# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-10-30T19:17:25+01:00
# 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 = 16 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
"1576219","10.305","0.0003","11.2133","0.0003","20.326","0.0006","87.874","0.001","82.5","0.001","68.349","0.001","2164.19","0.11","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H26 Cl Fe N2 O5 -","- C22 H26 Cl Fe N2 O5 -","- C88 H104 Cl4 Fe4 N8 O20 -","4","2","","Usman, Mohammad; Hussein, Mohamed A.T.; Kandiel, Tarek A.; Yamani, Zain H.; Shaikh, M. Nasiruzzaman","Catalytic ammonia oxidation mediated by high-spin Fe(iii) complex: combined experimental and DFT study","Catalysis Science & Technology","2026","16","1","124","136","10.1039/D5CY01107H","","x-ray","0.71073","MoKα","","0.0715","0.0609","","","0.1223","0.1267","","","","","","1.137","","","","has coordinates","304860","2026-03-05","12:09:45",""
"1576417","9.745","0.002","10.958","0.003","12.73","0.003","90","","98.973","0.005","90","","1342.7","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H17 Cl2 N Ru -","- C12 H17 Cl2 N Ru -","- C48 H68 Cl8 N4 Ru4 -","4","1","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.0836","0.0692","","","0.1599","0.1681","","","","","","1.2","","","","has coordinates,has disorder","305277","2026-04-05","11:33:38",""
"1576418","10.3192","0.0014","12.9409","0.0018","18.335","0.002","71.028","0.004","89.935","0.004","78.471","0.003","2263.3","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H22 Cl5 N O Ru -","- C19 H22 Cl5 N O Ru -","- C76 H88 Cl20 N4 O4 Ru4 -","4","2","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.0803","0.0669","","","0.162","0.1665","","","","","","1.216","","","","has coordinates","305277","2026-04-05","11:33:38",""
"1576419","8.2888","0.0009","12.657","0.0013","23.549","0.003","90","","98.116","0.004","90","","2445.8","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H32 Cl N Ru -","- C29 H32 Cl N Ru -","- C116 H128 Cl4 N4 Ru4 -","4","1","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.0587","0.0535","","","0.1047","0.1069","","","","","","1.193","","","","has coordinates","305277","2026-04-05","11:33:38",""
"1576420","9.1021","0.0006","11.0511","0.0008","18.3886","0.0013","90","","90","","90","","1849.7","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H23 Cl2 N Ru -","- C19 H23 Cl2 N Ru -","- C76 H92 Cl8 N4 Ru4 -","4","1","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.044","0.0426","","","0.0973","0.0979","","","","","","1.24","","","","has coordinates","305277","2026-04-05","11:33:38",""
"1576421","7.5945","0.0004","12.2445","0.0006","25.2295","0.0012","90","","91.324","0.002","90","","2345.5","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H34 Cl N Ru -","- C27 H34 Cl N Ru -","- C108 H136 Cl4 N4 Ru4 -","4","1","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.0485","0.043","","","0.093","0.0955","","","","","","1.113","","","","has coordinates","305277","2026-04-05","11:33:38",""
"1576422","25.2987","0.0009","17.9124","0.0006","8.3465","0.0003","90","","94.252","0.001","90","","3771.9","0.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C15.5 H22 Cl3 N O2 Ru -","- C15.5 H22 Cl3 N O2 Ru -","- C124 H176 Cl24 N8 O16 Ru8 -","8","1","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.0466","0.0459","","","0.1134","0.1137","","","","","","1.274","","","","has coordinates,has disorder","305277","2026-04-05","11:33:38",""
"1576423","7.3074","0.0004","12.8439","0.0007","22.1781","0.0013","90","","90","","90","","2081.5","0.2","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H29 Cl2 N O Ru -","- C21 H29 Cl2 N O Ru -","- C84 H116 Cl8 N4 O4 Ru4 -","4","1","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.0207","0.0206","","","0.053","0.0531","","","","","","1.145","","","","has coordinates","305277","2026-04-05","11:33:38",""
"1576424","9.7509","0.0006","16.0618","0.001","12.8319","0.0008","90","","99.133","0.002","90","","1984.2","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 I2 N Ru -","- C17 H25 I2 N Ru -","- C68 H100 I8 N4 Ru4 -","4","1","","Lapa, Hugo M.; del Rosso, Mattia; Zacchini, Stefano; Giarola, Greta; Alegria, Elisabete C. B. A.; Trzeciak, Anna M.; Marchetti, Fabio; Martins, Luísa M. D. R. S.; Biancalana, Lorenzo","Controlling alkyne dimerization and trimerization with ruthenium(ii) arene isocyanide catalysts","Catalysis Science & Technology","2026","16","5","1622","1653","10.1039/D5CY01493J","","","0.71073","MoKα","","0.0321","0.03","","","0.066","0.0667","","","","","","1.303","","","","has coordinates","305277","2026-04-05","11:33:38",""
"1576425","12.3464","0.0005","6.2562","0.0002","15.9702","0.0006","90","","110.806","0.002","90","","1153.12","0.08","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 Br2 O4 -","- C10 H8 Br2 O4 -","- C40 H32 Br8 O16 -","4","1","","Jungi, Hiren; Chhetri, Ashis; Kumar, Dheeraj; Podder, Sumana; R. S., Malavika; Kuniyil, Rositha; Mitra, Joyee","Bifunctional picolinate ionic liquids as metal-/halide-free sustainable catalysts for CO2 cycloaddition to epoxides","Catalysis Science & Technology","2026","16","2","458","468","10.1039/D5CY01068C","","","0.71073","MoKα","","0.0732","0.0389","","","0.0714","0.0843","","","","","","1.017","","","","has coordinates","304224","2026-02-12","20:39:03",""
"1576426","18.1182","0.0007","4.242","0.0002","19.6101","0.0008","90","","111.198","0.005","90","","1405.2","0.11","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C15 H10 N2 O2 S2 -","- C15 H10 N2 O2 S2 -","- C60 H40 N8 O8 S8 -","4","0.5","","Swain, Amlan; Behera, Bedabyas; Samal, Saroj Lochan; Rout, Laxmidhar; Mohapatra, Debendra K.","CuNiO2 nano catalyst for efficient Csp2–S bond formation in water: toward green synthesis of bioactive molecules","Catalysis Science & Technology","2026","16","3","830","839","10.1039/D5CY01377A","","x-ray","0.71073","MoKα","","0.0454","0.0329","","","0.0808","0.0858","","","","","","1.035","","","","has coordinates","304225","2026-02-12","20:39:55",""
"1576427","7.6812","0.0002","10.0587","0.0002","15.6788","0.0003","77.844","0.002","88.357","0.002","87.353","0.002","1182.74","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H11 F O S -","- C13 H11 F O S -","- C52 H44 F4 O4 S4 -","4","2","","Swain, Amlan; Behera, Bedabyas; Samal, Saroj Lochan; Rout, Laxmidhar; Mohapatra, Debendra K.","CuNiO2 nano catalyst for efficient Csp2–S bond formation in water: toward green synthesis of bioactive molecules","Catalysis Science & Technology","2026","16","3","830","839","10.1039/D5CY01377A","","x-ray","0.71073","MoKα","","0.0893","0.0433","","","0.1069","0.1238","","","","","","1.042","","","","has coordinates","304225","2026-02-12","20:39:55",""
"1576428","5.637","0.0002","22.295","0.0007","9.3965","0.0004","90","","95.349","0.004","90","","1175.78","0.08","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 N2 O S2 -","- C11 H10 N2 O S2 -","- C44 H40 N8 O4 S8 -","4","1","","Swain, Amlan; Behera, Bedabyas; Samal, Saroj Lochan; Rout, Laxmidhar; Mohapatra, Debendra K.","CuNiO2 nano catalyst for efficient Csp2–S bond formation in water: toward green synthesis of bioactive molecules","Catalysis Science & Technology","2026","16","3","830","839","10.1039/D5CY01377A","","x-ray","0.71073","MoKα","","0.0486","0.0356","","","0.0968","0.1021","","","","","","1.137","","","","has coordinates","304225","2026-02-12","20:39:55",""
"1576429","10.3136","0.0005","8.2566","0.0004","15.63","0.0007","90","","103.712","0.005","90","","1293.04","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 Cl O3 S -","- C13 H11 Cl O3 S -","- C52 H44 Cl4 O12 S4 -","4","1","","Swain, Amlan; Behera, Bedabyas; Samal, Saroj Lochan; Rout, Laxmidhar; Mohapatra, Debendra K.","CuNiO2 nano catalyst for efficient Csp2–S bond formation in water: toward green synthesis of bioactive molecules","Catalysis Science & Technology","2026","16","3","830","839","10.1039/D5CY01377A","","x-ray","0.71073","MoKα","","0.1246","0.0732","","","0.2083","0.2429","","","","","","1.071","","","","has coordinates","304225","2026-02-12","20:39:56",""
"1576430","6.683","0.0003","20.6941","0.001","10.3255","0.0004","90","","91.252","0.004","90","","1427.66","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 N O2 S -","- C16 H19 N O2 S -","- C64 H76 N4 O8 S4 -","4","1","","Swain, Amlan; Behera, Bedabyas; Samal, Saroj Lochan; Rout, Laxmidhar; Mohapatra, Debendra K.","CuNiO2 nano catalyst for efficient Csp2–S bond formation in water: toward green synthesis of bioactive molecules","Catalysis Science & Technology","2026","16","3","830","839","10.1039/D5CY01377A","","x-ray","0.71073","MoKα","","0.0771","0.0412","","","0.087","0.0955","","","","","","1.045","","","","has coordinates","304225","2026-02-12","20:39:56",""
"1576431","12.6019","0.0004","21.5377","0.0005","22.3675","0.0006","90","","90","","90","","6070.9","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C60 H40 N8 S16 -","- C60 H40 N8 S16 -","- C240 H160 N32 S64 -","4","0.5","","Swain, Amlan; Behera, Bedabyas; Samal, Saroj Lochan; Rout, Laxmidhar; Mohapatra, Debendra K.","CuNiO2 nano catalyst for efficient Csp2–S bond formation in water: toward green synthesis of bioactive molecules","Catalysis Science & Technology","2026","16","3","830","839","10.1039/D5CY01377A","","x-ray","0.71073","MoKα","","0.0887","0.0428","","","0.0819","0.091","","","","","","1.067","","","","has coordinates","304225","2026-02-12","20:39:56",""
"1576432","18.983","0.0012","10.4621","0.0007","22.4265","0.0012","90","","108.076","0.002","90","","4234.1","0.5","298","2","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H18 Cu N4 O2 -","- C27 H18 Cu N4 O2 -","- C216 H144 Cu8 N32 O16 -","8","2","","Choudhary, Rachana; Dogra, Kritika; Monika,; Dhar, Basab Bijayi","Photo-mediated aromatic C–H activation by Cu(ii)-amido-quinoline complexes","Catalysis Science & Technology","2026","16","5","1610","1621","10.1039/D5CY01283J","","","0.71073","MoKα","","0.232","0.1184","","","0.1912","0.2043","","","","","","3.698","","","","has coordinates","305278","2026-04-05","11:33:47",""
"1576433","13.507","0.011","13.173","0.015","12.659","0.016","90","","99.26","0.04","90","","2223","4","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","CuL3","","- C25 H24 Cu N4 O3 -","- C25 H24 Cu N4 O3 -","- C100 H96 Cu4 N16 O12 -","4","1","","Choudhary, Rachana; Dogra, Kritika; Monika,; Dhar, Basab Bijayi","Photo-mediated aromatic C–H activation by Cu(ii)-amido-quinoline complexes","Catalysis Science & Technology","2026","16","5","1610","1621","10.1039/D5CY01283J","","","0.71073","MoKα","","0.0776","0.0451","","","0.0963","0.1214","","","","","","1.106","","","","has coordinates","305278","2026-04-05","11:33:47",""
"1576622","10.977","0.002","11.712","0.003","12.949","0.003","95.407","0.005","103.657","0.005","103.77","0.005","1551.1","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H35 Br N2 Ni -","- C36 H35 Br N2 Ni -","- C72 H70 Br2 N4 Ni2 -","2","1","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","x-ray","0.71073","MoKa","","0.0845","0.0447","","","0.1075","0.1176","","","","","","1.107","","","","has coordinates","304585","2026-02-23","22:43:37",""
"1576623","12.2007","0.0004","31.66","0.0009","10.5824","0.0003","90","","93.398","0.001","90","","4080.5","0.2","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C37 H50 Br N2 Ni -","- C37 H50 Br N2 Ni -","- C148 H200 Br4 N8 Ni4 -","4","1","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","x-ray","0.71073","MoKa","","0.0754","0.0492","","","0.1301","0.1413","","","","","","1.002","","","","has coordinates","304585","2026-02-23","22:43:38",""
"1576624","16.2483","0.0015","16.9672","0.0016","8.7426","0.0008","90","","100.492","0.002","90","","2369.9","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H32 N2 Ni -","- C26 H32 N2 Ni -","- C104 H128 N8 Ni4 -","4","1","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","x-ray","0.71073","MoKa","","0.1134","0.0599","","","0.1554","0.1753","","","","","","1.09","","","","has coordinates","304585","2026-02-23","22:43:38",""
"1576625","11.702","0.003","14.611","0.003","15.051","0.003","104.655","0.009","103.443","0.009","95.282","0.009","2390.1","0.9","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C47 H58 N4 Ni2 -","- C47 H58 N4 Ni2 -","- C94 H116 N8 Ni4 -","2","1","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","","0.71073","MoKα","","0.0938","0.0647","","","0.2086","0.2266","","","","","","1.069","","","","has coordinates,has disorder","304585","2026-02-23","22:43:38",""
"1576626","12.0486","0.0004","31.6028","0.001","10.6772","0.0003","90","","92.982","0.001","90","","4060","0.2","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C37 H53 Cl N2 Ni -","- C37 H53 Cl N2 Ni -","- C148 H212 Cl4 N8 Ni4 -","4","1","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","x-ray","0.71073","MoKa","","0.0825","0.0528","","","0.1373","0.1479","","","","","","0.989","","","","has coordinates","304585","2026-02-23","22:43:38",""
"1576627","11.352","0.0007","16.5221","0.0011","20.3395","0.0014","85.126","0.002","78.915","0.002","76.11","0.002","3631.2","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H68 Cl2 N4 Ni2 -","- C72 H68 Cl2 N4 Ni2 -","- C144 H136 Cl4 N8 Ni4 -","2","1","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","x-ray","0.71073","MoKa","","0.1082","0.0668","","","0.157","0.1741","","","","","","1.032","","","","has coordinates","304585","2026-02-23","22:43:39",""
"1576628","12.6985","0.0003","36.7921","0.001","12.873","0.0004","90","","90","","90","","6014.3","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H44 N2 Ni -","- C32 H44 N2 Ni -","- C256 H352 N16 Ni8 -","8","2","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","x-ray","0.71073","MoKa","","0.2046","0.0715","","","0.1692","0.2064","","","","","","0.93","","","","has coordinates","304585","2026-02-23","22:43:39",""
"1576629","21.2448","0.0012","18.7524","0.0008","18.5759","0.0008","90","","115.889","0.001","90","","6657.8","0.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C79 H80 N4 Ni2 -","- C79 H80 N4 Ni2 -","- C316 H320 N16 Ni8 -","4","1","","Redl, Samuel; Halas, Simon; Monkowius, Uwe; Topf, Christoph","Exploring the bimodal nature of a nickel-based catalytic system for the hydrogenation of alkenes and polycyclic aromatic hydrocarbons","Catalysis Science & Technology","2026","16","4","1238","1249","10.1039/D5CY01341K","","","0.71073","MoKα","","0.1286","0.0581","","","0.131","0.1536","","","","","","1.041","","","","has coordinates,has disorder","304585","2026-02-23","22:43:39",""
"1576630","20.76973","0.00031","20.76973","","20.76973","","90","","90","","90","","8959.68","0.13","298","1","298","1","","","","","","","","4","F m -3 m","-F 4 2 3","225","","","","- C24 N3 O16 Zr3 -","- C24 N3 O16 Zr3 -","- C192 N24 O128 Zr24 -","8","0.0416667","","Liu, Yongling; Huang, Zhaohui; Zhang, Senlin; Zhan, Ruoning; Wang, Yingxinjie; Xie, Xiuqiang; Zhang, Nan","Hierarchical hollow UiO-66-NH2/CdS heterostructure with synergistic mass transport and charge separation for enhanced photocatalytic hydrogen production","Catalysis Science & Technology","2026","16","4","1322","1331","10.1039/D5CY01232E","powder diffraction","","0.72768","Synchrotron","","","","","","","","","","","","","","","","","has coordinates","304586","2026-02-23","22:44:07",""
"1576645","11.4946","0.0003","11.7114","0.0003","17.2449","0.0004","83.468","0.001","72.064","0.001","69.996","0.001","2075.31","0.09","296.15","","296.15","","","","","","","","","5","P -1","-P 1","2","","","","- C56 H66 Mo12 N12 O42 -","- C56 H66 Mo12 N12 O42 -","- C56 H66 Mo12 N12 O42 -","1","0.5","","Bandaru, Rohith Phaneendra; Gaonkar, Asmita Dileep; Vankayala, Kiran; Tripuramallu, Bharat Kumar","Molecular engineering of polyoxometalate–porphyrin ion-pair hybrids: crystallographic insight and visible-light driven photocatalytic oxidative coupling of amines","Catalysis Science & Technology","2026","16","7","2276","2281","10.1039/D6CY00008H","","","0.71073","MoKα","","0.03","0.0269","","","0.0636","0.0653","","","","","","1.03","","","","has coordinates","305724","2026-05-05","08:33:10",""
"1576831","14.7271","0.00014","19.29125","0.00017","11.45396","0.00011","90","","109.672","0.0011","90","","3064.18","0.05","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H29 N9 O S2 Zn -","- C29 H29 N9 O S2 Zn -","- C116 H116 N36 O4 S8 Zn4 -","4","0.5","","Shrivastav, Akash; Tiwari, Raman Kumar; Yadav, Mangal S.; Bhattacharya, Subrato","Cis-thiolate bridged heterobimetallic complexes as efficient catalysts for glycosyl triazole synthesis","Catalysis Science & Technology","2026","16","5","1595","1609","10.1039/D5CY01152C","","x-ray","1.54184","CuKα","","0.0264","0.0249","","","0.0718","0.0728","","","","","","1.084","","","","has coordinates,has disorder","305002","2026-03-09","22:48:50",""
"1576832","13.4767","0.0001","16.1583","0.0002","17.9322","0.0003","102.508","0.001","102.566","0.001","102.879","0.001","3568.42","0.09","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C71 H73 Ag N12 Ni O6 P2 S2 -","- C68 H66 Ag N10 Ni O2 P2 S2 -","- C136 H132 Ag2 N20 Ni2 O4 P4 S4 -","2","1","","Shrivastav, Akash; Tiwari, Raman Kumar; Yadav, Mangal S.; Bhattacharya, Subrato","Cis-thiolate bridged heterobimetallic complexes as efficient catalysts for glycosyl triazole synthesis","Catalysis Science & Technology","2026","16","5","1595","1609","10.1039/D5CY01152C","","","1.54184","CuKα","","0.0345","0.03","","","0.0806","0.0828","","","","","","1.066","","","","has coordinates,has disorder","305002","2026-03-09","22:48:52",""
"1576833","13.5061","0.0002","16.2043","0.0003","18.0194","0.0003","102.564","0.001","102.759","0.001","102.673","0.001","3603","0.11","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C71 H73 Ag N12 O6 P2 S2 Zn -","- C68 H66 Ag N10 O2 P2 S2 Zn -","- C136 H132 Ag2 N20 O4 P4 S4 Zn2 -","2","1","","Shrivastav, Akash; Tiwari, Raman Kumar; Yadav, Mangal S.; Bhattacharya, Subrato","Cis-thiolate bridged heterobimetallic complexes as efficient catalysts for glycosyl triazole synthesis","Catalysis Science & Technology","2026","16","5","1595","1609","10.1039/D5CY01152C","","x-ray","1.54184","CuKα","","0.0321","0.029","","","0.0805","0.0823","","","","","","1.063","","","","has coordinates,has disorder","305002","2026-03-09","22:48:52",""
"1576834","13.3546","0.0001","20.0062","0.0002","21.7751","0.0002","90","","90","","90","","5817.76","0.09","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C29 H29 N9 Ni O S2 -","- C29 H29 N9 Ni O S2 -","- C232 H232 N72 Ni8 O8 S16 -","8","1","","Shrivastav, Akash; Tiwari, Raman Kumar; Yadav, Mangal S.; Bhattacharya, Subrato","Cis-thiolate bridged heterobimetallic complexes as efficient catalysts for glycosyl triazole synthesis","Catalysis Science & Technology","2026","16","5","1595","1609","10.1039/D5CY01152C","","x-ray","1.54184","CuKα","","0.0478","0.0393","","","0.0852","0.089","","","","","","1.088","","","","has coordinates","305002","2026-03-09","22:48:52",""
"1576835","19.9114","0.0002","17.0586","0.0002","38.7226","0.0004","90","","96.291","0.001","90","","13073.3","0.2","293","2","293","2","","","","","","","","9","I 1 2/a 1","-I 2ya","15","","","","- C63 H53 Cl3 Cu N9 Ni O3.14 P2 S2 -","- C63 H53 Cl3 Cu N9 Ni O3.14 P2 S2 -","- C504 H424 Cl24 Cu8 N72 Ni8 O25.12 P16 S16 -","8","1","","Shrivastav, Akash; Tiwari, Raman Kumar; Yadav, Mangal S.; Bhattacharya, Subrato","Cis-thiolate bridged heterobimetallic complexes as efficient catalysts for glycosyl triazole synthesis","Catalysis Science & Technology","2026","16","5","1595","1609","10.1039/D5CY01152C","","x-ray","1.54184","CuKα","","0.058","0.0491","","","0.1341","0.1406","","","","","","1.028","","","","has coordinates,has disorder","305002","2026-03-09","22:48:52",""