehydrogenation chemistry: coordination and activation of H2Ga{(NDippCMe)2CH} Chemical Science, 2013, 4, 4245 |
| 1514726 | CIF | C16 H16 O4 S | P -1 | 10.8453; 12.173; 12.2364 109.364; 106.53; 98.626 | 1406.8 | Scheetz, Kolbe J.; Spaeth, Andrew D.; Vorushilov, Alexander S.; Powell, Douglas R.; Day, Victor W.; Barybin, Mikhail V. The 2,6-dimercaptoazulene motif: efficient synthesis and completely regioselective metallation of its 6-mercapto terminus Chemical Science, 2013, 4, 4267 |
| 1514727 | CIF | C16 H14 Cl2 O4 | P -1 | 3.9099; 13.413; 14.207 82.606; 86.888; 82.453 | 731.9 | Scheetz, Kolbe J.; Spaeth, Andrew D.; Vorushilov, Alexander S.; Powell, Douglas R.; Day, Victor W.; Barybin, Mikhail V. The 2,6-dimercaptoazulene motif: efficient synthesis and completely regioselective metallation of its 6-mercapto terminus Chemical Science, 2013, 4, 4267 |
| 1514728 | CIF | C34 H30 Au O4 P S2 | P c a 21 | 23.574; 11.1504; 23.342 90; 90; 90 | 6135.7 | Scheetz, Kolbe J.; Spaeth, Andrew D.; Vorushilov, Alexander S.; Powell, Douglas R.; Day, Victor W.; Barybin, Mikhail V. The 2,6-dimercaptoazulene motif: efficient synthesis and completely regioselective metallation of its 6-mercapto terminus Chemical Science, 2013, 4, 4267 |
| 1514729 | CIF | C15.5 H15 Cl3 N2 Pt S | P -1 | 9.6661; 13.0872; 15.6977 111.029; 90.575; 108.683 | 1738.24 | Rosen, Mari S.; Stern, Charlotte L.; Mirkin, Chad A. Heteroligated PtII Weak-Link Approach complexes using hemilabile N-heterocyclic carbene‒thioether and phosphino‒thioether ligands Chemical Science, 2013, 4, 4193 |
| 1514730 | CIF | C35 H33 B Cl F4 N2 P Pt S2 | P -1 | 9.4153; 12.0408; 16.6958 102.425; 100.136; 104.304 | 1737.82 | Rosen, Mari S.; Stern, Charlotte L.; Mirkin, Chad A. Heteroligated PtII Weak-Link Approach complexes using hemilabile N-heterocyclic carbene‒thioether and phosphino‒thioether ligands Chemical Science, 2013, 4, 4193 |
| 1514731 | CIF | C35 H33 B2 F8 N2 P Pt S2 | P 1 21/c 1 | 10.295; 9.8283; 34.0318 90; 94.67; 90 | 3431.99 | Rosen, Mari S.; Stern, Charlotte L.; Mirkin, Chad A. Heteroligated PtII Weak-Link Approach complexes using hemilabile N-heterocyclic carbene‒thioether and phosphino‒thioether ligands Chemical Science, 2013, 4, 4193 |
| 1514732 | CIF | C30 H42 N2 Si | P 1 21/a 1 | 15.1354; 9.24; 20.128 90; 101.781; 90 | 2755.63 | Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P. Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis Chemical Science, 2013, 4, 4212 |
| 1514733 | CIF | C38 H58 Mg N2 O2 Si | P -1 | 11.294; 12.168; 13.604 96.759; 90.61; 90.961 | 1856.13 | Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P. Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis Chemical Science, 2013, 4, 4212 |
| 1514734 | CIF | C44 H68 Mg N2 O3.5 Si | P 1 21/n 1 | 10.031; 30.017; 16.556 90; 104.903; 90 | 4817.34 | Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P. Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis Chemical Science, 2013, 4, 4212 |
| 1514735 | CIF | C49 H72 Ca N2 O3 Si | P 1 21/n 1 | 10.2642; 22.7621; 20.7835 90; 98.249; 90 | 4805.5 | Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P. Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis Chemical Science, 2013, 4, 4212 |
| 1514736 | CIF | C46 H71 N2 O4 Si Sr | P 1 21 1 | 10.37; 18.852; 12.632 90; 113.607; 90 | 2262.83 | Hill, Michael S.; Liptrot, David J.; MacDougall, Dugald J.; Mahon, Mary F.; Robinson, Thomas P. Hetero-dehydrocoupling of silanes and amines by heavier alkaline earth catalysis Chemical Science, 2013, 4, 4212 |
| 1514737 | CIF | C20 H18 F3 N3 O3 | C 1 2/c 1 | 27.371; 7.0453; 18.8951 90; 99.01; 90 | 3598.7 | Lee, Min Hee; Yoon, Byungkwon; Kim, Jong Seung; Sessler, Jonathan L. Naphthalimide trifluoroacetyl acetonate: a hydrazine-selective chemodosimetric sensor Chemical Science, 2013, 4, 4121 |
| 1514738 | CIF | C47 H77 N2 Na O3 Zn | P 21 21 21 | 11.948; 15.878; 24.9404 90; 90; 90 | 4731.5 | Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion Chemical Science, 2013, 4, 4259 |
| 1514739 | CIF | C35 H54 N2 Zn | P -1 | 9.7795; 10.1033; 20.1669 90.336; 103.989; 118.932 | 1674.4 | Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion Chemical Science, 2013, 4, 4259 |
| 1514740 | CIF | C71 H127 N2 Na O7 Zn2 | P 1 21/c 1 | 12.5177; 33.2445; 18.2146 90; 100.694; 90 | 7448.3 | Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion Chemical Science, 2013, 4, 4259 |
| 1514741 | CIF | C39 H63 Li N2 Zn | P b c a | 21.8628; 22.1892; 31.9347 90; 90; 90 | 15492.1 | Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion Chemical Science, 2013, 4, 4259 |
| 1514742 | CIF | C45 H50 Au2 Cl N2 P | P -1 | 9.2833; 14.4759; 16.9188 68.109; 81.38; 86.27 | 2085.74 | Armstrong, David R.; Baillie, Sharon E.; Blair, Victoria L.; Chabloz, Nicolas G.; Diez, Josefina; Garcia-Alvarez, Joaquin; Kennedy, Alan R.; Robertson, Stuart D.; Hevia, Eva Alkali-metal-mediated zincation (AMMZn) meets N-heterocyclic carbene (NHC) chemistry: Zn‒H exchange reactions and structural authentication of a dinuclear Au(i) complex with a NHC anion Chemical Science, 2013, 4, 4259 |
| 1514743 | CIF | C18 H12 Br F3 O2 | P 1 21 1 | 11.822; 47.948; 12.119 90; 104.545; 90 | 6649 | Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D. Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study Chemical Science, 2013, 4, 4146 |
| 1514744 | CIF | C22 H19 F3 O2 | P 1 21 1 | 6.039; 27.449; 11.299 90; 104.404; 90 | 1814 | Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D. Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study Chemical Science, 2013, 4, 4146 |
| 1514745 | CIF | C19 H20 N2 S | P 21 21 21 | 7.934; 10.719; 18.419 90; 90; 90 | 1566.4 | Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D. Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study Chemical Science, 2013, 4, 4146 |
| 1514746 | CIF | C18 H17 F3 O2 | C 1 2 1 | 19.358; 9.419; 8.186 90; 90.979; 90 | 1492.4 | Morrill, Louis C.; Douglas, James; Lebl, Tomas; Slawin, Alexandra M. Z.; Fox, David J.; Smith, Andrew D. Isothiourea-mediated asymmetric Michael-lactonisation of trifluoromethylenones: a synthetic and mechanistic study Chemical Science, 2013, 4, 4146 |
| 1514747 | CIF | C31 H32 Cl2 N2 O4 | P -1 | 8.3666; 10.8236; 17.2119 84.42; 79.713; 75.288 | 1481.1 | Ghorai, Suman; Sumrak, Joseph C.; Hutchins, Kristin M.; Bučar, Dejan-Krešimir; Tivanski, Alexei V.; MacGillivray, Leonard R. From co-crystals to functional thin films: photolithography using [2+2] photodimerization Chemical Science, 2013, 4, 4304 |
| 1514748 | CIF | C160 H178 Cd3 N14 O27 Ti4 | P 6 2 2 | 32.0273; 32.0273; 29.1427 90; 90; 120 | 25888.2 | Xuan, Weimin; Ye, Chengcheng; Zhang, Mengni; Chen, Zhijie; Cui, Yong A chiral porous metallosalan-organic framework containing titanium-oxo clusters for enantioselective catalytic sulfoxidation Chemical Science, 2013, 4, 3154 |
| 1514749 | CIF | C24 H16 B2 O3 | P 1 21/n 1 | 9.4797; 45.49; 21.7415 90; 92.764; 90 | 9364.7 | Dimitrijević, Elena; Taylor, Mark S. 9-Hetero-10-boraanthracene-derived borinic acid catalysts for regioselective activation of polyols Chemical Science, 2013, 4, 3298 |
| 1514750 | CIF | C26 H22 B2 N2 O | P b c a | 10.6981; 14.3379; 26.3743 90; 90; 90 | 4045.5 | Dimitrijević, Elena; Taylor, Mark S. 9-Hetero-10-boraanthracene-derived borinic acid catalysts for regioselective activation of polyols Chemical Science, 2013, 4, 3298 |
| 1514751 | CIF | C39 H41 F12 N7 O0 P2 | P 1 21/n 1 | 12.9199; 15.8918; 20.2181 90; 95.307; 90 | 4133.4 | Li, Yi; Liu, Gao-Feng; Tan, Cai-Ping; Ji, Liang-Nian; Mao, Zong-Wan Antitumor properties and mechanisms of mitochondria-targeted Ag(i) and Au(i) complexes containing N-heterocyclic carbenes derived from cyclophanes. Metallomics : integrated biometal science, 2014, 6, 1460-1468 |
| 1514752 | CIF | C47 H97 N O6 S Si9 | P -1 | 13.583; 15.995; 16.961 110.618; 111.892; 93.2 | 3125.1 | Brady, Patrick B.; Albert, Brian J.; Akakura, Matsujiro; Yamamoto, Hisashi Controlling stereochemistry in polyketide synthesis: 1,3- vs. 1,2-asymmetric induction in methyl ketone aldol additions to β-super siloxy aldehydes Chemical Science, 2013, 4, 3223 |
| 1514753 | CIF | C30 H34 Ag F6 N5 P | I b a m | 17.9559; 18.8882; 17.9394 90; 90; 90 | 6084.2 | Li, Yi; Liu, Gao-Feng; Tan, Cai-Ping; Ji, Liang-Nian; Mao, Zong-Wan Antitumor properties and mechanisms of mitochondria-targeted Ag(i) and Au(i) complexes containing N-heterocyclic carbenes derived from cyclophanes. Metallomics : integrated biometal science, 2014, 6, 1460-1468 |
| 1514754 | CIF | C79.5 H115.5 Co3 N8.5 O34.5 | P n m a | 17.564; 25.629; 20.8 90; 90; 90 | 9363 | Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters Chemical Science, 2013, 4, 3232 |
| 1514755 | CIF | C79.5 H109.5 Co3 N8.5 O31.5 | P n m a | 17.5608; 25.3474; 20.8804 90; 90; 90 | 9294.3 | Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters Chemical Science, 2013, 4, 3232 |
| 1514756 | CIF | C78 H106 Co3 N8 O31 | P n m a | 17.446; 27.758; 18.762 90; 90; 90 | 9086 | Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters Chemical Science, 2013, 4, 3232 |
| 1514757 | CIF | C122 H178 Co6 N14 O46 | I m -3 | 27.2496; 27.2496; 27.2496 90; 90; 90 | 20233.9 | Li, Jia; Huang, Peng; Wu, Xue-Ru; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun Metal-organic frameworks displaying single crystal-to-single crystal transformation through postsynthetic uptake of metal clusters Chemical Science, 2013, 4, 3232 |
| 1514758 | CIF | C30 H35 Au F6 N5 O0 P | I b a m | 18.7883; 17.8671; 18.1775 90; 90; 90 | 6102 | Li, Yi; Liu, Gao-Feng; Tan, Cai-Ping; Ji, Liang-Nian; Mao, Zong-Wan Antitumor properties and mechanisms of mitochondria-targeted Ag(i) and Au(i) complexes containing N-heterocyclic carbenes derived from cyclophanes. Metallomics : integrated biometal science, 2014, 6, 1460-1468 |
| 1514759 | CIF | C18 H18 I2 O2 | P 21 21 21 | 7.7537; 8.7833; 28.0793 90; 90; 90 | 1912.29 | Gómez-Bengoa, Enrique; García, Jesús M.; Jiménez, Sandra; Lapuerta, Irati; Mielgo, Antonia; Odriozola, José M.; Otazo, Itziar; Razkin, Jesús; Urruzuno, Iñaki; Vera, Silvia; Oiarbide, Mikel; Palomo, Claudio Asymmetric synthesis of propargylic alcohols via aldol reaction of aldehydes with ynals promoted by prolinol ether–transition metal–Brønsted acid cooperative catalysis Chemical Science, 2013, 4, 3198 |
| 1514760 | CIF | C28 H34 F12 N4 P2 | P 1 21/c 1 | 8.66; 19.8775; 11.7276 90; 130.999; 90 | 1523.62 | Li, Yi; Liu, Gao-Feng; Tan, Cai-Ping; Ji, Liang-Nian; Mao, Zong-Wan Antitumor properties and mechanisms of mitochondria-targeted Ag(i) and Au(i) complexes containing N-heterocyclic carbenes derived from cyclophanes. Metallomics : integrated biometal science, 2014, 6, 1460-1468 |
| 1514761 | CIF | C13 H14 O3 | P b c a | 10.2738; 11.207; 19.0373 90; 90; 90 | 2191.93 | Farmer, Rebecca L.; Scheidt, Karl A. A Concise Enantioselective Synthesis and Cytotoxic Evaluation of the Anticancer Rotenoid Deguelin Enabled by a Tandem Knoevenagel/Conjugate Addition/Decarboxylation Sequence. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3304-3309 |
| 1514762 | CIF | C95 H74 B Cl6 O4 P2 Rh | P 1 21/c 1 | 19.3718; 20.1092; 21.506 90; 93.7932; 90 | 8359.34 | Raskatov, Jevgenij A.; Thompson, Amber L.; Cowley, Andrew R.; Claridge, Timothy D. W.; Brown, John M. Chiral recognition in contact ion-pairs; observation, characterization and analysis Chemical Science, 2013, 4, 3140 |
| 1514763 | CIF | C98 H80 B Cl6 O5 P2 Rh | P 21 21 21 | 15.7224; 20.2138; 25.7426 90; 90; 90 | 8181.2 | Raskatov, Jevgenij A.; Thompson, Amber L.; Cowley, Andrew R.; Claridge, Timothy D. W.; Brown, John M. Chiral recognition in contact ion-pairs; observation, characterization and analysis Chemical Science, 2013, 4, 3140 |
| 1514764 | CIF | C96 H76 B Cl8 O4 P2 Rh | P 1 21 1 | 11.8286; 25.5279; 14.3047 90; 111.974; 90 | 4005.65 | Raskatov, Jevgenij A.; Thompson, Amber L.; Cowley, Andrew R.; Claridge, Timothy D. W.; Brown, John M. Chiral recognition in contact ion-pairs; observation, characterization and analysis Chemical Science, 2013, 4, 3140 |
| 1514765 | CIF | C200 H256 Si8 | P 1 2/n 1 | 16.179; 17.461; 32.012 90; 95.835; 90 | 8997 | Matsuno, Taisuke; Kamata, Sho; Hitosugi, Shunpei; Isobe, Hiroyuki Bottom-up synthesis and structures of π-lengthened tubular macrocycles Chemical Science, 2013, 4, 3179 |
| 1514766 | CIF | C58 H78 Br6 Dy N9 O14 Zn2 | P b c a | 22.0395; 16.0165; 39.3819 90; 90; 90 | 13901.6 | Liu, Jun-Liang; Chen, Yan-Cong; Zheng, Yan-Zhen; Lin, Wei-Quan; Ungur, Liviu; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Tong, Ming-Liang Switching the anisotropy barrier of a single-ion magnet by symmetry change from quasi-D5h to quasi-Oh Chemical Science, 2013, 4, 3310 |
| 1514767 | CIF | C54 H62 Br6 Dy N9 O10 Zn2 | P b c a | 20.5186; 16.4699; 37.585 90; 90; 90 | 12701.4 | Liu, Jun-Liang; Chen, Yan-Cong; Zheng, Yan-Zhen; Lin, Wei-Quan; Ungur, Liviu; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Tong, Ming-Liang Switching the anisotropy barrier of a single-ion magnet by symmetry change from quasi-D5h to quasi-Oh Chemical Science, 2013, 4, 3310 |
| 1514768 | CIF | C58 H78 Br6 Dy N9 O14 Zn2 | P b c a | 21.893; 15.9613; 39.306 90; 90; 90 | 13735.1 | Liu, Jun-Liang; Chen, Yan-Cong; Zheng, Yan-Zhen; Lin, Wei-Quan; Ungur, Liviu; Wernsdorfer, Wolfgang; Chibotaru, Liviu F.; Tong, Ming-Liang Switching the anisotropy barrier of a single-ion magnet by symmetry change from quasi-D5h to quasi-Oh Chemical Science, 2013, 4, 3310 |
| 1514769 | CIF | C67 H101 Ag2 F3 N4 O6 S | P -1 | 10.5882; 16.8592; 20.8 74.883; 79.955; 76.103 | 3454.7 | Tate, Brandon K.; Wyss, Chelsea M.; Bacsa, John; Kluge, Kelly; Gelbaum, Leslie; Sadighi, Joseph P. A dinuclear silver hydride and an umpolung reaction of CO2 Chemical Science, 2013, 4, 3068 |
| 1514770 | CIF | C63 H93 Ag2 F3 N4 O5 S | P 1 21/n 1 | 14.8245; 23.508; 19.9054 90; 110.118; 90 | 6513.7 | Tate, Brandon K.; Wyss, Chelsea M.; Bacsa, John; Kluge, Kelly; Gelbaum, Leslie; Sadighi, Joseph P. A dinuclear silver hydride and an umpolung reaction of CO2 Chemical Science, 2013, 4, 3068 |
| 1514771 | CIF | C44 H38 F6 N4 O8 S2 | P -1 | 11.445; 12.104; 17.978 77.35; 76.4; 65.63 | 2184 | Wang, Kai; Huang, Shuo; Zhang, Yu; Zhao, Shanshan; Zhang, Hongyu; Wang, Yue Multicolor fluorescence and electroluminescence of an ICT-type organic solid tuned by modulating the accepting nature of the central core Chemical Science, 2013, 4, 3288 |
| 1514772 | CIF | C40 H28 N4 S2 | P 1 21/c 1 | 9.6569; 10.14; 18.898 90; 118.42; 90 | 1627.5 | Wang, Kai; Huang, Shuo; Zhang, Yu; Zhao, Shanshan; Zhang, Hongyu; Wang, Yue Multicolor fluorescence and electroluminescence of an ICT-type organic solid tuned by modulating the accepting nature of the central core Chemical Science, 2013, 4, 3288 |
| 1514773 | CIF | C24 H14 | P 1 21/c 1 | 11.6522; 5.4552; 11.4821 90; 90.607; 90 | 729.82 | Shan, Liang; Liang, Zhixiong; Xu, Xiaomin; Tang, Qin; Miao, Qian Revisiting zethrene: synthesis, reactivity and semiconductor properties Chemical Science, 2013, 4, 3294 |
| 1514774 | CIF | C216 H289 Cl2 Gd36 N51 O193 | P -1 | 21.545; 23.046; 23.372 94.535; 115.193; 115.679 | 8956 | Wu, Mingyan; Jiang, Feilong; Kong, Xiangjian; Yuan, Daqiang; Long, Lasheng; Al-Thabaiti, Shaeel A.; Hong, Maochun Two polymeric 36-metal pure lanthanide nanosize clusters Chemical Science, 2013, 4, 3104 |
| 1514775 | CIF | C216 H289 Cl2 Dy36 N51 O193 | P -1 | 21.545; 22.886; 23.17 94.32; 115.373; 115.639 | 8817 | Wu, Mingyan; Jiang, Feilong; Kong, Xiangjian; Yuan, Daqiang; Long, Lasheng; Al-Thabaiti, Shaeel A.; Hong, Maochun Two polymeric 36-metal pure lanthanide nanosize clusters Chemical Science, 2013, 4, 3104 |
| 1514776 | CIF | C38 H42 Cl2 N4 O7 S Si | P 21 21 21 | 9.7839; 16.5231; 24.2524 90; 90; 90 | 3920.7 | Coste, Alexis; Kim, Justin; Adams, Timothy C.; Movassaghi, Mohammad Concise Total Synthesis of (+)-Bionectins A and C. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3191-3197 |
| 1514777 | CIF | C32.33 H36.66 Cl0.66 N4 O10 S Si | P 1 | 13.7346; 16.0038; 17.3585 100.01; 92.214; 108.59 | 3543.2 | Coste, Alexis; Kim, Justin; Adams, Timothy C.; Movassaghi, Mohammad Concise Total Synthesis of (+)-Bionectins A and C. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3191-3197 |
| 1514778 | CIF | C45 H50 N4 O14 S | P 1 21 1 | 12.8803; 10.3954; 16.5478 90; 90.063; 90 | 2215.7 | Coste, Alexis; Kim, Justin; Adams, Timothy C.; Movassaghi, Mohammad Concise Total Synthesis of (+)-Bionectins A and C. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3191-3197 |
| 1514779 | CIF | C29 H21 N5 O6 S2 | P 1 21 1 | 11.6928; 11.2669; 20.6483 90; 96.676; 90 | 2701.8 | Coste, Alexis; Kim, Justin; Adams, Timothy C.; Movassaghi, Mohammad Concise Total Synthesis of (+)-Bionectins A and C. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 3191-3197 |
| 1514780 | CIF | C28 H32 F9 La N9 O10 P S4 | P 1 21/n 1 | 11.106; 16.93; 22 90; 91.61; 90 | 4134.9 | Löble, Matthias W.; Oña-Burgos, Pascual; Fernández, Ignacio; Apostolidis, Christos; Morgenstern, Alfred; Walter, Olaf; Bruchertseifer, Frank; Kaden, Peter; Vitova, Tonya; Rothe, Jörg; Dardenne, Kathy; Banik, Nidhu L.; Geist, Andreas; Denecke, Melissa A.; Breher, Frank Exploring the solution behavior of f-element coordination compounds: a case study on some trivalent rare earth and plutonium complexes Chemical Science, 2013, 4, 3717 |
| 1514781 | CIF | C54 H61 F18 N19 O19 P2 S8 Sm2 | P 1 21/c 1 | 9.764; 19.857; 22.899 90; 97.37; 90 | 4403.1 | Löble, Matthias W.; Oña-Burgos, Pascual; Fernández, Ignacio; Apostolidis, Christos; Morgenstern, Alfred; Walter, Olaf; Bruchertseifer, Frank; Kaden, Peter; Vitova, Tonya; Rothe, Jörg; Dardenne, Kathy; Banik, Nidhu L.; Geist, Andreas; Denecke, Melissa A.; Breher, Frank Exploring the solution behavior of f-element coordination compounds: a case study on some trivalent rare earth and plutonium complexes Chemical Science, 2013, 4, 3717 |
| 1514782 | CIF | C30 H33 F9 N12 O9 P Pu S4 | P -1 | 13.2866; 13.3751; 13.849 83.93; 70.156; 80.123 | 2277.65 | Löble, Matthias W.; Oña-Burgos, Pascual; Fernández, Ignacio; Apostolidis, Christos; Morgenstern, Alfred; Walter, Olaf; Bruchertseifer, Frank; Kaden, Peter; Vitova, Tonya; Rothe, Jörg; Dardenne, Kathy; Banik, Nidhu L.; Geist, Andreas; Denecke, Melissa A.; Breher, Frank Exploring the solution behavior of f-element coordination compounds: a case study on some trivalent rare earth and plutonium complexes Chemical Science, 2013, 4, 3717 |
| 1514783 | CIF | C17 H20 N4 Ni | P 1 21/c 1 | 14.9461; 7.3243; 15.6793 90; 112.463; 90 | 1586.18 | Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B. Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii) Chemical Science, 2013, 4, 3636 |
| 1514784 | CIF | C36 H40 F6 N8 Ni2 O6 S2 | P -1 | 10.076; 10.6657; 19.6623 90.05; 97.94; 105.384 | 2016.3 | Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B. Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii) Chemical Science, 2013, 4, 3636 |
| 1514785 | CIF | C25 H36 K N4 Ni O2 | P 1 21/n 1 | 10.5982; 12.3634; 19.8165 90; 95.155; 90 | 2586 | Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B. Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii) Chemical Science, 2013, 4, 3636 |
| 1514786 | CIF | C23 H29 F12 N7 Ni P2 | C 1 c 1 | 9.223; 23.7522; 15.2139 90; 107.35; 90 | 3181.2 | Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B. Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii) Chemical Science, 2013, 4, 3636 |
| 1514787 | CIF | C35 H56 K N6 Ni O6 | P 1 21/c 1 | 12.7277; 21; 28.837 90; 99.126; 90 | 7610 | Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B. Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii) Chemical Science, 2013, 4, 3636 |
| 1514788 | CIF | C70 H106 K2 N12 Ni O12 | C 1 2/c 1 | 34.46; 10.852; 23.144 90; 100.903; 90 | 8499 | Williams, Valerie A.; Hulley, Elliott B.; Wolczanski, Peter T.; Lancaster, Kyle M.; Lobkovsky, Emil B. Exploring the limits of redox non-innocence: pseudo square planar [{κ4-Me2C(CH2NCHpy)2}Ni]n (n = 2+, 1+, 0, −1, −2) favor Ni(ii) Chemical Science, 2013, 4, 3636 |
| 1514789 | CIF | C31 H22 N2 | P b c a | 9.7242; 17.6641; 25.6425 90; 90; 90 | 4404.59 | Yang, Zhiyong; Qin, Wei; Lam, Jacky W. Y.; Chen, Sijie; Sung, Herman H. Y.; Williams, Ian D.; Tang, Ben Zhong Fluorescent pH sensor constructed from a heteroatom-containing luminogen with tunable AIE and ICT characteristics Chemical Science, 2013, 4, 3725 |
| 1514790 | CIF | C17 H15 N O | P 1 21/c 1 | 9.1485; 13.8946; 10.4647 90; 102.948; 90 | 1296.4 | Cui, Sunliang; Zhang, Yan; Wu, Qifan Rh(iii)-catalyzed C–H activation/cycloaddition of benzamides and methylenecyclopropanes: divergence in ring formation Chemical Science, 2013, 4, 3421 |
| 1514791 | CIF | C19.5 H18.5 Cl2.5 N O | P 1 21/c 1 | 23.247; 9.9836; 16.0069 90; 90.649; 90 | 3714.8 | Cui, Sunliang; Zhang, Yan; Wu, Qifan Rh(iii)-catalyzed C–H activation/cycloaddition of benzamides and methylenecyclopropanes: divergence in ring formation Chemical Science, 2013, 4, 3421 |
| 1514792 | CIF | C16 H14 Cl3 N O2 | P b c a | 9.7761; 14.7382; 24.0669 90; 90; 90 | 3467.6 | Cui, Sunliang; Zhang, Yan; Wu, Qifan Rh(iii)-catalyzed C–H activation/cycloaddition of benzamides and methylenecyclopropanes: divergence in ring formation Chemical Science, 2013, 4, 3421 |
| 1514793 | CIF | C17 H15 N O2 | P 21 21 21 | 6.4122; 12.077; 16.676 90; 90; 90 | 1291.4 | Ozaki, Kyohei; Zhang, Hua; Ito, Hideto; Lei, Aiwen; Itami, Kenichiro One-shot indole-to-carbazole π-extension by a Pd–Cu–Ag trimetallic system Chemical Science, 2013, 4, 3416 |
| 1514794 | CIF | C24.5 H28.5 Cl1.5 N4 O6 Ru | P 1 21/c 1 | 8.906; 17.7086; 17.021 90; 91.073; 90 | 2684 | Renfrew, Anna K.; Bryce, Nicole S.; Hambley, Trevor W. Delivery and release of curcumin by a hypoxia-activated cobalt chaperone: a XANES and FLIM study Chemical Science, 2013, 4, 3731 |
| 1514795 | CIF | C34 H31 Cl3 N4 O6 Ru | C 1 2/c 1 | 23.297; 12.4626; 25.803 90; 115.977; 90 | 6734.8 | Renfrew, Anna K.; Bryce, Nicole S.; Hambley, Trevor W. Delivery and release of curcumin by a hypoxia-activated cobalt chaperone: a XANES and FLIM study Chemical Science, 2013, 4, 3731 |
| 1514796 | CIF | C66 H58 Cl4 Co2 N8 O21 | P -1 | 9.1898; 11.3905; 16.2931 78.018; 82.142; 76.846 | 1617.39 | Renfrew, Anna K.; Bryce, Nicole S.; Hambley, Trevor W. Delivery and release of curcumin by a hypoxia-activated cobalt chaperone: a XANES and FLIM study Chemical Science, 2013, 4, 3731 |
| 1514797 | CIF | C14 H17 Br N2 O4 S | P 21 21 21 | 7.6678; 13.5683; 14.958 90; 90; 90 | 1556.2 | Miles, Dillon H.; Veguillas, Marcos; Toste, F. Dean Gold(i)-catalyzed enantioselective bromocyclization reactions of allenes Chemical Science, 2013, 4, 3427 |
| 1514798 | CIF | C21 H18 Cu N5 O4 | P 1 21/c 1 | 9.876; 9.295; 22.594 90; 106.8; 90 | 1985.5 | Chen, Yong-Qiang; Li, Guo-Rong; Chang, Ze; Qu, Yang-Kun; Zhang, Ying-Hui; Bu, Xian-He A Cu(i) metal‒organic framework with 4-fold helical channels for sensing anions Chemical Science, 2013, 4, 3678 |
| 1514799 | CIF | C20 H16 Cu N5 O4 | P 1 21/c 1 | 9.399; 9.848; 21.834 90; 102.09; 90 | 1976.2 | Chen, Yong-Qiang; Li, Guo-Rong; Chang, Ze; Qu, Yang-Kun; Zhang, Ying-Hui; Bu, Xian-He A Cu(i) metal‒organic framework with 4-fold helical channels for sensing anions Chemical Science, 2013, 4, 3678 |
| 1514800 | CIF | C21 H18 Cu N5 O4 | P 1 21/c 1 | 9.93; 9.3445; 22.717 90; 106.94; 90 | 2016.5 | Chen, Yong-Qiang; Li, Guo-Rong; Chang, Ze; Qu, Yang-Kun; Zhang, Ying-Hui; Bu, Xian-He A Cu(i) metal‒organic framework with 4-fold helical channels for sensing anions Chemical Science, 2013, 4, 3678 |
| 1514801 | CIF | C24 H28 Cl3 N O6 Pd S | P 1 21 1 | 9.3736; 15.178; 10.1053 90; 107.302; 90 | 1372.7 | Yamaguchi, Kazuya; Kondo, Hiroki; Yamaguchi, Junichiro; Itami, Kenichiro Aromatic C‒H coupling with hindered arylboronic acids by Pd/Fe dual catalysts Chemical Science, 2013, 4, 3753 |
| 1514802 | CIF | C45 H51 N3 P3 V | P -1 | 10.0198; 11.1462; 19.6789 85.018; 79.607; 74.258 | 2078.99 | Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M. Vanadium–iron complexes featuring metal–metal multiple bonds Chemical Science, 2013, 4, 3557 |
| 1514803 | CIF | C48 H57 Fe I N3 O0.75 P3 V | P -1 | 10.7003; 22.3479; 22.519 62.001; 81.313; 88.637 | 4693.3 | Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M. Vanadium‒iron complexes featuring metal‒metal multiple bonds Chemical Science, 2013, 4, 3557 |
| 1514804 | CIF | C48 H60 Fe N3 P4 V | P -3 c 1 | 16.3841; 16.3841; 22.8729 90; 90; 120 | 5317.4 | Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M. Vanadium–iron complexes featuring metal–metal multiple bonds Chemical Science, 2013, 4, 3557 |
| 1514805 | CIF | C60 H69 Fe N4 P4 V | P 1 21/c 1 | 13.0944; 14.5742; 28.469 90; 95.9356; 90 | 5403.9 | Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M. Vanadium–iron complexes featuring metal–metal multiple bonds Chemical Science, 2013, 4, 3557 |
| 1514806 | CIF | C48 H57 F Fe I N3 O0.75 P3 V | P -1 | 10.7611; 22.0867; 22.4678 63.268; 80.585; 85.642 | 4705.1 | Kuppuswamy, Subramaniam; Powers, Tamara M.; Krogman, Jeremy P.; Bezpalko, Mark W.; Foxman, Bruce M.; Thomas, Christine M. Vanadium‒iron complexes featuring metal‒metal multiple bonds Chemical Science, 2013, 4, 3557 |
| 1514807 | CIF | C10 H20 Cl2 N4 Ni | P 1 21/n 1 | 8.0672; 13.6398; 12.88 90; 100.756; 90 | 1392.4 | Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker (NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform Chemical Science, 2013, 4, 77 |
| 1514808 | CIF | C6 H13 Cl2 N2 P | P b c a | 7.768; 12.985; 19.423 90; 90; 90 | 1959.1 | Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker (NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform Chemical Science, 2013, 4, 77 |
| 1514809 | CIF | C11 H15 Cl2 N2 P | C 1 2/c 1 | 19.24; 11.531; 15.038 90; 128.66; 90 | 2605.2 | Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker (NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform Chemical Science, 2013, 4, 77 |
| 1514810 | CIF | C5 H10 Cl3 N2 P | P 1 21/c 1 | 11.4381; 7.717; 12.979 90; 122.697; 90 | 964.09 | Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker (NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform Chemical Science, 2013, 4, 77 |
| 1514811 | CIF | C10 H20 Cl2 N4 Pd | P 1 21/n 1 | 8.9858; 12.0174; 13.4315 90; 104.706; 90 | 1402.9 | Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker (NHCMe)SiCl4: a versatile carbene transfer reagent ‒ synthesis from silicochloroform Chemical Science, 2013, 4, 77 |
| 1514812 | CIF | C5 H11 F4 N2 P | P -1 | 7.375; 7.56; 8.6846 74.688; 76.04; 62.6 | 410.6 | Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker (NHCMe)SiCl4: a versatile carbene transfer reagent – synthesis from silicochloroform Chemical Science, 2013, 4, 77 |
| 1514813 | CIF | C5 H10 Cl4 N2 Si | P b c a | 12.8424; 12.65; 13.2356 90; 90; 90 | 2150.21 | Böttcher, Tobias; Bassil, Bassem S.; Zhechkov, Lyuben; Heine, Thomas; Röschenthaler, Gerd-Volker (NHCMe)SiCl4: a versatile carbene transfer reagent – synthesis from silicochloroform Chemical Science, 2013, 4, 77 |
| 1514814 | CIF | C26 H18 Fe | P -1 | 7.1257; 9.7812; 14.6087 74.587; 81.231; 70.49 | 922.94 | Gietter, Amber A. S.; Pupillo, Rachel C.; Yap, Glenn P. A.; Beebe, Thomas P.; Rosenthal, Joel; Watson, Donald A. On-surface cross-coupling methods for the construction of modified electrode assemblies with tailored morphologies Chemical Science, 2013, 4, 437 |
| 1514815 | CIF | C25 H21 Fe N3 | P 1 21 1 | 11.3194; 5.7682; 14.8959 90; 94.364; 90 | 969.77 | Gietter, Amber A. S.; Pupillo, Rachel C.; Yap, Glenn P. A.; Beebe, Thomas P.; Rosenthal, Joel; Watson, Donald A. On-surface cross-coupling methods for the construction of modified electrode assemblies with tailored morphologies Chemical Science, 2013, 4, 437 |
| 1514816 | CIF | C24 H18 Fe | P 1 21/c 1 | 21.166; 9.936; 8.1878 90; 92.968; 90 | 1719.6 | Gietter, Amber A. S.; Pupillo, Rachel C.; Yap, Glenn P. A.; Beebe, Thomas P.; Rosenthal, Joel; Watson, Donald A. On-surface cross-coupling methods for the construction of modified electrode assemblies with tailored morphologies Chemical Science, 2013, 4, 437 |
| 1514817 | CIF | C18 H12 O2 | C 1 c 1 | 20.7703; 20.6316; 23.952 90; 102.233; 90 | 10031 | Cheng, Ming; Yan, Jianwei; Hu, Feng; Chen, Hong; Hu, Youhong Palladium-catalyzed cascade reactions of 3-iodochromones with aryl iodides and norbornadiene leading to annulated xanthones Chemical Science, 2013, 4, 526 |
| 1514818 | CIF | C10 H17 Cl N4 Ni O6 | P 1 21/n 1 | 7.3309; 16.9368; 12.1796 90; 95.441; 90 | 1505.43 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514819 | CIF | C22 H40 Cl2 N8.5 Ni O10 Zn | P 1 21/n 1 | 11.5005; 20.8961; 14.2514 90; 109.637; 90 | 3225.65 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514820 | CIF | C22 H42 Cl2 N8 Ni O10 Zn | P 1 21/n 1 | 11.5533; 22.0368; 12.9726 90; 104.81; 90 | 3193.1 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514821 | CIF | C21 H40 Cl N7 Ni O8 Zn | C 1 2/c 1 | 18.853; 18.337; 16.409 90; 90.05; 90 | 5673 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514822 | CIF | C19 H37 Cl N8 Ni O8 Zn | P 1 | 8.5274; 12.4106; 13.0776 98.754; 96.004; 90.074 | 1360.17 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514823 | CIF | C110 H150 B2 Cl2 N18 Ni2 O16 Zn2 | P -1 | 11.7327; 15.5512; 17.9328 67.784; 71.146; 77.96 | 2852.6 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514824 | CIF | C61 H89 B N7 Ni O6.5 Zn | P -1 | 11.9784; 19.7901; 26.294 104.912; 91.396; 98.3 | 5947.7 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514825 | CIF | C77 H100 B N7 Ni O6 P Zn | P 1 21/c 1 | 21.7065; 13.6234; 24.045 90; 90.533; 90 | 7110.2 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514826 | CIF | C55 H74 B N7 Ni O5 Zn | P 1 21/c 1 | 17.2117; 12.9449; 24.7109 90; 101.43; 90 | 5396.5 | Uyeda, Christopher; Peters, Jonas C. Access to formally Ni(i) states in a heterobimetallic NiZn system Chemical Science, 2013, 4, 157 |
| 1514827 | CIF | C57 H72 N14 O15 | P -1 | 14.1445; 14.338; 16.719 86.271; 81.687; 61.358 | 2944.5 | Moore, Stephen J.; Haynes, Cally J. E.; González, Jorge; Sutton, Jennifer L.; Brooks, Simon J.; Light, Mark E.; Herniman, Julie; Langley, G. John; Soto-Cerrato, Vanessa; Pérez-Tomás, Ricardo; Marques, Igor; Costa, Paulo J.; Félix, Vítor; Gale, Philip A. Chloride, carboxylate and carbonate transport by ortho-phenylenediamine-based bisureas Chemical Science, 2013, 4, 103 |
| 1514828 | CIF | C38 H33 Co F9 N8 O6 S2 | C 1 2/c 1 | 23.898; 15.593; 23.95 90; 109.468; 90 | 8414.5 | Sun, Yujie; Sun, Jianwei; Long, Jeffrey R.; Yang, Peidong; Chang, Christopher J. Photocatalytic generation of hydrogen from water using a cobalt pentapyridine complex in combination with molecular and semiconductor nanowire photosensitizers Chemical Science, 2013, 4, 118 |
| 1514829 | CIF | C63 H65 Au2 Cl2 F6 N O10 P2 S2 | P -1 | 12.9063; 14.0711; 20.7385 101.178; 99.806; 113.143 | 3268.15 | Weber, Dieter; Gagné, Michel R σ-π-Diauration as an alternative binding mode for digold intermediates in gold(i) catalysis. Chemical science (Royal Society of Chemistry : 2010), 2013, 47, 335-338 |
| 1514830 | CIF | C20 H18 Fe O4 Si | P 1 21 1 | 7.151; 29.386; 9.6851 90; 100.773; 90 | 1999.4 | Williams, David R.; Shah, Akshay A.; Mazumder, Shivnath; Baik, Mu-Hyun Studies of iron-mediated Pauson‒Khand reactions of 1,1-disubstituted-allenylsilanes: mechanistic implications for a reactive three-membered iron metallacycle Chemical Science, 2013, 4, 238 |
| 1514831 | CIF | C25 H38 O2 Si2 | P 1 21/n 1 | 12.129; 8.192; 26.318 90; 102.587; 90 | 2552.1 | Williams, David R.; Shah, Akshay A.; Mazumder, Shivnath; Baik, Mu-Hyun Studies of iron-mediated Pauson–Khand reactions of 1,1-disubstituted-allenylsilanes: mechanistic implications for a reactive three-membered iron metallacycle Chemical Science, 2013, 4, 238 |
| 1514832 | CIF | C30 H52 Fe N2 Si2 | P -1 | 8.8101; 9.1759; 11.1624 102.467; 92.503; 113.932 | 796.59 | Zadrozny, Joseph M.; Atanasov, Mihail; Bryan, Aimee M.; Lin, Chun-Yi; Rekken, Brian D.; Power, Philip P.; Neese, Frank; Long, Jeffrey R. Slow magnetization dynamics in a series of two-coordinate iron(ii) complexes Chemical Science, 2013, 4, 125 |
| 1514833 | CIF | C60 H76 Fe0.93 N2 | P 1 21/n 1 | 10.8937; 20.234; 11.2231 90; 90.829; 90 | 2473.6 | Zadrozny, Joseph M.; Atanasov, Mihail; Bryan, Aimee M.; Lin, Chun-Yi; Rekken, Brian D.; Power, Philip P.; Neese, Frank; Long, Jeffrey R. Slow magnetization dynamics in a series of two-coordinate iron(ii) complexes Chemical Science, 2013, 4, 125 |
| 1514834 | CIF | C18.87 H19.16 N2 O2 Zn | I b c a | 13.9562; 23.5904; 23.5858 90; 90; 90 | 7765.2 | He, Chun-Ting; Tian, Jing-Yu; Liu, Si-Yang; Ouyang, Gangfeng; Zhang, Jie-Peng; Chen, Xiao-Ming A porous coordination framework for highly sensitive and selective solid-phase microextraction of non-polar volatile organic compounds Chemical Science, 2013, 4, 351 |
| 1514835 | CIF | C12 H10 N2 O2 Zn | I b c a | 13.9249; 23.653; 23.637 90; 90; 90 | 7785.2 | He, Chun-Ting; Tian, Jing-Yu; Liu, Si-Yang; Ouyang, Gangfeng; Zhang, Jie-Peng; Chen, Xiao-Ming A porous coordination framework for highly sensitive and selective solid-phase microextraction of non-polar volatile organic compounds Chemical Science, 2013, 4, 351 |
| 1514836 | CIF | C58 H60 Au2 I2 O2 P4 | P -1 | 11.83; 11.9725; 12.3591 65.098; 69.838; 65.309 | 1411.99 | Lim, Sang Ho; Olmstead, Marilyn M.; Balch, Alan L. Inorganic topochemistry. Vapor-induced solid state transformations of luminescent, three-coordinate gold(i) complexes Chemical Science, 2013, 4, 311 |
| 1514837 | CIF | C51 H62 N3 Ni | P 1 21/n 1 | 12.2859; 20.3988; 17.3454 90; 99.232; 90 | 4290.8 | Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L. Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation Chemical Science, 2013, 4, 170 |
| 1514838 | CIF | C59 H78 Cl4 N3 Ni | P 1 21/c 1 | 21.2763; 10.7269; 24.4104 90; 97.053; 90 | 5529 | Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L. Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation Chemical Science, 2013, 4, 170 |
| 1514839 | CIF | C87 H84 B F24 N3 Ni O | P 1 21/n 1 | 12.9077; 34.624; 19.65 90; 107.756; 90 | 8363.6 | Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L. Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation Chemical Science, 2013, 4, 170 |
| 1514840 | CIF | C197 H204 B2 F48 N6 Ni2 O4 | P -1 | 14.7621; 16.7885; 21.465 102.291; 106.901; 105.812 | 4644.3 | Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L. Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation Chemical Science, 2013, 4, 170 |
| 1514841 | CIF | C93 H96 B F24 N3 Ni O | P 1 21/c 1 | 12.7476; 20.1891; 33.921 90; 90.696; 90 | 8729.4 | Laskowski, C. A.; Morello, G. R.; Saouma, C. T.; Cundari, T. R.; Hillhouse, G. L. Single-electron oxidation of N-heterocyclic carbene-supported nickel amides yielding benzylic C‒H activation Chemical Science, 2013, 4, 170 |
| 1514842 | CIF | C30 H27 B F15 O2 P S | P 1 21/c 1 | 9.4942; 29.0008; 11.5368 90; 90.018; 90 | 3176.5 | Sajid, Muhammad; Klose, Annika; Birkmann, Birgit; Liang, Liyuan; Schirmer, Birgitta; Wiegand, Thomas; Eckert, Hellmut; Lough, Alan J.; Fröhlich, Roland; Daniliuc, Constantin G.; Grimme, Stefan; Stephan, Douglas W.; Kehr, Gerald; Erker, Gerhard Reactions of phosphorus/boron frustrated Lewis pairs with SO2 Chemical Science, 2013, 4, 213 |
| 1514843 | CIF | C33 H28 B F10 O2 P S | P -1 | 13.2898; 13.3521; 22.579 73.392; 73.073; 83.328 | 3670.7 | Sajid, Muhammad; Klose, Annika; Birkmann, Birgit; Liang, Liyuan; Schirmer, Birgitta; Wiegand, Thomas; Eckert, Hellmut; Lough, Alan J.; Fröhlich, Roland; Daniliuc, Constantin G.; Grimme, Stefan; Stephan, Douglas W.; Kehr, Gerald; Erker, Gerhard Reactions of phosphorus/boron frustrated Lewis pairs with SO2 Chemical Science, 2013, 4, 213 |
| 1514844 | CIF | C36 H32 B F10 O2 P S | P -1 | 10.5993; 11.865; 14.4165 92.7; 95.322; 111.03 | 1678.66 | Sajid, Muhammad; Klose, Annika; Birkmann, Birgit; Liang, Liyuan; Schirmer, Birgitta; Wiegand, Thomas; Eckert, Hellmut; Lough, Alan J.; Fröhlich, Roland; Daniliuc, Constantin G.; Grimme, Stefan; Stephan, Douglas W.; Kehr, Gerald; Erker, Gerhard Reactions of phosphorus/boron frustrated Lewis pairs with SO2 Chemical Science, 2013, 4, 213 |
| 1514845 | CIF | C76 H162 Cu6 N12 O88.66 V30 | P 31 2 1 | 20.411; 20.411; 40.34 90; 90; 120 | 14554 | Forster, Johannes; Rösner, Benedikt; Fink, Rainer H.; Nye, Leanne C.; Ivanovic-Burmazovic, Ivana; Kastner, Katharina; Tucher, Johannes; Streb, Carsten Oxidation-driven self-assembly gives access to high-nuclearity molecular copper vanadium oxide clusters Chemical Science, 2013, 4, 418 |
| 1514846 | CIF | C10 H30 N2 O12 S5 V | P -1 | 9.4145; 11.119; 13.183 67.27; 77.71; 89.25 | 1240 | Forster, Johannes; Rösner, Benedikt; Fink, Rainer H.; Nye, Leanne C.; Ivanovic-Burmazovic, Ivana; Kastner, Katharina; Tucher, Johannes; Streb, Carsten Oxidation-driven self-assembly gives access to high-nuclearity molecular copper vanadium oxide clusters Chemical Science, 2013, 4, 418 |
| 1514847 | CIF | C31 H33 N3 O7 S | C 1 2/c 1 | 26.759; 8.5937; 24.464 90; 92.096; 90 | 5621.9 | Moore, Jared T.; Soldi, Cristian; Fettinger, James C.; Shaw, Jared T. Catalytic Alkene Cyclization Reactions for the Stereoselective Synthesis of Complex "Terpenoid-like" Heterocycles. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 292-296 |
| 1514848 | CIF | C31 H27 N3 O8 S | P -1 | 7.9323; 12.8416; 28.201 96.6629; 90.955; 94.4154 | 2843.8 | Moore, Jared T.; Soldi, Cristian; Fettinger, James C.; Shaw, Jared T. Catalytic Alkene Cyclization Reactions for the Stereoselective Synthesis of Complex "Terpenoid-like" Heterocycles. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 292-296 |
| 1514849 | CIF | C24.5 H33 Cl N4 O8 Pd2 S2 | P 21 21 21 | 8.4525; 15.486; 46.184 90; 90; 90 | 6045.3 | Rodríguez, Nuria; Romero-Revilla, Jose A.; Fernández-Ibáñez, M. Ángeles; Carretero, Juan C. Palladium-catalyzed N-(2-pyridyl)sulfonyl-directed C(sp3)‒H γ-arylation of amino acid derivatives Chemical Science, 2013, 4, 175 |
| 1514850 | CIF | C19 H24 N2 O6 S | P 21 21 21 | 9.8306; 17.0929; 24.3215 90; 90; 90 | 4086.8 | Rodríguez, Nuria; Romero-Revilla, Jose A.; Fernández-Ibáñez, M. Ángeles; Carretero, Juan C. Palladium-catalyzed N-(2-pyridyl)sulfonyl-directed C(sp3)–H γ-arylation of amino acid derivatives Chemical Science, 2013, 4, 175 |
| 1514851 | CIF | C106 H115 Cl N8 O11 | P -1 | 13.258; 20.3837; 26.4826 85.599; 81.344; 81.232 | 6982 | Allain, Clémence; Beer, Paul D.; Faulkner, Stephen; Jones, Michael W.; Kenwright, Alan M.; Kilah, Nathan L.; Knighton, Richard C.; Sørensen, Thomas Just; Tropiano, Manuel Lanthanide appended rotaxanes respond to changing chloride concentration Chemical Science, 2013, 4, 489 |
| 1514852 | CIF | C70 H126 Lu4 N16 Na4 O43 | P 1 2/c 1 | 18.0616; 14.969; 18.2262 90; 108.69; 90 | 4667.84 | Allain, Clémence; Beer, Paul D.; Faulkner, Stephen; Jones, Michael W.; Kenwright, Alan M.; Kilah, Nathan L.; Knighton, Richard C.; Sørensen, Thomas Just; Tropiano, Manuel Lanthanide appended rotaxanes respond to changing chloride concentration Chemical Science, 2013, 4, 489 |
| 1514853 | CIF | C26 H16 O5 S8 | P -1 | 6.06; 12.255; 19.535 79.509; 81.926; 76.549 | 1380.07 | Simao, Claudia; Mas-Torrent, Marta; André, Vânia; Duarte, M. Teresa; Veciana, Jaume; Rovira, Concepció Intramolecular electron transfer in the photodimerisation product of a tetrathiafulvalene derivative in solution and on a surface Chemical Science, 2013, 4, 307 |
| 1514854 | CIF | C25 H20 O | P 1 21/c 1 | 11.751; 7.5332; 19.9382 90; 95.651; 90 | 1756.4 | Truong, Thanh; Daugulis, Olafs Divergent Reaction Pathways for Phenol Arylation by Arynes: Synthesis of Helicenes and 2-Arylphenols. Chemical science (Royal Society of Chemistry : 2010), 2013, 4, 531-535 |
| 1514855 | CIF | Co2 K7 O49 W11 | F m -3 m | 21.2598; 21.2598; 21.2598 90; 90; 90 | 9609 | Song, Fangyuan; Ding, Yong; Ma, Baochun; Wang, Changming; Wang, Qiang; Du, Xiaoqiang; Fu, Shao; Song, Jie K7[CoIIICoII(H2O)W11O39]: a molecular mixed-valence Keggin polyoxometalate catalyst of high stability and efficiency for visible light-driven water oxidation Energy & Environmental Science, 2013, 6, 1170 |
| 1514856 | CIF | C20 H32 Cl2 N4 Pd | P 1 21/c 1 | 7.5573; 14.3118; 22.254 90; 94.258; 90 | 2400.3 | Haque, Rosenani A.; Salman, Abbas Washeel; Budagumpi, Srinivasa; Abdullah, Amirul Al-Ashraf; Majid, Amin M S Abdul Sterically tuned Ag(I)- and Pd(II)-N-heterocyclic carbene complexes of imidazol-2-ylidenes: synthesis, crystal structures, and in vitro antibacterial and anticancer studies. Metallomics : integrated biometal science, 2013, 5, 760-769 |
| 1514857 | CIF | C14 H20 Br0 Cl2 N4 Pd | P -1 | 7.5862; 7.6268; 8.196 78.976; 73.148; 69.472 | 422.9 | Haque, Rosenani A.; Salman, Abbas Washeel; Budagumpi, Srinivasa; Abdullah, Amirul Al-Ashraf; Majid, Amin M S Abdul Sterically tuned Ag(I)- and Pd(II)-N-heterocyclic carbene complexes of imidazol-2-ylidenes: synthesis, crystal structures, and in vitro antibacterial and anticancer studies. Metallomics : integrated biometal science, 2013, 5, 760-769 |
| 1514858 | CIF | C28 H36 Cl2 N4 Pd | P 1 21/c 1 | 11.629; 8.662; 16.71 90; 122.315; 90 | 1422.5 | Haque, Rosenani A.; Salman, Abbas Washeel; Budagumpi, Srinivasa; Abdullah, Amirul Al-Ashraf; Majid, Amin M S Abdul Sterically tuned Ag(I)- and Pd(II)-N-heterocyclic carbene complexes of imidazol-2-ylidenes: synthesis, crystal structures, and in vitro antibacterial and anticancer studies. Metallomics : integrated biometal science, 2013, 5, 760-769 |
| 1514859 | CIF | C2 H16 N10 O7 Pt2 | P 1 21/a 1 | 6.76; 12.76; 18.06 90; 92.31; 90 | 1557 | Komeda, Seiji; Takayama, Hiroshi; Suzuki, Toshihiro; Odani, Akira; Yamori, Takao; Chikuma, Masahiko Synthesis of antitumor azolato-bridged dinuclear platinum(ii) complexes with in vivo antitumor efficacy and unique in vitro cytotoxicity profiles. Metallomics : integrated biometal science, 2013, 5, 461-468 |
| 1514860 | CIF | C19 H16 Au Cl N2 | P c a 21 | 12.8493; 6.2192; 20.5103 90; 90; 90 | 1639.03 | Citta, Anna; Schuh, Esther; Mohr, Fabian; Folda, Alessandra; Massimino, Maria Lina; Bindoli, Alberto; Casini, Angela; Rigobello, Maria Pia Fluorescent silver(I) and gold(I)-N-heterocyclic carbene complexes with cytotoxic properties: mechanistic insights. Metallomics : integrated biometal science, 2013, 5, 1006-1015 |
| 1514861 | CIF | C39 H34 Ag2 Cl4 N4 | P 1 21/c 1 | 11.70626; 10.58915; 28.8363 90; 94.201; 90 | 3564.92 | Citta, Anna; Schuh, Esther; Mohr, Fabian; Folda, Alessandra; Massimino, Maria Lina; Bindoli, Alberto; Casini, Angela; Rigobello, Maria Pia Fluorescent silver(I) and gold(I)-N-heterocyclic carbene complexes with cytotoxic properties: mechanistic insights. Metallomics : integrated biometal science, 2013, 5, 1006-1015 |
| 1514862 | CIF | C15 H16 N2 O3 | P -1 | 7.9251; 8.3409; 11.1686 97.746; 110.719; 95.6 | 675.77 | Telpoukhovskaia, Maria A.; Patrick, Brian O.; Rodríguez-Rodríguez, Cristina; Orvig, Chris Exploring the multifunctionality of thioflavin- and deferiprone-based molecules as acetylcholinesterase inhibitors for potential application in Alzheimer's disease. Molecular bioSystems, 2013, 9, 792-805 |
| 1514863 | CIF | C16 H14 N2 O3 | P 1 21/c 1 | 9.2499; 17.8481; 9.1282 90; 115.046; 90 | 1365.3 | Telpoukhovskaia, Maria A.; Patrick, Brian O.; Rodríguez-Rodríguez, Cristina; Orvig, Chris Exploring the multifunctionality of thioflavin- and deferiprone-based molecules as acetylcholinesterase inhibitors for potential application in Alzheimer's disease. Molecular bioSystems, 2013, 9, 792-805 |
| 1514864 | CIF | C16 H14 N2 O2 S | P 1 21/c 1 | 9.7184; 13.6885; 10.8658 90; 106.839; 90 | 1383.5 | Telpoukhovskaia, Maria A.; Patrick, Brian O.; Rodríguez-Rodríguez, Cristina; Orvig, Chris Exploring the multifunctionality of thioflavin- and deferiprone-based molecules as acetylcholinesterase inhibitors for potential application in Alzheimer's disease. Molecular bioSystems, 2013, 9, 792-805 |
| 1514865 | CIF | C13 H15 N O3 | P -1 | 7.5969; 9.6007; 9.9994 100.928; 111.838; 107.261 | 608.35 | Telpoukhovskaia, Maria A.; Patrick, Brian O.; Rodríguez-Rodríguez, Cristina; Orvig, Chris Exploring the multifunctionality of thioflavin- and deferiprone-based molecules as acetylcholinesterase inhibitors for potential application in Alzheimer's disease. Molecular bioSystems, 2013, 9, 792-805 |
| 1514866 | CIF | C119.81 H53.81 Cl1.25 N4 Ni Sc2 | C 1 2/m 1 | 25.054; 15.018; 19.103 90; 94.07; 90 | 7169.59 | Feng, Yongqiang; Wang, Taishan; Wu, Jingyi; Feng, Lai; Xiang, Junfeng; Ma, Yihan; Zhang, Zhuxia; Jiang, Li; Shu, Chunying; Wang, Chunru Structural and electronic studies of metal carbide clusterfullerene Sc2C2@Cs-C72. Nanoscale, 2013, 5, 6704-6707 |
| 1514867 | CIF | C21.5 H16.5 F6 O6 | P 1 21 1 | 13.1176; 5.17328; 17.1353 90; 112.756; 90 | 1072.31 | Kataoka, Keisuke; Yasumoto, Tetsuaki; Manabe, Yousuke; Sato, Hiroyasu; Yamano, Akihito; Katagiri, Toshimasa A molecular-sized tunnel-porous crystal with a ratchet gear structure and its one-way guest-molecule transportation property. Nanoscale, 2013, 5, 1298-1300 |
| 1514868 | CIF | C18 H14 F6 O6 | P 1 21 1 | 13.308; 5.176; 15.272 90; 98.749; 90 | 1039.7 | Kataoka, Keisuke; Yasumoto, Tetsuaki; Manabe, Yousuke; Sato, Hiroyasu; Yamano, Akihito; Katagiri, Toshimasa A molecular-sized tunnel-porous crystal with a ratchet gear structure and its one-way guest-molecule transportation property. Nanoscale, 2013, 5, 1298-1300 |
| 1514869 | CIF | C190 H130 Ag16 Cl4 F27.89 O0.13 P8 S14 | I 41/a :2 | 25.3878; 25.3878; 72.3758 90; 90; 90 | 46649.1 | Yang, Huayan; Wang, Yu; Zheng, Nanfeng Stabilizing subnanometer Ag(0) nanoclusters by thiolate and diphosphine ligands and their crystal structures. Nanoscale, 2013, 5, 2674-2677 |
| 1514870 | CIF | C322 H234 Ag32 Cl0 F72 O1.5 P11 S24 | C 1 2/c 1 | 49.221; 22.63; 40.889 90; 120.01; 90 | 39439 | Yang, Huayan; Wang, Yu; Zheng, Nanfeng Stabilizing subnanometer Ag(0) nanoclusters by thiolate and diphosphine ligands and their crystal structures. Nanoscale, 2013, 5, 2674-2677 |
| 1514871 | CIF | C114.75 H48.75 Cl0.75 N4 Ni Sm | C 1 2 1 | 25.082; 14.877; 19.229 90; 93.881; 90 | 7159 | Xu, Wei; Hao, Yajuan; Uhlik, Filip; Shi, Zujin; Slanina, Zdenêk; Feng, Lai Structural and electrochemical studies of Sm@D3h-C74 reveal a weak metal-cage interaction and a small band gap species. Nanoscale, 2013, 5, 10409-10413 |
| 1514872 | CIF | C16 H8 N2 Se | P 1 21/n 1 | 9.9546; 9.6031; 12.4807 90; 105.463; 90 | 1149.91 | Xiao, Jinchong; Xiao, Xuyu; Zhao, Yanlei; Wu, Bo; Liu, Zhenying; Zhang, Xuemin; Wang, Sujuan; Zhao, Xiaohui; Liu, Lei; Jiang, Li Synthesis, physical properties and self-assembly behavior of azole-fused pyrene derivatives. Nanoscale, 2013, 5, 5420-5425 |
| 1514873 | CIF | C9 H26 N2 O12 Ti | P 3 | 15.304; 15.304; 6.6658 90; 90; 120 | 1352.1 | Seisenbaeva, Gulaim A.; Daniel, Geoffrey; Nedelec, Jean-Marie; Kessler, Vadim G. Solution equilibrium behind the room-temperature synthesis of nanocrystalline titanium dioxide. Nanoscale, 2013, 5, 3330-3336 |
| 1514874 | CIF | C23 H13 N O2 S2 | P 1 21/c 1 | 8.1311; 15.2998; 14.1896 90; 104.87; 90 | 1706.13 | Sarker, Majher I.; Shahrin, Tasnuva; Steinmetz, Mark G.; Timerghazin, Qadir K. Photochemical electrocyclic ring closure and leaving group expulsion from N-(9-oxothioxanthenyl)benzothiophene carboxamides. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2013, 12, 309-322 |
| 1514875 | CIF | C36 H27 N7 | P 21 21 21 | 9.807; 10.079; 29.603 90; 90; 90 | 2926.1 | Bahrenburg, Julia; Sievers, Claudia M.; Schönborn, Jan Boyke; Hartke, Bernd; Renth, Falk; Temps, Friedrich; Näther, Christian; Sönnichsen, Frank D Photochemical properties of multi-azobenzene compounds. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2013, 12, 511-518 |
| 1514876 | CIF | C44 H52 N6 O9 | P -1 | 13.322; 13.735; 14.199 67.748; 63.947; 64.564 | 2049.2 | Farrán, Angeles; Mohanraj, John; Clarkson, Guy J.; Claramunt, Rosa M.; Herranz, Fernando; Accorsi, Gianluca Tuning photoinduced processes of covalently bound isoalloxazine and anthraquinone bichromophores. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2013, 12, 813-822 |
| 1514877 | CIF | C38 H38 N4 O7 | P 1 21/c 1 | 7.28715; 29.6837; 14.4618 90; 94.412; 90 | 3118.96 | Farrán, Angeles; Mohanraj, John; Clarkson, Guy J.; Claramunt, Rosa M.; Herranz, Fernando; Accorsi, Gianluca Tuning photoinduced processes of covalently bound isoalloxazine and anthraquinone bichromophores. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2013, 12, 813-822 |
| 1514878 | CIF | C38 H38 N4 O7 | P -1 | 14.7145; 15.495; 15.5967 72.967; 77.681; 71.913 | 3202.6 | Farrán, Angeles; Mohanraj, John; Clarkson, Guy J.; Claramunt, Rosa M.; Herranz, Fernando; Accorsi, Gianluca Tuning photoinduced processes of covalently bound isoalloxazine and anthraquinone bichromophores. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2013, 12, 813-822 |
| 1514879 | CIF | C19.5 H16.5 N1.5 O9 Tb | P -1 | 9.9199; 10.4905; 13.4316 105.687; 101.88; 94.436 | 1303.68 | Wang, Hong-Ming; Yang, Yang-Yi; Zeng, Cheng-Hui; Chu, Tian-Shu; Zhu, Yi-Min; Ng, Seik Weng A highly luminescent terbium-organic framework for reversible detection of mercury ions in aqueous solution. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2013, 12, 1700-1706 |
| 1514880 | CIF | C10 H10 O4 | P -1 | 6.8784; 8.2785; 8.5427 78.119; 87.93; 88.399 | 475.61 | Unold, Jörg; Wang, Dongren; Frey, Wolfgang; Buchmeiser, Michael R. Stereo- and regioselective cyclopolymerization of chiral 1,7-octadiynes Polymer Chemistry, 2013, 4, 4219 |
| 1514881 | CIF | C10 H14 O2 | C 1 c 1 | 14.8047; 24.843; 5.0851 90; 101.707; 90 | 1831.4 | Unold, Jörg; Wang, Dongren; Frey, Wolfgang; Buchmeiser, Michael R. Stereo- and regioselective cyclopolymerization of chiral 1,7-octadiynes Polymer Chemistry, 2013, 4, 4219 |
| 1514882 | CIF | C27 H38 Cl2 N2 O1.5 Zn | C 1 2/c 1 | 29.535; 11.948; 15.335 90; 96.899; 90 | 5372.3 | Naumann, Stefan; Schmidt, Friedrich Georg; Frey, Wolfgang; Buchmeiser, Michael R. Protected N-heterocyclic carbenes as latent pre-catalysts for the polymerization of ε-caprolactone Polymer Chemistry, 2013, 4, 4172 |
| 1514883 | CIF | C71 H116 N4 O6 Y2 | P c a b | 21.045; 24.936; 30.425 90; 90; 90 | 15966 | Fang, Jian; Tschan, Mathieu J.-L.; Roisnel, Thierry; Trivelli, Xavier; Gauvin, Régis M.; Thomas, Christophe M.; Maron, Laurent Yttrium catalysts for syndioselective β-butyrolactone polymerization: on the origin of ligand-induced stereoselectivity Polymer Chemistry, 2013, 4, 360 |
| 1514884 | CIF | C23 H26 N4 O2 | P 1 c 1 | 17.848; 16.102; 22.302 90; 110.45; 90 | 6005 | Alsarraf, Jérome; Robert, Frédéric; Cramail, Henri; Landais, Yannick Latent catalysts based on guanidine templates for polyurethane synthesis Polymer Chemistry, 2013, 4, 904 |
| 1514885 | CIF | C25 H30 N4 O2 | P -1 | 10.154; 10.801; 11.233 69.9; 85.34; 70.13 | 1087.2 | Alsarraf, Jérome; Robert, Frédéric; Cramail, Henri; Landais, Yannick Latent catalysts based on guanidine templates for polyurethane synthesis Polymer Chemistry, 2013, 4, 904 |
| 1514886 | CIF | C24 H29 N5 O2 | P b c a | 12.5135; 8.2914; 41.841 90; 90; 90 | 4341.2 | Alsarraf, Jérome; Robert, Frédéric; Cramail, Henri; Landais, Yannick Latent catalysts based on guanidine templates for polyurethane synthesis Polymer Chemistry, 2013, 4, 904 |
| 1514887 | CIF | C27 H41 N3 O3 | P 1 21 1 | 11.2993; 7.8614; 14.373 90; 94.716; 90 | 1272.4 | Li, Weina; Tian, Tian; Zhu, Wei; Cui, Jiecheng; Ju, Yong; Li, Guangtao Metal-free click approach for facile production of main chain poly(bile acid)s Polymer Chemistry, 2013, 4, 3057 |
| 1514888 | CIF | C36 H26 | P -1 | 9.908; 10.7787; 12.7321 97.6691; 94.7545; 115.897 | 1196.95 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514889 | CIF | C36.5 H25 Cl3 | P 1 21/c 1 | 7.5317; 21.0519; 17.7743 90; 94.802; 90 | 2808.3 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514890 | CIF | C38 H30 | C 1 2/c 1 | 7.3789; 22.1571; 16.3043 90; 102.057; 90 | 2606.87 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514891 | CIF | C52 H56 Cl2 | F d d d :2 | 13.8723; 17.3314; 37.589 90; 90; 90 | 9037.4 | Schlütter, Florian; Nishiuchi, Tomohiko; Enkelmann, Volker; Müllen, Klaus π-Congested poly(paraphenylene) from 2,2′,6,6′-tetraphenyl-1,1′-biphenyl units: synthesis and structural characterization Polymer Chemistry, 2013, 4, 2963 |
| 1514892 | CIF | C23 H19 N7 | P 43 21 2 | 6.1133; 6.1133; 52.627 90; 90; 90 | 1966.8 | Lang, Christiane; Pahnke, Kai; Kiefer, Claude; Goldmann, Anja S.; Roesky, Peter W.; Barner-Kowollik, Christopher Consecutive modular ligation as an access route to palladium containing polymers Polymer Chemistry, 2013, 4, 5456 |
| 1514893 | CIF | C29 H37 Cl4 N7 O3 Pd2 S3 | P -1 | 8.6458; 13.837; 17.394 109.67; 102.9; 95.46 | 1876.8 | Lang, Christiane; Pahnke, Kai; Kiefer, Claude; Goldmann, Anja S.; Roesky, Peter W.; Barner-Kowollik, Christopher Consecutive modular ligation as an access route to palladium containing polymers Polymer Chemistry, 2013, 4, 5456 |
| 1514894 | CIF | C76 H68 N2 O2 | P n a 21 | 18.951; 14.595; 20.257 90; 90; 90 | 5603 | Brulé, Emilie; Guérineau, Vincent; Vermaut, Philippe; Prima, Frédéric; Balogh, Janos; Maron, Laurent; Slawin, Alexandra M. Z.; Nolan, Steven P.; Thomas, Christophe M. Polymerization of cyclic esters using N-heterocyclic carbene carboxylate catalysts Polymer Chemistry, 2013, 4, 2414 |
| 1514895 | CIF | C38 H38 Br2 N2 O2 S2 | P 1 21/c 1 | 18.397; 8.5233; 11.0281 90; 90.413; 90 | 1729.2 | Zhang, Haichang; Welterlich, Irina; Neudörfl, Jörg-Martin; Tieke, Bernd; Yang, Chao; Chen, Xuegang; Yang, Wenjun Synthesis and characterization of 1,3,4,6-tetraarylpyrrolo[3,2-b]-pyrrole-2,5-dione (isoDPP)-based donor–acceptor polymers with low band gap Polymer Chemistry, 2013, 4, 4682 |
| 1514896 | CIF | C32 H51 Al O2 | P -1 | 10.9975; 12.3835; 13.3184 65.237; 75.393; 69.574 | 1531.4 | Descour, Camille; Sciarone, Timo J. J.; Cavallo, Dario; Macko, Tibor; Kelchtermans, Mauritz; Korobkov, Ilia; Duchateau, Robbert Exploration of the effect of 2,6-(t-Bu)2-4-Me-C6H2OH (BHT) in chain shuttling polymerization Polymer Chemistry, 2013, 4, 4718 |
| 1514897 | CIF | C34 H56 O2 Zn2 | P b c a | 17.7224; 9.6794; 19.248 90; 90; 90 | 3301.8 | Descour, Camille; Sciarone, Timo J. J.; Cavallo, Dario; Macko, Tibor; Kelchtermans, Mauritz; Korobkov, Ilia; Duchateau, Robbert Exploration of the effect of 2,6-(t-Bu)2-4-Me-C6H2OH (BHT) in chain shuttling polymerization Polymer Chemistry, 2013, 4, 4718 |
| 1514898 | CIF | C30 H35 Br2 N3 O4 S2 | P 1 21/c 1 | 15.9739; 13.3946; 15.1964 90; 108.737; 90 | 3079.16 | Neo, Wei Teng; Loo, Lee May; Song, Jing; Wang, Xiaobai; Cho, Ching Mui; On Chan, Hardy Sze; Zong, Yun; Xu, Jianwei Solution-processable blue-to-transmissive electrochromic benzotriazole-containing conjugated polymers Polymer Chemistry, 2013, 4, 4663 |
| 1514899 | CIF | C31 H44 Cl4 N2 O2 | C 1 2/c 1 | 16.2658; 9.9841; 21.212 90; 108.293; 90 | 3270.7 | Naumann, Stefan; Schmidt, Friedrich Georg; Schowner, Roman; Frey, Wolfgang; Buchmeiser, Michael R. Polymerization of methyl methacrylate by latent pre-catalysts based on CO2-protected N-heterocyclic carbenes Polymer Chemistry, 2013, 4, 2731 |
| 1514900 | CIF | C32 H24 O4 | P -1 | 8.957; 11.1473; 12.7782 80.558; 89.54; 86.557 | 1256.3 | Hu, Rongrong; Lam, Jacky W. Y.; Yu, Yong; Sung, Herman H. Y.; Williams, Ian D.; Yuen, Matthew M. F.; Tang, Ben Zhong Facile synthesis of soluble nonlinear polymers with glycogen-like structures and functional properties from “simple” acrylic monomers Polymer Chemistry, 2013, 4, 95 |
| 1514901 | CIF | C32 H24 O4 | P -1 | 9.5026; 12.2523; 12.4543 98.109; 110.976; 105.891 | 1255.2 | Hu, Rongrong; Lam, Jacky W. Y.; Yu, Yong; Sung, Herman H. Y.; Williams, Ian D.; Yuen, Matthew M. F.; Tang, Ben Zhong Facile synthesis of soluble nonlinear polymers with glycogen-like structures and functional properties from “simple” acrylic monomers Polymer Chemistry, 2013, 4, 95 |
| 1514902 | CIF | C31 H22 O4 | C 1 2/c 1 | 17.33; 9.333; 13.964 90; 99.064; 90 | 2230.3 | Hu, Rongrong; Lam, Jacky W. Y.; Yu, Yong; Sung, Herman H. Y.; Williams, Ian D.; Yuen, Matthew M. F.; Tang, Ben Zhong Facile synthesis of soluble nonlinear polymers with glycogen-like structures and functional properties from “simple” acrylic monomers Polymer Chemistry, 2013, 4, 95 |
| 1514903 | CIF | C22 H39 Na O9 S | P 1 21 1 | 12.847; 7.442; 13.875 90; 106.04; 90 | 1274.9 | Zhang, Tao; Wu, Ya; Gao, Lihong; Song, Zhongtai; Zhao, Li; Zhang, Yunxiao; Tao, Jingchao A novel Na+ coordination mediated supramolecular organogel based on isosteviol: water-assisted self-assembly, in situ forming and selective gelation abilities Soft Matter, 2013, 9, 638 |
| 1514904 | CIF | C22 H35 Na O7 S | P 21 21 21 | 7.35356; 22.3698; 28.078 90; 90; 90 | 4618.77 | Zhang, Tao; Wu, Ya; Gao, Lihong; Song, Zhongtai; Zhao, Li; Zhang, Yunxiao; Tao, Jingchao A novel Na+ coordination mediated supramolecular organogel based on isosteviol: water-assisted self-assembly, in situ forming and selective gelation abilities Soft Matter, 2013, 9, 638 |
| 1514905 | CIF | C12 H16 N4 O8 S Zn | P b c a | 9.1328; 9.0544; 39.49 90; 90; 90 | 3265.5 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514906 | CIF | C12 H16 Cd N4 O8 S | P 1 21 1 | 6.8863; 10.0489; 12.7212 90; 90.543; 90 | 880.26 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514907 | CIF | C12 H18 N6 O8 S Zn | P 1 21/c 1 | 21.2322; 8.5552; 9.475 90; 94.688; 90 | 1715.34 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514908 | CIF | C12 H18 Cd N6 O8 S | P n m a | 9.5591; 21.864; 8.5122 90; 90; 90 | 1779.1 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514909 | CIF | C12 H20 N6 O9 S Zn | P 21 21 21 | 7.9153; 10.9871; 21.5221 90; 90; 90 | 1871.7 | Croitor, Lilia; Coropceanu, Eduard B.; Masunov, Artëm E.; Rivera-Jacquez, Hector J.; Siminel, Anatolii V.; Fonari, Marina S. Mechanism of Nonlinear Optical Enhancement and Supramolecular Isomerism in 1D Polymeric Zn(II) and Cd(II) Sulfates with Pyridine-4-aldoxime Ligands The Journal of Physical Chemistry C, 2014, 118, 9217 |
| 1514910 | CIF | C42 H31 F N3 O5 P | P -1 | 10.3434; 10.8351; 17.8432 88.992; 74.957; 66.544 | 1763.3 | Han, Ying; Sheng, Yin-Jian; Yan, Chao-Guo Convenient Synthesis of Triphenylphosphanylidene Spiro[cyclopentane-1,3'-indolines] and Spiro[cyclopent[2]ene-1,3'-indolines] via Three-Component Reactions. Organic letters, 2014, 16, 2654-2657 |
| 1514911 | CIF | C39 H34 N3 O5 P | P 1 21/c 1 | 11.5092; 20.748; 18.3368 90; 113.281; 90 | 4022.2 | Han, Ying; Sheng, Yin-Jian; Yan, Chao-Guo Convenient Synthesis of Triphenylphosphanylidene Spiro[cyclopentane-1,3'-indolines] and Spiro[cyclopent[2]ene-1,3'-indolines] via Three-Component Reactions. Organic letters, 2014, 16, 2654-2657 |
| 1514912 | CIF | C46 H38 F N2 O7 P | P -1 | 11.8143; 12.899; 16.002 89.295; 75.627; 66.226 | 2151.2 | Han, Ying; Sheng, Yin-Jian; Yan, Chao-Guo Convenient Synthesis of Triphenylphosphanylidene Spiro[cyclopentane-1,3'-indolines] and Spiro[cyclopent[2]ene-1,3'-indolines] via Three-Component Reactions. Organic letters, 2014, 16, 2654-2657 |
| 1514913 | CIF | C27 H19 Cl O3 Sn | P -1 | 9.582; 10.189; 12.743 80.315; 81.682; 72.174 | 1161.7 | Villamil-Ramos, Raul; Barba, Víctor; Yatsimirsky, Anatoly K. Selective fluorometric detection of pyrophosphate by 3-hydroxyflavone-diphenyltin(IV) complex in aqueous micellar medium. The Analyst, 2012, 137, 5229-5236 |
| 1514914 | CIF | C23 H23 N3 O4 | P -1 | 5.933; 11.085; 15.588 93.5; 92.85; 93.01 | 1020.4 | Ho, I-Ting; Lai, Ting-Ling; Wu, Ren-Tsung; Tsai, Ming-Tsung; Wu, Chun-Ming; Lee, Gene-Hsiang; Chung, Wen-Sheng Design and synthesis of triazolyl coumarins as Hg2+ selective fluorescent chemosensors. The Analyst, 2012, 137, 5770-5776 |
| 1514915 | CIF | C25 H25 N3 O5 | P -1 | 5.7298; 11.442; 17.7012 96.531; 96.165; 93.056 | 1143.77 | Ho, I-Ting; Lai, Ting-Ling; Wu, Ren-Tsung; Tsai, Ming-Tsung; Wu, Chun-Ming; Lee, Gene-Hsiang; Chung, Wen-Sheng Design and synthesis of triazolyl coumarins as Hg2+ selective fluorescent chemosensors. The Analyst, 2012, 137, 5770-5776 |
| 1514916 | CIF | C52 H47 F12 N5 P2 | P 1 21/c 1 | 24.481; 8.9613; 23.769 90; 108.336; 90 | 4949.7 | Kumar, Rahul; Kumar, Sandeep; Singh, Prabhpreet; Hundal, Geeta; Hundal, Maninder Singh; Kumar, Subodh A fluorescent chemosensor for detection of perchlorate ions in water. The Analyst, 2012, 137, 4913-4916 |
| 1514917 | CIF | C101 H82 Eu2 F18 N8 O12 S6 | P -1 | 14.5284; 24.4825; 30.2443 97.944; 99.275; 99.985 | 10302.3 | Knall, Astrid C.; Tscherner, Martin; Noormofidi, Nadja; Pein, Andreas; Saf, Robert; Mereiter, Kurt; Ribitsch, Volker; Stelzer, Franz; Slugovc, Christian Nonradiative deactivation of europium(III) luminescence as a detection scheme for moisture. The Analyst, 2012, 137, 563-566 |
| 1514918 | CIF | C24 H22 Cu N4 O5 | P -1 | 8.7402; 10.657; 13.3251 73.598; 81.236; 66.007 | 1086.77 | Singh, Vikram; Mondal, Prakash Chandra; Lakshmanan, Jeyachandran Yekkoni; Zharnikov, Michael; Gupta, Tarkeshwar "Turn on" electron-transfer-based selective detection of ascorbic acid via copper complexes immobilized on glass. The Analyst, 2012, 137, 3216-3219 |
| 1514919 | CIF | C18 H13 N3 S | P 1 21 1 | 8.3875; 12.9511; 13.3838 90; 98.248; 90 | 1438.81 | Sen, Supriti; Sarkar, Sandipan; Chattopadhyay, Basab; Moirangthem, Anuradha; Basu, Anupam; Dhara, Koushik; Chattopadhyay, Pabitra A ratiometric fluorescent chemosensor for iron: discrimination of Fe2+ and Fe3+ and living cell application. The Analyst, 2012, 137, 3335-3342 |
| 1514920 | CIF | C31 H33 Br Fe N4 O | C 1 2/c 1 | 20.3791; 19.3945; 16.8449 90; 121.23; 90 | 5693.1 | Cao, Qian-Yong; Pradhan, Tuhin; Lee, Min Hee; No, Kwanghyun; Kim, Jong Seung Ferrocene-based anion receptor bearing amide and triazolium donor groups. The Analyst, 2012, 137, 4454-4457 |
| 1514921 | CIF | C31 H33 F6 Fe N4 O P | C 1 2/c 1 | 20.9857; 20.1226; 17.211 90; 117.802; 90 | 6429 | Cao, Qian-Yong; Pradhan, Tuhin; Lee, Min Hee; No, Kwanghyun; Kim, Jong Seung Ferrocene-based anion receptor bearing amide and triazolium donor groups. The Analyst, 2012, 137, 4454-4457 |
| 1514922 | CIF | C13 H13 N O2 | C 1 2/c 1 | 15.982; 4.957; 27.97 90; 104.77; 90 | 2143 | Lin, Hsiang-Yi; Cheng, Pi-Yun; Wan, Chin-Feng; Wu, An-Tai A turn-on and reversible fluorescence sensor for zinc ion. The Analyst, 2012, 137, 4415-4417 |
| 1514923 | CIF | C16 H12 B F2 N3 | P 1 21/c 1 | 15.746; 8.9776; 10.2886 90; 99.12; 90 | 1436 | Kand, Dnyaneshwar; Mishra, Pratyush Kumar; Saha, Tanmoy; Lahiri, Mayurika; Talukdar, Pinaki BODIPY based colorimetric fluorescent probe for selective thiophenol detection: theoretical and experimental studies. The Analyst, 2012, 137, 3921-3924 |
| 1514924 | CIF | C16 H13 N O2 | P 1 21/c 1 | 9.7368; 9.5514; 13.8091 90; 107.501; 90 | 1224.8 | Sen, Supriti; Mukherjee, Titas; Chattopadhyay, Basab; Moirangthem, Anuradha; Basu, Anupam; Marek, Jaromir; Chattopadhyay, Pabitra A water soluble Al3+ selective colorimetric and fluorescent turn-on chemosensor and its application in living cell imaging. The Analyst, 2012, 137, 3975-3981 |
| 1514926 | CIF | C24 H15 N O2 | P 1 21/n 1 | 6.661; 30.083; 17.635 90; 99.52; 90 | 3485.08 | Guha, Subarna; Lohar, Sisir; Banerjee, Arnab; Sahana, Animesh; Mukhopadhyay, Subhra Kanti; Matalobos, Jesús Sanmartín; Das, Debasis Anthracene appended coumarin derivative as a Cr(iii) selective turn-on fluorescent probe for living cell imaging: a green approach towards speciation studies Analytical Methods, 2012, 4, 3163 |
| 1514927 | CIF | C16 H11 N O5 | P 1 21/c 1 | 15.7822; 7.2392; 12.5086 90; 106.033; 90 | 1373.5 | Ivanova, Bojidarka B. Matrixes in UV-MALDI mass spectrometry – crystals of organic salts versus co-crystals of neutral polyfunctional carboxylic acids Analytical Methods, 2012, 4, 2247 |
| 1514930 | CIF | C8 H7 N2 O3 | C 1 2/c 1 | 21.047; 8.368; 9.364 90; 101.972; 90 | 1613.3 | Ivanova, Bojidarka B. Matrixes in UV-MALDI mass spectrometry ‒ crystals of organic salts versus co-crystals of neutral polyfunctional carboxylic acids Analytical Methods, 2012, 4, 2247 |
| 1514932 | CIF | C15 H11 N S | A b a 2 | 10.7541; 20.966; 10.5543 90; 90; 90 | 2379.7 | Das, Sudipta; Sahana, Animesh; Banerjee, Arnab; Lohar, Sisir; Guha, Subarna; Matalobos, Jesús Sanmartín; Das, Debasis Thiophene anchored naphthalene derivative: Cr3+ selective turn-on fluorescent probe for living cell imaging Analytical Methods, 2012, 4, 2254 |
| 1514933 | CIF | C30 H35 B O9 | P 1 21/c 1 | 14.1656; 14.6048; 14.5328 90; 104.242; 90 | 2914.2 | Lawrence, Katherine; Flower, Stephen E.; Kociok-Kohn, Gabriele; Frost, Christopher G.; James, Tony D. A simple and effective colorimetric technique for the detection of boronic acids and their derivatives Analytical Methods, 2012, 4, 2215 |
| 1514934 | CIF | C28 H24 | P 32 | 29.9106; 29.9106; 5.9714 90; 90; 120 | 4626.55 | Tseng, Nai-Wen; Liu, Jianzhao; Ng, Jason C. Y.; Lam, Jacky W. Y.; Sung, Herman H. Y.; Williams, Ian D.; Tang, Ben Zhong Deciphering mechanism of aggregation-induced emission (AIE): Is E–Z isomerisation involved in an AIE process? Chemical Science, 2012, 3, 493 |
| 1514935 | CIF | C13 H14 Fe N5 O | P -1 | 8.24; 9.982; 16.64 82.977; 83.088; 73.325 | 1296 | Patra, Ashis K.; Dube, Koustubh S.; Sanders, Brian C.; Papaefthymiou, Georgia C.; Conradie, Jeanet; Ghosh, Abhik; Harrop, Todd C. A thermally stable {FeNO}8 complex: properties and biological reactivity of reduced MNO systems Chemical Science, 2012, 3, 364 |
| 1514936 | CIF | C13 H14 Co N5 O | P 1 21/n 1 | 10.445; 11.723; 11.03 90; 100.177; 90 | 1329.3 | Patra, Ashis K.; Dube, Koustubh S.; Sanders, Brian C.; Papaefthymiou, Georgia C.; Conradie, Jeanet; Ghosh, Abhik; Harrop, Todd C. A thermally stable {FeNO}8 complex: properties and biological reactivity of reduced MNO systems Chemical Science, 2012, 3, 364 |
| 1514937 | CIF | C68 H63 Fe3 N9 | P -1 | 11.805; 12.98; 19.363 73.794; 86.132; 75.907 | 2763.3 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514938 | CIF | C68 H63 Fe3 N9 | P -1 | 11.839; 13.026; 19.436 73.818; 86.197; 75.893 | 2791.8 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514939 | CIF | C68 H63 Fe3 N9 | P -1 | 11.8394; 13.037; 19.508 73.852; 86.214; 75.811 | 2804 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514940 | CIF | C68 H63 Fe3 N9 | P -1 | 11.888; 13.106; 19.649 73.904; 86.251; 75.708 | 2850.3 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514941 | CIF | C68 H63 Fe3 N9 | P -1 | 11.881; 13.093; 19.706 73.971; 86.265; 75.654 | 2854.4 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514942 | CIF | C60 H74 Fe3 N6 O4.75 | C 1 2/c 1 | 21.1077; 15.5695; 33.842 90; 98.773; 90 | 10991.6 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514943 | CIF | C65 H69 Fe3 N6 P3 | P 1 21/c 1 | 12.403; 20.06; 22.036 90; 90; 90 | 5483 | Eames, Emily V.; Harris, T. David; Betley, Theodore A. Modulation of magnetic behavior via ligand-field effects in the trigonal clusters (PhL)Fe3L*3 (L* = thf, py, PMe2Ph) Chemical Science, 2012, 3, 407 |
| 1514944 | CIF | C26 H25 F3 N2 O4 | P 21 21 21 | 8.6711; 9.4306; 29.5986 90; 90; 90 | 2420.39 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514945 | CIF | C31 H30 F3 N O6 S | P 1 21/c 1 | 11.9727; 24.2406; 10.481 90; 107.399; 90 | 2902.67 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514946 | CIF | C27 H27 F3 N2 O4 | P 1 21 1 | 10.8509; 9.3445; 12.7734 90; 107.297; 90 | 1236.6 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514947 | CIF | C32 H29 N O4 S | P 21 21 21 | 9.3165; 14.3322; 19.705 90; 90; 90 | 2631.13 | Maciver, Eleanor E.; Knipe, Peter C.; Cridland, Andrew P.; Thompson, Amber L.; Smith, Martin D. Catalytic enantioselective electrocyclic cascades Chemical Science, 2012, 3, 537 |
| 1514948 | CIF | C44 H40 N4 Si | C 1 2/c 1 | 30.7917; 10.2374; 11.7082 90; 90.481; 90 | 3690.61 | Mei, Ju; Wang, Jian; Sun, Jing Zhi; Zhao, Hui; Yuan, Wangzhang; Deng, Chunmei; Chen, Shuming; Sung, Herman H. Y.; Lu, Ping; Qin, Anjun; Kwok, Hoi Sing; Ma, Yuguang; Williams, Ian D.; Tang, Ben Zhong Siloles symmetrically substituted on their 2,5-positions with electron-accepting and donating moieties: facile synthesis, aggregation-enhanced emission, solvatochromism, and device application Chemical Science, 2012, 3, 549 |
| 1514949 | CIF | C32 H26 O2 Si | P b c a | 21.7477; 13.4689; 35.5044 90; 90; 90 | 10399.9 | Mei, Ju; Wang, Jian; Sun, Jing Zhi; Zhao, Hui; Yuan, Wangzhang; Deng, Chunmei; Chen, Shuming; Sung, Herman H. Y.; Lu, Ping; Qin, Anjun; Kwok, Hoi Sing; Ma, Yuguang; Williams, Ian D.; Tang, Ben Zhong Siloles symmetrically substituted on their 2,5-positions with electron-accepting and donating moieties: facile synthesis, aggregation-enhanced emission, solvatochromism, and device application Chemical Science, 2012, 3, 549 |
| 1514950 | CIF | C54 H44 N2 Si | P 1 21/c 1 | 20.3587; 11.0369; 18.2729 90; 93.111; 90 | 4099.8 | Mei, Ju; Wang, Jian; Sun, Jing Zhi; Zhao, Hui; Yuan, Wangzhang; Deng, Chunmei; Chen, Shuming; Sung, Herman H. Y.; Lu, Ping; Qin, Anjun; Kwok, Hoi Sing; Ma, Yuguang; Williams, Ian D.; Tang, Ben Zhong Siloles symmetrically substituted on their 2,5-positions with electron-accepting and donating moieties: facile synthesis, aggregation-enhanced emission, solvatochromism, and device application Chemical Science, 2012, 3, 549 |
| 1514951 | CIF | C28 H42 F6 N O6 P | C 1 c 1 | 13.4798; 24.491; 11.104 90; 122.469; 90 | 3092.8 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514952 | CIF | C29 H44 F6 N O6 P | P 1 21/c 1 | 13.7552; 13.8563; 16.5085 90; 96.093; 90 | 3128.7 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514953 | CIF | C30 H46 F6 N O6 P | P 1 21/c 1 | 8.538; 33.09; 11.751 90; 97.9; 90 | 3288 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514954 | CIF | C30 H46 F6 N O7 P | P 1 21/c 1 | 8.702; 32.962; 11.4583 90; 93.616; 90 | 3280.1 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514955 | CIF | C29 H46 F6 N O6 P | P 1 21/c 1 | 15.9763; 13.6353; 15.3457 90; 104.633; 90 | 3234.5 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514956 | CIF | C30 H48 F6 N O7 P | P 1 21 1 | 8.3591; 33.576; 12.1989 90; 99.083; 90 | 3380.9 | Dasgupta, Suvankar; Wu, Jishan Formation of [2]rotaxanes by encircling [20], [21] and [22]crown ethers onto the dibenzylammonium dumbbell Chemical Science, 2012, 3, 425 |
| 1514957 | CIF | C33 H16 O S4 | P -1 | 11.03; 12.159; 12.875 112.013; 104.449; 96.026 | 1511.8 | Isla, Helena; Grimm, Bruno; Pérez, Emilio M.; Rosario Torres, M.; Ángeles Herranz, M.; Viruela, Rafael; Aragó, Juan; Ortí, Enrique; M. Guldi, Dirk; Martín, Nazario Bowl-shape electron donors with absorptions in the visible range of the solar spectrum and their supramolecular assemblies with C60 Chemical Science, 2012, 3, 498 |
| 1514958 | CIF | C48 H46 Br2 N4 O2 | I 41/a c d :2 | 23.2637; 23.2637; 62.003 90; 90; 90 | 33556 | Nakamura, Shoichi; Hiroto, Satoru; Shinokubo, Hiroshi Synthesis and oxidation of cyclic tetraindole Chemical Science, 2012, 3, 524 |
| 1514959 | CIF | C54 H52 N4 O2 | I -4 c 2 | 17.198; 17.198; 15.807 90; 90; 90 | 4675 | Nakamura, Shoichi; Hiroto, Satoru; Shinokubo, Hiroshi Synthesis and oxidation of cyclic tetraindole Chemical Science, 2012, 3, 524 |
| 1514960 | CIF | C26 H30 B2 F8 Fe N10 O2 | I 41/a :2 | 13.7494; 13.7494; 35.336 90; 90; 90 | 6680.1 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514961 | CIF | C26 H26 B2 F8 Fe N10 | P 42/n :2 | 9.7481; 9.7481; 17.6848 90; 90; 90 | 1680.51 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514962 | CIF | C26 H26 B2 F8 Fe N10 | P 42/n :2 | 9.8046; 9.8046; 17.8869 90; 90; 90 | 1719.47 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514963 | CIF | C14 H17 N5 O | P 21 21 21 | 10.064; 11.6546; 12.3944 90; 90; 90 | 1453.76 | Roberts, Thomas D.; Tuna, Floriana; Malkin, Tamsin L.; Kilner, Colin A.; Halcrow, Malcolm A. An iron(ii) complex exhibiting five anhydrous phases, two of which interconvert by spin-crossover with wide hysteresis Chemical Science, 2012, 3, 349 |
| 1514964 | CIF | C13 H12 B F2 N3 | P -1 | 7.4169; 8.3781; 11.0339 70.296; 73.131; 71.441 | 598.943 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514965 | CIF | C13 H9 B F2 N4 | P 1 21/c 1 | 12.6822; 6.9729; 13.8314 90; 95.138; 90 | 1218.2 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514966 | CIF | C14 H12 B F2 N3 O | P 1 21/c 1 | 13.589; 11.4482; 8.7135 90; 105.519; 90 | 1306.1 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514967 | CIF | C15 H14 B F2 N3 O2 | P 1 21/c 1 | 14.589; 11.456; 8.6272 90; 90.271; 90 | 1441.9 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2–hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514968 | CIF | C17 H11 B F2 N4 | P -1 | 7.7978; 8.4159; 25.529 91.862; 95.446; 117.248 | 1477.3 | Yang, Yin; Su, Xin; Carroll, Calden N.; Aprahamian, Ivan Aggregation-induced emission in BF2‒hydrazone (BODIHY) complexes Chemical Science, 2012, 3, 610 |
| 1514969 | CIF | C56 H48 Ag2 F12 N12 O4 P2 | P 1 2/c 1 | 14.883; 11.843; 19.893 90; 118.38; 90 | 3085 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514970 | CIF | C56 H48 Ag2 B Cl F4 N12 O4 | P 6 2 2 | 22.2009; 22.2009; 12.58554 90; 90; 120 | 5372.09 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514971 | CIF | C90 H84 Ag3 B3 F12 N18 O6 | P 63 | 17.3366; 17.3366; 18.9739 90; 90; 120 | 4938.73 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514972 | CIF | C90 H84 Ag3 B3 F12 N18 O6 | P 63 | 17.3399; 17.3399; 18.6738 90; 90; 120 | 4862.47 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514973 | CIF | C90 H84 Ag3 N18 O6 | P 63 | 17.2761; 17.2761; 18.7097 90; 90; 120 | 4836.03 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514974 | CIF | C90 H84 Au3 B3 F12 N18 O6 | P 63 | 17.4164; 17.4164; 18.8187 90; 90; 120 | 4943.53 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514975 | CIF | C71 H93 Ag3 Cl4 F12 N18 O8 P2 | P 1 | 12.6553; 13.0092; 15.1663 104.239; 112.9; 99.765 | 2128.75 | Wei, Siping; Li, Xiyu; Yang, Zhuang; Lan, Jingbo; Gao, Ge; Xue, Ying; You, Jingsong Ligand-switching and counteranion-induced hierarchical self-assembly of silver-NHC complexes Chemical Science, 2012, 3, 359 |
| 1514976 | CIF | C16 H20 N2 O6 | P 21 21 21 | 7.95486; 10.00542; 20.80472 90; 90; 90 | 1655.88 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514977 | CIF | C18 H24 N2 O7 | P 21 21 21 | 5.5811; 12.5943; 26.723 90; 90; 90 | 1878.4 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514978 | CIF | C17 H22 N2 O6 | P 1 21 1 | 10.1928; 6.6518; 12.7044 90; 93.098; 90 | 860.11 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514979 | CIF | C18 H24 N2 O7 | P 1 21/c 1 | 12.8847; 5.6274; 25.767 90; 92.776; 90 | 1866.1 | Rajkumar, Sundaram; Shankland, Kenneth; Brown, Geoffrey D.; Cobb, Alexander J. A. Organocatalytic enantioselective construction of nitrocyclohexanes containing multiple chiral centres via a cascade reaction Chemical Science, 2012, 3, 584 |
| 1514980 | CIF | C31 H28 Fe O6 Pt S4 | P 1 21/n 1 | 14.6379; 11.5625; 18.7162 90; 96.152; 90 | 3149.5 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514981 | CIF | C47 H60 Co O9.75 Pt S4 | I 1 2/a 1 | 22.814; 16.6711; 23.2989 90; 92.135; 90 | 8855.2 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514982 | CIF | C28 H22 Co O5 Pt S4 | P 1 c 1 | 11.3784; 11.822; 22.0722 90; 90.429; 90 | 2969 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514983 | CIF | C32.35 H29.7 Ni O6.09 Pt S4 | I -4 c 2 | 19.0697; 19.0697; 22.6005 90; 90; 90 | 8218.7 | Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H. Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions Chemical Science, 2012, 3, 602 |
| 1514984 | CIF | C35 H41 B O7 | P -1 | 8.0671; 12.5459; 15.4229 83.045; 83.617; 81.899 | 1526.94 | Gong, Wei; Singidi, Ramakrishna Reddy; Gallucci, Judith C.; RajanBabu, T. V. On the stereochemistry of acetylide additions to highly functionalized biphenylcarbaldehydes and multi-component cyclization of 1,n-diynes. Syntheses of dibenzocyclooctadiene lignans Chemical Science, 2012, 3, 1221 |
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