# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T20:48:17+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Catalysis Science & Technology') AND volume = 3 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1547383","9.0107","0.0006","22.8169","0.0016","25.9541","0.0017","90","","90","","90","","5336.1","0.6","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C57 H61 Au Cl4 O3 P -","- C57 H61 Au Cl4 O3 P -","- C228 H244 Au4 Cl16 O12 P4 -","4","1","","Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena","Modular chiral gold(i) phosphite complexes","Catalysis Science & Technology","2013","3","","3007","3012","10.1039/c3cy00250k","","","0.71073","MoKα","","0.0834","0.0511","","","0.1045","0.1164","","","","","","1.02","","","","has coordinates","201356","2020-10-21","18:00:00",""
"1547384","9.7873","0.0003","12.8393","0.0004","39.6173","0.0013","90","","90","","90","","4978.4","0.3","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C62 H45 Au Cl O3 P Si2 -","- C62 H45 Au Cl O3 P Si2 -","- C248 H180 Au4 Cl4 O12 P4 Si8 -","4","1","","Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena","Modular chiral gold(i) phosphite complexes","Catalysis Science & Technology","2013","3","","3007","3012","10.1039/c3cy00250k","","","0.71073","MoKα","","0.0389","0.036","","","0.0841","0.085","","","","","","1.118","","","","has coordinates","288243","2023-12-12","09:57:13",""
"1547385","13.2861","0.0014","13.2861","0.0014","14.7974","0.0015","90","","90","","90","","2612","0.5","100","2","100","2","","","","","","","","6","P 41","P 4w","76","","","","- C32 H25 Au Cl Fe P -","- C32 H25 Au Cl Fe P -","- C128 H100 Au4 Cl4 Fe4 P4 -","4","1","","Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena","Modular chiral gold(i) phosphite complexes","Catalysis Science & Technology","2013","3","","3007","3012","10.1039/c3cy00250k","","","0.71073","MoKα","","0.0302","0.0287","","","0.0788","0.0805","","","","","","0.864","","","","has coordinates","288243","2023-12-12","09:57:13",""
"1547386","9.7478","0.0014","9.7478","0.0014","23.296","0.003","90","","90","","120","","1917","0.5","100","2","100","2","","","","","","","","6","P 31","P 31","144","","","","- C28 H33 Au Cl Fe P -","- C28 H33 Au Cl Fe P -","- C84 H99 Au3 Cl3 Fe3 P3 -","3","1","","Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena","Modular chiral gold(i) phosphite complexes","Catalysis Science & Technology","2013","3","","3007","3012","10.1039/c3cy00250k","","","0.71073","MoKα","","0.0496","0.0483","","","0.1219","0.1231","","","","","","1.063","","","","has coordinates","288243","2023-12-12","09:57:13",""
"1547387","9.6442","0.0011","15.8547","0.0015","17.74","0.002","90","","90","","90","","2712.6","0.5","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H38 Fe O S -","- C32 H38 Fe O S -","- C128 H152 Fe4 O4 S4 -","4","1","","Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena","Modular chiral gold(i) phosphite complexes","Catalysis Science & Technology","2013","3","","3007","3012","10.1039/c3cy00250k","","","0.71073","MoKα","","0.0532","0.0439","","","0.1062","0.1108","","","","","","1.035","","","","has coordinates","288243","2023-12-12","09:57:13",""
"1547388","19.461","0.002","9.2739","0.0011","20.008","0.002","90","","112.325","0.002","90","","3340.4","0.6","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C30 H57 Au Cl O3 P -","- C30 H57 Au Cl O3 P -","- C120 H228 Au4 Cl4 O12 P4 -","4","1","","Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena","Modular chiral gold(i) phosphite complexes","Catalysis Science & Technology","2013","3","","3007","3012","10.1039/c3cy00250k","","","0.71073","MoKα","","0.0805","0.0687","","","0.1694","0.1771","","","","","","1.048","","","","has coordinates","288243","2023-12-12","09:57:13",""
"1547389","11.6873","0.0011","13.7576","0.0019","34.499","0.004","90","","90","","90","","5547.1","1.1","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C63 H47 O4 P Si2 -","- C63 H47 O4 P Si2 -","- C252 H188 O16 P4 Si8 -","4","1","","Nicolas Delpont; Imma Escofet; Patricia Perez-Galen; Dirk Spiegl; Mihai Raducan; Christophe Bour; Riccardo Sinisi; Antonio M. Echavarrena","Modular chiral gold(i) phosphite complexes","Catalysis Science & Technology","2013","3","","3007","3012","10.1039/c3cy00250k","","","1.54178","CuKα","","0.0678","0.0597","","","0.1597","0.1652","","","","","","1.269","","","","has coordinates,has disorder","288243","2023-12-12","09:57:13",""
"1556325","8.1051","0.0008","11.1155","0.0009","22.6264","0.0006","77.784","0.005","89.987","0.004","71.894","0.003","1888.9","0.3","180","2","180","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C15 H29 Cl2 N3 Pd -","- C15 H29 Cl2 N3 Pd -","- C60 H116 Cl8 N12 Pd4 -","4","2","","Peral, Daniel; Gómez-Villarraga, Fernando; Sala, Xavier; Pons, Josefina; Carles Bayón, J.; Ros, Josep; Guerrero, Miguel; Vendier, Laure; Lecante, Pierre; García-Antón, Jordi; Philippot, Karine","Palladium catalytic systems with hybrid pyrazole ligands in C‒C coupling reactions. Nanoparticles versus molecular complexes","Catal. Sci. Technol.","2013","3","2","475","","10.1039/C2CY20517C","","","0.71073","MoKα","","0.0182","0.0161","","","0.0393","0.0409","","","","","","1.085","","","","has coordinates","244215","2020-10-21","18:00:00",""
"1556326","8.1752","0.0008","15.2655","0.0006","15.457","0.001","94.321","0.007","90.451","0.005","93.185","0.004","1920.4","0.2","180","2","180","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C15 H28 Cl2 N2 Pd S -","- C15 H28 Cl2 N2 Pd S -","- C60 H112 Cl8 N8 Pd4 S4 -","4","2","","Peral, Daniel; Gómez-Villarraga, Fernando; Sala, Xavier; Pons, Josefina; Carles Bayón, J.; Ros, Josep; Guerrero, Miguel; Vendier, Laure; Lecante, Pierre; García-Antón, Jordi; Philippot, Karine","Palladium catalytic systems with hybrid pyrazole ligands in C‒C coupling reactions. Nanoparticles versus molecular complexes","Catal. Sci. Technol.","2013","3","2","475","","10.1039/C2CY20517C","","","0.71073","MoKα","","0.0272","0.0225","","","0.0548","0.0585","","","","","","1.057","","","","has coordinates","244215","2020-10-21","18:00:00",""
"1556327","8.1693","0.0008","9.1162","0.001","22.9935","0.0007","93.592","0.003","91.806","0.005","89.939","0.006","1708.2","0.3","180","2","180","2","","","","","","","synthesis as described","6","P 1","P 1","1","","","","- C30 H56 Cl2 N4 O2 Pd -","- C30 H56 Cl2 N4 O2 Pd -","- C60 H112 Cl4 N8 O4 Pd2 -","2","2","","Peral, Daniel; Gómez-Villarraga, Fernando; Sala, Xavier; Pons, Josefina; Carles Bayón, J.; Ros, Josep; Guerrero, Miguel; Vendier, Laure; Lecante, Pierre; García-Antón, Jordi; Philippot, Karine","Palladium catalytic systems with hybrid pyrazole ligands in C‒C coupling reactions. Nanoparticles versus molecular complexes","Catal. Sci. Technol.","2013","3","2","475","","10.1039/C2CY20517C","","x-ray","0.71073","MoKα","","0.1022","0.0759","","","0.1632","0.182","","","","","","1.016","","","","has coordinates","244215","2020-10-21","18:00:00",""
"1556328","15.7877","0.001","21.0937","0.0013","8.109","0.0005","90","","102.061","0.003","90","","2640.9","0.3","180","2","180","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H45 Cl2 N3 Pd -","- C23 H45 Cl2 N3 Pd -","- C92 H180 Cl8 N12 Pd4 -","4","1","","Peral, Daniel; Gómez-Villarraga, Fernando; Sala, Xavier; Pons, Josefina; Carles Bayón, J.; Ros, Josep; Guerrero, Miguel; Vendier, Laure; Lecante, Pierre; García-Antón, Jordi; Philippot, Karine","Palladium catalytic systems with hybrid pyrazole ligands in C‒C coupling reactions. Nanoparticles versus molecular complexes","Catal. Sci. Technol.","2013","3","2","475","","10.1039/C2CY20517C","","","0.71073","MoKα","","0.0553","0.0311","","","0.0593","0.0682","","","","","","1.074","","","","has coordinates","244215","2020-10-21","18:00:00",""
"1556329","17.8598","0.0014","10.775","0.0008","31.054","0.002","90","","101.73","0.004","90","","5851.2","0.7","120","2","120","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","Compound 2","","","- C66 H64 Cl2 N4 O7.5 V2 -","- C66 H64 Cl2 N4 O7.5 V2 -","- C264 H256 Cl8 N16 O30 V8 -","4","1","","Clowes, Lucy; Walton, Mark; Redshaw, Carl; Chao, Yimin; Walton, Alex; Elo, Pertti; Sumerin, Victor; Hughes, David L.","Vanadium(iii) phenoxyimine complexes for ethylene or ε-caprolactone polymerization: mononuclear versus binuclear pre-catalysts","Catal. Sci. Technol.","2013","3","1","152","","10.1039/C2CY20571H","","","0.71073","MoKα","","0.1007","0.0653","","","0.1159","0.1271","","","","","","1.037","","","","has coordinates,has disorder","244216","2020-10-21","18:00:00",""
"1556330","9.6297","0.0003","12.1792","0.0004","16.2276","0.0006","90","","100.851","0.004","90","","1869.18","0.11","140","1","140","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Compound L5","","","- C44 H56 N2 O2 -","- C44 H56 N2 O2 -","- C88 H112 N4 O4 -","2","0.5","","Clowes, Lucy; Walton, Mark; Redshaw, Carl; Chao, Yimin; Walton, Alex; Elo, Pertti; Sumerin, Victor; Hughes, David L.","Vanadium(iii) phenoxyimine complexes for ethylene or ε-caprolactone polymerization: mononuclear versus binuclear pre-catalysts","Catal. Sci. Technol.","2013","3","1","152","","10.1039/C2CY20571H","","","0.71073","Mo-Kα","","0.1056","0.0498","","","0.0835","0.0958","","","","","","0.926","","","","has coordinates","244216","2020-10-21","18:00:00",""
"1556331","15.4851","0.0003","12.3449","0.0002","33.0323","0.0006","90","","90","","90","","6314.5","0.2","140","1","140","1","","","","","","","","6","P b c a","-P 2ac 2ab","61","Compound 5","","","- C60 H86 Cl4 N2 O6 V2 -","- C60 H86 Cl4 N2 O6 V2 -","- C240 H344 Cl16 N8 O24 V8 -","4","0.5","","Clowes, Lucy; Walton, Mark; Redshaw, Carl; Chao, Yimin; Walton, Alex; Elo, Pertti; Sumerin, Victor; Hughes, David L.","Vanadium(iii) phenoxyimine complexes for ethylene or ε-caprolactone polymerization: mononuclear versus binuclear pre-catalysts","Catal. Sci. Technol.","2013","3","1","152","","10.1039/C2CY20571H","","","0.71073","Mo-Kα","","0.0867","0.0612","","","0.1045","0.1129","","","","","","1.199","","","","has coordinates,has disorder","244216","2020-10-21","18:00:00",""
"1556332","11.0873","0.0005","17.9157","0.0008","20.6832","0.0014","90","","90","","90","","4108.4","0.4","100","","100","","","","","","","","","6","P 21 n b","P -2bc 2a","33","Compound 13","","","- C42 H52 Cl2 N4 O3 V -","- C42 H52 Cl2 N4 O3 V -","- C168 H208 Cl8 N16 O12 V4 -","4","1","","Clowes, Lucy; Walton, Mark; Redshaw, Carl; Chao, Yimin; Walton, Alex; Elo, Pertti; Sumerin, Victor; Hughes, David L.","Vanadium(iii) phenoxyimine complexes for ethylene or ε-caprolactone polymerization: mononuclear versus binuclear pre-catalysts","Catal. Sci. Technol.","2013","3","1","152","","10.1039/C2CY20571H","","","0.71075","MoKα","","0.0776","0.0505","","","0.0899","0.0978","","","","","","1.043","","","","has coordinates","244216","2020-10-21","18:00:00",""
"1556333","14.483","0.002","14.483","0.002","58.042","0.012","90","","90","","90","","12175","3","200","2","200","2","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C54 H84 B Cl2 F4 P6 Rh3 -","- C54 H84 B Cl2 F4 P6 Rh3 -","- C432 H672 B8 Cl16 F32 P48 Rh24 -","8","1","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.0326","0.0251","","","0.0423","0.0432","","","","","","0.876","","","","has coordinates","244217","2020-10-21","18:00:00",""
"1556334","13.136","0.003","13.405","0.003","14.779","0.003","85.58","0.03","68.44","0.03","68.06","0.03","2239.6","1.1","200","2","200","2","","","","","","","","8","P 1","P 1","1","","","","- C85 H86 B Cl4 F4 O6 P6 Rh3 -","- C85 H86 B Cl4 F4 O6 P6 Rh3 -","- C85 H86 B Cl4 F4 O6 P6 Rh3 -","1","1","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.0611","0.053","","","0.1311","0.1332","","","","","","1.017","","","","has coordinates,has disorder","244217","2020-10-21","18:00:00",""
"1556335","14.1975","0.0005","16.3823","0.0004","20.5561","0.0005","90","","90","","90","","4781.1","0.2","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C44 H72 Cl2 P4 Rh2 -","- C44 H72 Cl2 P4 Rh2 -","- C176 H288 Cl8 P16 Rh8 -","4","1","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.0213","0.0184","","","0.0377","0.0381","","","","","","0.908","","","","has coordinates","244217","2020-10-21","18:00:00",""
"1556336","16.493","0.003","23.276","0.005","16.775","0.003","90","","118.1","0.03","90","","5681","2","200","2","200","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C135 H100 Cl6 F3 O3 P6 Rh3 S -","- C135 H100 Cl6 F3 O3 P6 Rh3 S -","- C270 H200 Cl12 F6 O6 P12 Rh6 S2 -","2","1","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.1018","0.0424","","","0.0617","0.0745","","","","","","0.554","","","","has coordinates,has disorder","244217","2020-10-21","18:00:00",""
"1556337","16.431","0.003","20.348","0.004","21.116","0.004","90","","90","","90","","7060","2","200","2","200","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C54 H84 B Br0.8 Cl1.2 F4 P6 Rh3 -","- C54 H84 B Br0.8 Cl1.2 F4 P6 Rh3 -","- C216 H336 B4 Br3.2 Cl4.8 F16 P24 Rh12 -","4","1","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.0321","0.0229","","","0.042","0.043","","","","","","0.769","","","","has coordinates,has disorder","244217","2020-10-21","18:00:00",""
"1556338","11.2912","0.0006","16.6047","0.0006","11.4464","0.0005","90","","105.766","0.004","90","","2065.32","0.17","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C36 H56 Br2 P4 Rh2 -","- C36 H56 Br2 P4 Rh2 -","- C72 H112 Br4 P8 Rh4 -","2","1","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.0204","0.0198","","","0.0498","0.05","","","","","","1.04","","","","has coordinates","244217","2020-10-21","18:00:00",""
"1556339","12.416","0.003","12.444","0.003","18.186","0.004","95.81","0.03","94.37","0.03","111.98","0.03","2572.3","1.2","200","2","200","2","","","","","","","","7","P 1","P 1","1","","","","- C36 H86 B F4 O2 P6 Rh3 -","- C36 H84 B F4 O2 P6 Rh3 -","- C72 H168 B2 F8 O4 P12 Rh6 -","2","2","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.0324","0.0256","","","0.0513","0.052","","","","","","0.971","","","","has coordinates,has disorder","244217","2020-10-21","18:00:00",""
"1556340","9.6676","0.0019","12.005","0.002","12.658","0.003","109.83","0.03","94.19","0.03","90.56","0.03","1377.3","0.6","150","2","150","2","","","","","","","","7","P 1","P 1","1","","","","- C37 H86 B Cl4 F4 P6 Rh3 -","- C37 H86 B Cl4 F4 P6 Rh3 -","- C37 H86 B Cl4 F4 P6 Rh3 -","1","1","","Preetz, Angelika; Kohrt, Christina; Meißner, Antje; Wei, Siping; Drexler, Hans-Joachim; Buschmann, Helmut; Heller, Detlef","Halide bridged trinuclear rhodium complexes and their inhibiting influence on catalysis","Catal. Sci. Technol.","2013","3","2","462","","10.1039/C2CY20591B","","","0.71073","MoKα","","0.0274","0.0236","","","0.0486","0.049","","","","","","0.991","","","","has coordinates,has disorder","244217","2020-10-21","18:00:00",""
"1556341","29.0844","0.001","15.042","0.0005","16.3344","0.0006","90","","108.315","0.002","90","","6784.1","0.4","100","2","100","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C30.5 H30 Cl2 F6 N6 O3 P2 Ru -","- C30.5 H30 Cl2 F6 N6 O3 P2 Ru -","- C244 H240 Cl16 F48 N48 O24 P16 Ru8 -","8","1","","Vaquer, Lydia; Riente, Paola; Sala, Xavier; Jansat, Susanna; Benet-Buchholz, Jordi; Llobet, Antoni; Pericàs, Miquel A.","Molecular ruthenium complexes anchored on magnetic nanoparticles that act as powerful and magnetically recyclable stereospecific epoxidation catalysts","Catal. Sci. Technol.","2013","3","3","706","","10.1039/C2CY20616A","","","0.71073","MoKα","","0.0471","0.0349","","","0.0798","0.0858","","","","","","1.026","","","","has coordinates,has disorder","244218","2020-10-21","18:00:00",""
"1556342","10.9643","0.0007","11.9921","0.0008","15.491","0.0015","110.491","0.005","99.026","0.004","107.666","0.003","1737.2","0.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30.5 H30.5 Cl2 F6 N6 O3.25 P2 Ru -","- C30.5 H30.5 Cl2 F6 N6 O3.25 P2 Ru -","- C61 H61 Cl4 F12 N12 O6.5 P4 Ru2 -","2","1","","Vaquer, Lydia; Riente, Paola; Sala, Xavier; Jansat, Susanna; Benet-Buchholz, Jordi; Llobet, Antoni; Pericàs, Miquel A.","Molecular ruthenium complexes anchored on magnetic nanoparticles that act as powerful and magnetically recyclable stereospecific epoxidation catalysts","Catal. Sci. Technol.","2013","3","3","706","","10.1039/C2CY20616A","","","0.71073","MoKα","","0.0622","0.0502","","","0.1284","0.1367","","","","","","1.028","","","","has coordinates,has disorder","244218","2020-10-21","18:00:00",""
"1556343","13.6143","0.0003","13.6143","0.0003","38.6616","0.0008","90","","90","","90","","7165.9","0.3","100","","100","","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C80 H102 Al Cl N4 O6 S2 -","- C80 H102 Al Cl N4 O6 S2 -","- C320 H408 Al4 Cl4 N16 O24 S8 -","4","0.5","","Ternel, Jérémy; Roussel, Pascal; Agbossou-Niedercorn, Francine; Gauvin, Régis M.","Dismantling the salen framework: design of new asymmetric silylcyanation catalysts","Catal. Sci. Technol.","2013","3","3","580","","10.1039/C2CY20818K","","","0.71073","MoKα","","0.1165","0.0828","","0.172","0.0849","0.0751","","","","","","1.0916","","","","has coordinates","244219","2020-10-21","18:00:00",""
"1556371","7.129","0.003","11.454","0.005","19.387","0.009","90","","90","","90","","1583.1","1.2","273","2","273","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H15 Cl N4 O3 -","- C17 H15 Cl N4 O3 -","- C68 H60 Cl4 N16 O12 -","4","1","","Siddiqui, Zeba N.; Khan, Tabassum","P2O5/SiO2 as an efficient heterogeneous catalyst for the synthesis of heterocyclic alkene derivatives under thermal solvent-free conditions","Catalysis Science & Technology","2013","3","8","2032","","10.1039/c3cy00095h","","","0.71073","MoKα","","0.1887","0.1524","","","0.3606","0.3845","","","","","","1.184","","","","has coordinates","244406","2020-10-21","18:00:00",""
"1556372","10.53","0.003","10.579","0.003","10.773","0.004","109.248","0.002","93.156","0.002","106.287","0.002","1073","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Tetrakis(μ-2-methylbenzoato)bis[(2-methylbenzoic acid)copper(II)]","","- C48 H44 Cu2 O12 -","- C48 H44 Cu2 O12 -","- C48 H44 Cu2 O12 -","1","0.5","","Sunil, Abraham C.; Langner, Ernst H. G.; Marais, Charlene; Bezuidenhoudt, Barend C. B.","Thermo-analytical determination of intermediates in the copper catalysed rearrangement of o-toluic acid to meta-cresol","Catalysis Science & Technology","2013","3","9","2227","","10.1039/c3cy00119a","","","0.71069","MoKα","","","0.0258","","","","0.0653","","","","","","1.048","","","","has coordinates","244407","2020-10-21","18:00:00",""
"1556373","14.2034","0.0007","11.5066","0.0007","14.6836","0.0011","90","","90","","90","","2399.8","0.3","173","2","173","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C19 H24 Br2 Cl2 N4 Ni -","- C19 H24 Br2 Cl2 N4 Ni -","- C76 H96 Br8 Cl8 N16 Ni4 -","4","0.5","","Budhai, Asheena; Omondi, Bernard; Ojwach, Stephen O.; Obuah, Collins; Osei-Twum, Emmanuel Y.; Darkwa, James","Tandem ethylene oligomerisation and Friedel‒Crafts alkylation of toluene catalysed by bis-(3,5-dimethylpyrazol-1-ylmethyl)benzene nickel(ii) complexes and ethylaluminium dichloride","Catalysis Science & Technology","2013","3","12","3130","","10.1039/c3cy00334e","","","0.71073","MoKα","","0.0473","0.0445","","","0.1204","0.1225","","","","","","1.06","","","","has coordinates","244408","2020-10-21","18:00:00",""
"1556374","9.2765","0.0005","10.7428","0.0005","12.1287","0.0006","110.976","0.003","96.346","0.003","113.712","0.003","986.47","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 Cl2 N4 Ni -","- C18 H22 Cl2 N4 Ni -","- C36 H44 Cl4 N8 Ni2 -","2","1","","Budhai, Asheena; Omondi, Bernard; Ojwach, Stephen O.; Obuah, Collins; Osei-Twum, Emmanuel Y.; Darkwa, James","Tandem ethylene oligomerisation and Friedel‒Crafts alkylation of toluene catalysed by bis-(3,5-dimethylpyrazol-1-ylmethyl)benzene nickel(ii) complexes and ethylaluminium dichloride","Catalysis Science & Technology","2013","3","12","3130","","10.1039/c3cy00334e","","","0.71073","MoKα","","0.0398","0.0329","","","0.0893","0.0928","","","","","","1.047","","","","has coordinates","244408","2020-10-21","18:00:00",""
"1556375","9.3446","0.0018","14.994","0.003","15.681","0.003","75.599","0.01","78.411","0.01","81.522","0.011","2073.7","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 Br2 N4 Ni -","- C18 H22 Br2 N4 Ni -","- C72 H88 Br8 N16 Ni4 -","4","2","","Budhai, Asheena; Omondi, Bernard; Ojwach, Stephen O.; Obuah, Collins; Osei-Twum, Emmanuel Y.; Darkwa, James","Tandem ethylene oligomerisation and Friedel‒Crafts alkylation of toluene catalysed by bis-(3,5-dimethylpyrazol-1-ylmethyl)benzene nickel(ii) complexes and ethylaluminium dichloride","Catalysis Science & Technology","2013","3","12","3130","","10.1039/c3cy00334e","","","0.71073","MoKα","","0.1531","0.0554","","","0.1175","0.1563","","","","","","0.913","","","","has coordinates","244408","2020-10-21","18:00:00",""
"1556376","9.6013","0.0019","16.927","0.003","24.799","0.005","90","","100.77","0.03","90","","3959.4","1.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H41 Br2 Cl N2 Ni -","- C45 H41 Br2 Cl N2 Ni -","- C180 H164 Br8 Cl4 N8 Ni4 -","4","1","","Jia, Dedong; Zhang, Wenjuan; Liu, Weiliang; Wang, Lin; Redshaw, Carl; Sun, Wen-Hua","Unsymmetrical α-diiminonickel bromide complexes: synthesis, characterization and their catalytic behavior toward ethylene","Catalysis Science & Technology","2013","3","10","2737","","10.1039/c3cy00422h","","","0.71073","MoKα","","","0.0668","","","0.1943","0.2163","","","","","","1.079","","","","has coordinates","244409","2020-10-21","18:00:00",""
"1556377","9.922","0.002","16.84","0.003","24.975","0.005","90","","98.41","0.03","90","","4128.1","1.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H45 Br2 Cl N2 Ni -","- C47 H44 Br2 Cl N2 Ni -","- C188 H176 Br8 Cl4 N8 Ni4 -","4","1","","Jia, Dedong; Zhang, Wenjuan; Liu, Weiliang; Wang, Lin; Redshaw, Carl; Sun, Wen-Hua","Unsymmetrical α-diiminonickel bromide complexes: synthesis, characterization and their catalytic behavior toward ethylene","Catalysis Science & Technology","2013","3","10","2737","","10.1039/c3cy00422h","","","0.71073","MoKα","","","0.0979","","","0.2363","0.2722","","","","","","1.193","","","","has coordinates","244409","2020-10-21","18:00:00",""
"1556378","9.6343","0.0006","9.6463","0.0007","14.2834","0.0008","76.36","0.006","88.829","0.005","63.062","0.007","1144.29","0.15","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C25 H35 N3 Zn -","- C25 H35 N3 Zn -","- C50 H70 N6 Zn2 -","2","1","","Dai, Zhongran; Zhang, Jinjin; Gao, Yuan; Tang, Ning; Huang, Yong; Wu, Jincai","Synthesis and structures of tridentate β-diketiminato zinc phenoxides as catalysts for immortal ring-opening polymerization of l-lactide","Catalysis Science & Technology","2013","3","12","3268","","10.1039/c3cy00482a","","","0.7107","MoKα","","0.0291","0.0267","","","0.0642","0.0658","","","","","","1.007","","","","has coordinates","244410","2020-10-21","18:00:00",""
"1556379","12.765","0.006","16.025","0.014","13.594","0.01","90","","98.6","0.06","90","","2750","3","99.97","0.15","99.97","0.15","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H39 N3 O Zn -","- C31 H39 N3 O Zn -","- C124 H156 N12 O4 Zn4 -","4","1","","Dai, Zhongran; Zhang, Jinjin; Gao, Yuan; Tang, Ning; Huang, Yong; Wu, Jincai","Synthesis and structures of tridentate β-diketiminato zinc phenoxides as catalysts for immortal ring-opening polymerization of l-lactide","Catalysis Science & Technology","2013","3","12","3268","","10.1039/c3cy00482a","","","0.7107","MoKα","","0.0544","0.0393","","","0.0875","0.1001","","","","","","1.028","","","","has coordinates","244410","2020-10-21","18:00:00",""
"1556380","10.889","0.0005","14.2911","0.0007","20.7227","0.0009","92.804","0.004","92.129","0.004","92.212","0.004","3216.1","0.3","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C35 H47 N3 O Zn -","- C35 H47 N3 O Zn -","- C140 H188 N12 O4 Zn4 -","4","2","","Dai, Zhongran; Zhang, Jinjin; Gao, Yuan; Tang, Ning; Huang, Yong; Wu, Jincai","Synthesis and structures of tridentate β-diketiminato zinc phenoxides as catalysts for immortal ring-opening polymerization of l-lactide","Catalysis Science & Technology","2013","3","12","3268","","10.1039/c3cy00482a","","","0.71073","MoKα","","0.115","0.0655","","","0.0986","0.111","","","","","","1.11","","","","has coordinates","275434","2022-05-16","05:31:58",""
"1556381","3.8864","0.0005","7.7824","0.0009","7.5103","0.0009","90","","98.573","0.002","90","","224.61","0.05","200","2","200","2","","","","","","","","5","P 1 2/m 1","-P 2y","10","","","","- C3 H5 Au Cl4 N2 -","- C3 H5 Au Cl4 N2 -","- C3 H5 Au Cl4 N2 -","1","0.25","","de Almeida, M. Peixoto; Martins, L. M. D. R. S.; Carabineiro, S. A. C.; Lauterbach, T.; Rominger, F.; Hashmi, A. S. K.; Pombeiro, A. J. L.; Figueiredo, J. L.","Homogeneous and heterogenised new gold C-scorpionate complexes as catalysts for cyclohexane oxidation","Catalysis Science & Technology","2013","3","11","3056","","10.1039/c3cy00552f","","","0.71073","MoKα","","0.013","0.013","","","0.0317","0.0317","","","","","","1.187","","","","has coordinates,has disorder","244411","2020-10-21","18:00:00",""
"1556382","5.8113","0.0002","23.7797","0.0008","9.2207","0.0003","90","","95.959","0.002","90","","1267.33","0.07","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C56 H64 N8 O8 -","4","1","","Ray, Suman; Bhaumik, Asim; Dutta, Arghya; Mukhopadhyay, Chhanda","Porous silica nanoparticles with mesoscopic void spaces for the domino intermolecular aerobic oxidative synthesis of novel β,β′-diketoenamines","Catalysis Science & Technology","2013","3","5","1267","","10.1039/c3cy20642d","","","0.71073","MoKα","","0.0509","0.0425","","","0.1251","0.1396","","","","","","0.646","","","","has coordinates","244412","2020-10-21","18:00:00",""
"1556383","20.8644","0.0004","20.8644","0.0004","52.9489","0.0013","90","","90","","120","","19961.8","0.7","150","2","150","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C99 H102 N9 O6 P Zn3 -","- C99 H102 N9 O6 P Zn3 -","- C792 H816 N72 O48 P8 Zn24 -","8","0.666667","","Jacobs, Ivo; van Duin, Adri C. T.; Kleij, Arjan W.; Kuil, Mark; Tooke, Duncan M.; Spek, Anthony L.; Reek, Joost N. H.","Conformational studies of ligand-template assemblies and the consequences for encapsulation of rhodium complexes and hydroformylation catalysis","Catalysis Science & Technology","2013","3","8","1955","","10.1039/c3cy20665c","","","0.71073","MoKα","","0.0746","0.0538","","","0.1105","0.1185","","","","","","1.179","","","","has coordinates","244413","2020-10-21","18:00:00",""
"1556384","12.2117","0.0003","20.6062","0.0004","23.4209","0.0005","90","","90.957","0.002","90","","5892.7","0.2","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25.63 H25.25 Cl3.25 Fe N6 O8 -","- C25.625 H25.25 Cl3.25 Fe N6 O8 -","- C205 H202 Cl26 Fe8 N48 O64 -","8","2","","Wong, Emma; Jeck, Jonathan; Grau, Michaela; White, Andrew J. P.; Britovsek, George J. P.","A strong-field pentadentate ligand in iron-based alkane oxidation catalysis and implications for iron(iv) oxo intermediates","Catalysis Science & Technology","2013","3","4","1116","","10.1039/c3cy20823k","","","0.71073","MoKα","","0.1246","0.0863","","","0.2159","0.2354","","","","","","1.037","","","","has coordinates,has disorder","244414","2020-10-21","18:00:00",""
"1556385","12.4043","0.0008","38.877","0.002","12.3737","0.001","90","","117.208","0.008","90","","5306.9","0.7","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H47 Cl4 Fe2 N11 O18 -","- C48 H45 Cl4 Fe2 N11 O18 -","- C192 H180 Cl16 Fe8 N44 O72 -","4","1","","Wong, Emma; Jeck, Jonathan; Grau, Michaela; White, Andrew J. P.; Britovsek, George J. P.","A strong-field pentadentate ligand in iron-based alkane oxidation catalysis and implications for iron(iv) oxo intermediates","Catalysis Science & Technology","2013","3","4","1116","","10.1039/c3cy20823k","","","0.71073","MoKα","","0.1683","0.0795","","","0.1365","0.1703","","","","","","0.979","","","","has coordinates,has disorder","244414","2020-10-21","18:00:00",""