# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-08-17T23:56:36+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 'New Journal of Chemistry') AND volume = 50 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
"7064220","7.11","0.005","8.813","0.006","12.868","0.009","83.048","0.013","75.01","0.04","86.742","0.013","772.9","0.9","296.15","","296.15","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H17 N O4 -","- C19 H17 N O4 -","- C38 H34 N2 O8 -","2","1","","Liu, Lanxiang; Tao, Yunfeng; Song, Yulin; Zhou, Xiaojian; Du, Guanben; Zhou, Bei; Lin, Jun","Photocatalytic activation of indole alkanols for intramolecular cyclization toward furoindolines","New Journal of Chemistry","2026","50","10","4264","4270","10.1039/D5NJ04764A","","","0.71073","MoKα","","0.1166","0.0775","","","0.2028","0.2221","","","","","","1.117","","","","has coordinates","305415","2026-04-05","12:21:56",""
"7064221","12.5814","0.0004","11.6665","0.0003","10.1069","0.0003","90","","102.112","0.002","90","","1450.48","0.07","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O3 -","- C16 H18 N2 O3 -","- C64 H72 N8 O12 -","4","1","","Bhat, Muzzaffar A.; Jan, Tabasum; Ashraf, Refat; Ali, Muneeba; Mushtaq, Asmat; Bhat, Sajad A.; Butcher, Ray J.; Din Reshi, Noor U.","A hydrazone-based fluorescent chemosensor for Al3+: turn-on response induced by ESIPT suppression","New Journal of Chemistry","2026","50","6","2937","2947","10.1039/D5NJ04748J","","","0.71073","MoKα","","0.0603","0.0439","","","0.1096","0.1211","","","","","","1.034","","","","has coordinates","304349","2026-02-13","01:20:19",""
"7064222","10.8673","0.0006","11.3115","0.0006","13.3163","0.001","90","","90","","90","","1636.91","0.18","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H16 O4 -","- C21 H16 O4 -","- C84 H64 O16 -","4","1","","Zhang, Yichi; Wu, Qingling; Zhang, Qingxiao; Zhao, Yang; Wang, Qilin","Catalyst-controlled divergent synthesis of 2,8-dioxabicyclo[3.3.1]nonanes and benzo[c]chromen-6-ones","New Journal of Chemistry","2026","50","8","3580","3584","10.1039/D5NJ04524J","","x-ray","1.54184","CuKα","","0.0491","0.0416","","","0.1073","0.1158","","","","","","1.046","","","","has coordinates","304936","2026-03-05","13:01:47",""
"7064223","11.2354","0.0005","5.1466","0.0002","30.374","0.0012","90","","97.699","0.004","90","","1740.52","0.12","100.08","0.14","100.08","0.14","","","","","","","","4","I 1 2 1","I 2y","5","","","","- C21 H19 Cl O3 -","- C21 H19 Cl O3 -","- C84 H76 Cl4 O12 -","4","1","","Zhang, Yichi; Wu, Qingling; Zhang, Qingxiao; Zhao, Yang; Wang, Qilin","Catalyst-controlled divergent synthesis of 2,8-dioxabicyclo[3.3.1]nonanes and benzo[c]chromen-6-ones","New Journal of Chemistry","2026","50","8","3580","3584","10.1039/D5NJ04524J","","x-ray","1.54184","CuKα","","0.1275","0.1242","","","0.3376","0.3428","","","","","","1.658","","","","has coordinates,has disorder","304936","2026-03-05","13:01:47",""
"7064224","9.4615","0.0003","7.4413","0.0003","22.9597","0.0007","90","","97.165","0.003","90","","1603.87","0.1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H14 O4 -","- C21 H14 O4 -","- C84 H56 O16 -","4","1","","Zhang, Yichi; Wu, Qingling; Zhang, Qingxiao; Zhao, Yang; Wang, Qilin","Catalyst-controlled divergent synthesis of 2,8-dioxabicyclo[3.3.1]nonanes and benzo[c]chromen-6-ones","New Journal of Chemistry","2026","50","8","3580","3584","10.1039/D5NJ04524J","","x-ray","1.54184","CuKα","","0.0609","0.0473","","","0.1253","0.1411","","","","","","1.025","","","","has coordinates","304936","2026-03-05","13:01:47",""
"7064225","9.2262","0.0002","15.3698","0.0004","15.0703","0.0004","90","","92.705","0.002","90","","2134.66","0.09","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C38 H46.13 Cl2 N11 O0.56 Pd S2 -","- C38 H46.128 Cl2 N11 O0.564 Pd S2 -","- C76 H92.256 Cl4 N22 O1.128 Pd2 S4 -","2","1","","Ortiz-Hernández, M.; Noguez-Maldonado, V. I.; Salazar-Pereda, V.; Gonzalez-Montiel, S.; Mendoza-Espinosa, D.; Suárez, A.; Cristobal, C.","PdII and PtII complexes bearing acetamide and thioacetamide functionalized heteroscorpionates and their application in the hydrosilylation of terminal alkynes","New Journal of Chemistry","2026","50","10","4415","4424","10.1039/D5NJ04709A","","x-ray","0.71073","MoKα","","0.0196","0.0181","","","0.0451","0.0462","","","","","","1.059","","","","has coordinates,has disorder","305414","2026-04-05","12:21:51",""
"7064226","10.7568","0.0003","10.9438","0.0002","16.5867","0.0004","94.7911","0.0018","90.678","0.002","111.144","0.002","1812.92","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 N10 Pd S2 -","- C36 H40 N10 Pd S2 -","- C72 H80 N20 Pd2 S4 -","2","1","","Ortiz-Hernández, M.; Noguez-Maldonado, V. I.; Salazar-Pereda, V.; Gonzalez-Montiel, S.; Mendoza-Espinosa, D.; Suárez, A.; Cristobal, C.","PdII and PtII complexes bearing acetamide and thioacetamide functionalized heteroscorpionates and their application in the hydrosilylation of terminal alkynes","New Journal of Chemistry","2026","50","10","4415","4424","10.1039/D5NJ04709A","","x-ray","0.71073","MoKα","","0.0425","0.0292","","","0.061","0.0666","","","","","","1.036","","","","has coordinates,has disorder","305414","2026-04-05","12:21:51",""
"7064227","10.8601","0.0002","10.8921","0.0002","16.3934","0.0002","94.868","0.001","90.782","0.001","110.887","0.002","1803.19","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 N10 Pt S2 -","- C36 H40 N10 Pt S2 -","- C72 H80 N20 Pt2 S4 -","2","1","","Ortiz-Hernández, M.; Noguez-Maldonado, V. I.; Salazar-Pereda, V.; Gonzalez-Montiel, S.; Mendoza-Espinosa, D.; Suárez, A.; Cristobal, C.","PdII and PtII complexes bearing acetamide and thioacetamide functionalized heteroscorpionates and their application in the hydrosilylation of terminal alkynes","New Journal of Chemistry","2026","50","10","4415","4424","10.1039/D5NJ04709A","","x-ray","0.71073","MoKα","","0.0184","0.0161","","","0.0395","0.041","","","","","","1.096","","","","has coordinates","305414","2026-04-05","12:21:51",""
"7064228","10.8601","0.0002","10.8921","0.0002","16.3934","0.0002","94.868","0.001","90.782","0.001","110.887","0.002","1803.19","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 N10 Pt S2 -","- C36 H40 N10 Pt S2 -","- C72 H80 N20 Pt2 S4 -","2","1","","Ortiz-Hernández, M.; Noguez-Maldonado, V. I.; Salazar-Pereda, V.; Gonzalez-Montiel, S.; Mendoza-Espinosa, D.; Suárez, A.; Cristobal, C.","PdII and PtII complexes bearing acetamide and thioacetamide functionalized heteroscorpionates and their application in the hydrosilylation of terminal alkynes","New Journal of Chemistry","2026","50","10","4415","4424","10.1039/D5NJ04709A","","x-ray","0.71073","MoKα","","0.0184","0.0161","","","0.0395","0.041","","","","","","1.096","","","","has coordinates","305414","2026-04-05","12:21:51",""
"7064229","8.1152","0.0016","10.943","0.002","10.445","0.002","90","","92.743","0.007","90","","926.5","0.3","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H28 O4 -","- C22 H28 O4 -","- C44 H56 O8 -","2","1","","Niu, Hanlin; Liu, Andi; Hu, Zunfeng; Zhu, Xiangtao; Zhang, Bowen; Zhang, Shuai","Metavanadate-mediated hydroxyl activation enhances reaction efficiency in the carboxylative cyclization of propargyl alcohol with CO2","New Journal of Chemistry","2026","50","8","3754","3762","10.1039/D5NJ04972E","","x-ray","0.71073","MoKα","","0.0602","0.0465","","","0.107","0.1157","","","","","","1.058","","","","has coordinates","304937","2026-03-05","13:01:56",""
"7064230","11.0309","0.0003","7.8291","0.0002","23.1989","0.0006","90","","92.104","0.001","90","","2002.15","0.09","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 Cl F4 N11 O6 -","- C13 H14 Cl F4 N11 O6 -","- C52 H56 Cl4 F16 N44 O24 -","4","1","","Xie, Hugen; Shi, Haichuan; Liu, Chang; Zhong, Mei; Li, Haoran; Du, Niying; Lai, Junfu; Zou, Qianzai; Huang, Ming; Yang, Haijun","Energetic triazolotriazines with trifluoromethyl, dinitromethyl and nitroamino groups: synthesis, structure and properties","New Journal of Chemistry","2026","50","6","2817","2824","10.1039/D5NJ04400F","","","0.71073","MoKα","","0.051","0.0395","","","0.0914","0.099","","","","","","1.048","","","","has coordinates","304353","2026-02-13","01:23:12",""
"7064231","8.1445","0.0006","10.771","0.0007","15.6123","0.0012","86.096","0.002","79.109","0.003","86.365","0.002","1340","0.17","170","0.1","170","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C15 H15 F6 N21 O4 -","- C15 H15 F6 N21 O4 -","- C30 H30 F12 N42 O8 -","2","1","","Xie, Hugen; Shi, Haichuan; Liu, Chang; Zhong, Mei; Li, Haoran; Du, Niying; Lai, Junfu; Zou, Qianzai; Huang, Ming; Yang, Haijun","Energetic triazolotriazines with trifluoromethyl, dinitromethyl and nitroamino groups: synthesis, structure and properties","New Journal of Chemistry","2026","50","6","2817","2824","10.1039/D5NJ04400F","","","0.71073","MoKα","","0.1608","0.0788","","","0.153","0.1917","","","","","","1.067","","","","has coordinates,has disorder","304353","2026-02-13","01:23:13",""
"7064232","9.0942","0.0014","13.4468","0.0018","10.1321","0.0015","90","","92.162","0.006","90","","1238.2","0.3","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 F3 N9 O5 -","- C6 H8 F3 N9 O5 -","- C24 H32 F12 N36 O20 -","4","1","","Xie, Hugen; Shi, Haichuan; Liu, Chang; Zhong, Mei; Li, Haoran; Du, Niying; Lai, Junfu; Zou, Qianzai; Huang, Ming; Yang, Haijun","Energetic triazolotriazines with trifluoromethyl, dinitromethyl and nitroamino groups: synthesis, structure and properties","New Journal of Chemistry","2026","50","6","2817","2824","10.1039/D5NJ04400F","","","0.71073","MoKα","","0.1223","0.0768","","","0.1652","0.1919","","","","","","1.084","","","","has coordinates,has disorder","304353","2026-02-13","01:23:13",""
"7064233","6.6018","0.0004","16.2369","0.0009","16.8101","0.0009","93.138","0.002","100.567","0.002","93.351","0.002","1764.4","0.17","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C17 H19 Br Cl N O2.5 P -","- C17 H19 Br Cl N O2.5 P -","- C68 H76 Br4 Cl4 N4 O10 P4 -","4","2","","Sidlyaruk, Nikita; Smolobochkin, Andrey; Gazizov, Almir; Rizbayeva, Tanzilya; Gerasimova, Daria; Garifzyanov, Airat; Shirokov, Valeriy; Burilov, Alexander; Pudovik, Michail","Acceleration of the Arbuzov-type reaction via double activation of imine and H-phosphonate","New Journal of Chemistry","2026","50","8","3615","3627","10.1039/D5NJ04753F","","x-ray","0.71073","MoKα","","0.0448","0.0343","","","0.077","0.081","","","","","","1.05","","","","has coordinates","305418","2026-04-05","12:22:22",""
"7064234","6.337","0.004","16.965","0.01","9.393","0.005","90","","104.174","0.012","90","","979.1","1","150","","150","","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C18 H23 Cl N O4 P -","- C18 H23 Cl N O4 P -","- C36 H46 Cl2 N2 O8 P2 -","2","1","","Sidlyaruk, Nikita; Smolobochkin, Andrey; Gazizov, Almir; Rizbayeva, Tanzilya; Gerasimova, Daria; Garifzyanov, Airat; Shirokov, Valeriy; Burilov, Alexander; Pudovik, Michail","Acceleration of the Arbuzov-type reaction via double activation of imine and H-phosphonate","New Journal of Chemistry","2026","50","8","3615","3627","10.1039/D5NJ04753F","","x-ray","0.71073","MoKα","","0.1137","0.0944","","","0.2041","0.214","","","","","","1.133","","","","has coordinates","305418","2026-04-05","12:22:22",""
"7064235","15.38","0.002","15.38","0.002","10.4419","0.0017","90","","90","","120","","2139.1","0.5","100.15","","100.15","","","","","","","","","7","P -3","-P 3","147","","","","- C36 H42 Cl Co N9 Ni O9 -","- C36 H30 Cl Co N9 Ni O3 -","- C72 H60 Cl2 Co2 N18 Ni2 O6 -","2","0.333333","","Pandey, Sharmila; Mukhopadhyay, Narottam; Lloret, Francesc; Mukherjee, Rabindranath","Hetero-bimetallic complexes of pyridine-/pyrazine-2-carboxamide ligands: synthesis, structure, redox properties and magnetism","New Journal of Chemistry","2026","50","6","2721","2731","10.1039/D5NJ03831F","","","0.71073","MoKα","","0.0576","0.0435","","","0.1131","0.1228","","","","","","1.034","","","","has coordinates","304355","2026-02-13","01:24:16",""
"7064236","18.385","0.005","16.393","0.005","22.388","0.005","90","","90","","90","","6747","3","100","2","100.15","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C33 H29 Cl N12 Ni O4 Zn -","- C33 H29 Cl N12 Ni O4 Zn -","- C264 H232 Cl8 N96 Ni8 O32 Zn8 -","8","1","","Pandey, Sharmila; Mukhopadhyay, Narottam; Lloret, Francesc; Mukherjee, Rabindranath","Hetero-bimetallic complexes of pyridine-/pyrazine-2-carboxamide ligands: synthesis, structure, redox properties and magnetism","New Journal of Chemistry","2026","50","6","2721","2731","10.1039/D5NJ03831F","","","0.71069","MoKα","","0.0564","0.0397","","","0.0923","0.1023","","","","","","1.041","","","","has coordinates","304355","2026-02-13","01:24:17",""
"7064237","18.578","0.005","16.484","0.005","22.217","0.005","90","","90","","90","","6804","3","100","2","100.15","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C33 H29 Cl Co N12 O4 Zn -","- C33 H29 Cl Co N12 O4 Zn -","- C264 H232 Cl8 Co8 N96 O32 Zn8 -","8","1","","Pandey, Sharmila; Mukhopadhyay, Narottam; Lloret, Francesc; Mukherjee, Rabindranath","Hetero-bimetallic complexes of pyridine-/pyrazine-2-carboxamide ligands: synthesis, structure, redox properties and magnetism","New Journal of Chemistry","2026","50","6","2721","2731","10.1039/D5NJ03831F","","","0.71069","MoKα","","0.081","0.0482","","","0.1064","0.1213","","","","","","1.019","","","","has coordinates,has disorder","304355","2026-02-13","01:24:17",""
"7064238","12.484","0.004","13.73","0.004","14.952","0.004","85.618","0.005","68.888","0.005","86.867","0.005","2382.8","1.2","100","2","100","2","","","","","","","","9","P -1","-P 1","2","","","","- C39 H42 Cl Co F6 N13 O5 P Zn -","- C33 H27 Cl Co F6 N12 O3 P Zn -","- C66 H54 Cl2 Co2 F12 N24 O6 P2 Zn2 -","2","1","","Pandey, Sharmila; Mukhopadhyay, Narottam; Lloret, Francesc; Mukherjee, Rabindranath","Hetero-bimetallic complexes of pyridine-/pyrazine-2-carboxamide ligands: synthesis, structure, redox properties and magnetism","New Journal of Chemistry","2026","50","6","2721","2731","10.1039/D5NJ03831F","","x-ray","0.71073","MoKα","","0.0847","0.0624","","","0.1618","0.1803","","","","","","0.997","","","","has coordinates","304355","2026-02-13","01:24:17",""
"7064239","18.257","0.005","16.417","0.005","22.303","0.005","90","","90","","90","","6685","3","100","2","100.15","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C33 H29 Cl Co N12 Ni O4 -","- C33 H29 Cl Co N12 Ni O4 -","- C264 H232 Cl8 Co8 N96 Ni8 O32 -","8","1","","Pandey, Sharmila; Mukhopadhyay, Narottam; Lloret, Francesc; Mukherjee, Rabindranath","Hetero-bimetallic complexes of pyridine-/pyrazine-2-carboxamide ligands: synthesis, structure, redox properties and magnetism","New Journal of Chemistry","2026","50","6","2721","2731","10.1039/D5NJ03831F","","","0.71069","MoKα","","0.0741","0.0475","","","0.1049","0.1208","","","","","","1.037","","","","has coordinates","304355","2026-02-13","01:24:17",""
"7064240","21.286","0.01","8.765","0.004","16.108","0.007","90","","105.98","0.02","90","","2889","2","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H33 B Br2 N2 O2 -","- C30 H33 B Br2 N2 O2 -","- C120 H132 B4 Br8 N8 O8 -","4","0.5","","Al-Ameed, Karrar; El-Ali, H. A. Abdulhadi; Ezzat, Nadia; Obies, Mohammed","Illuminating weak bonds: non-classical C–H⋯Br hydrogen bonding and bright emission in a BODIPY fluorophore","New Journal of Chemistry","2026","50","6","2594","2606","10.1039/D5NJ04295J","","","0.71073","MoKα","","0.118","0.0548","","","0.1387","0.17","","","","","","1.016","","","","has coordinates","304356","2026-02-13","01:24:41",""
"7064241","5.8713","0.0005","9.6203","0.0009","13.4415","0.0012","90.831","0.003","95.528","0.003","95.559","0.003","751.92","0.12","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H16 Br N -","- C18 H16 Br N -","- C36 H32 Br2 N2 -","2","1","","Li, Yuntao; Wang, Xu; Li, Anqi; Zhao, Jixing; Li, Shi-Wu; Yang, Shengwen; Zhao, Zhifei","Copper-catalyzed propargylic substitution for the highly selective construction of multi-substituted 1,4-enynes","New Journal of Chemistry","2026","50","10","4543","4549","10.1039/D6NJ00029K","","","1.54178","CuKα","","0.0323","0.0316","","","0.0846","0.0852","","","","","","1.117","","","","has coordinates","305412","2026-04-05","12:20:56",""
"7064242","13.6826","0.0005","9.7733","0.0003","15.5906","0.0006","90","","109.453","0.004","90","","1965.83","0.13","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 Cl N4 O7 -","- C18 H21 Cl N4 O7 -","- C72 H84 Cl4 N16 O28 -","4","1","","Nowicka, Daria; Garbaczewski, Karol; Consiglio, Giuseppe; Forte, Giuseppe; Kubicki, Maciej; Łuczak, Teresa; Patroniak, Violetta; Gorczyński, Adam","Biomimetic O-demethylation at a copper(ii) center with imine ligand: a structural and computational study","New Journal of Chemistry","2026","50","9","3843","3856","10.1039/D5NJ04478B","","x-ray","0.71073","MoKα","","0.0558","0.0454","","","0.1157","0.1243","","","","","","1.051","","","","has coordinates","304944","2026-03-05","13:04:32",""
"7064243","12.0808","0.0002","8.7564","0.0002","18.0332","0.0005","90","","91.44","0.002","90","","1907.03","0.08","100","1","100","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 Cl N4 O7 -","- C18 H19 Cl N4 O7 -","- C72 H76 Cl4 N16 O28 -","4","1","","Nowicka, Daria; Garbaczewski, Karol; Consiglio, Giuseppe; Forte, Giuseppe; Kubicki, Maciej; Łuczak, Teresa; Patroniak, Violetta; Gorczyński, Adam","Biomimetic O-demethylation at a copper(ii) center with imine ligand: a structural and computational study","New Journal of Chemistry","2026","50","9","3843","3856","10.1039/D5NJ04478B","","x-ray","0.71073","MoKα","","0.0427","0.0369","","","0.0931","0.0982","","","","","","1.036","","","","has coordinates","304944","2026-03-05","13:04:38",""
"7064244","14.4376","0.0006","8.0593","0.0003","16.8258","0.0007","90","","98.442","0.004","90","","1936.59","0.14","100","1","100","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 Cl2 Cu N4 O2 -","- C18 H20 Cl2 Cu N4 O2 -","- C72 H80 Cl8 Cu4 N16 O8 -","4","1","","Nowicka, Daria; Garbaczewski, Karol; Consiglio, Giuseppe; Forte, Giuseppe; Kubicki, Maciej; Łuczak, Teresa; Patroniak, Violetta; Gorczyński, Adam","Biomimetic O-demethylation at a copper(ii) center with imine ligand: a structural and computational study","New Journal of Chemistry","2026","50","9","3843","3856","10.1039/D5NJ04478B","","x-ray","0.71073","MoKα","","0.0539","0.043","","","0.1121","0.121","","","","","","1.038","","","","has coordinates","304944","2026-03-05","13:04:39",""
"7064245","8.2961","0.0007","13.6909","0.0005","14.6952","0.0011","89.989","0.005","88.45","0.007","82.033","0.006","1652.4","0.2","130","1","130","1","","","","","","","","6","P -1","-P 1","2","","","","- C16 H16 Cl2 Cu N4 O -","- C16 H16 Cl2 Cu N4 O -","- C64 H64 Cl8 Cu4 N16 O4 -","4","2","","Nowicka, Daria; Garbaczewski, Karol; Consiglio, Giuseppe; Forte, Giuseppe; Kubicki, Maciej; Łuczak, Teresa; Patroniak, Violetta; Gorczyński, Adam","Biomimetic O-demethylation at a copper(ii) center with imine ligand: a structural and computational study","New Journal of Chemistry","2026","50","9","3843","3856","10.1039/D5NJ04478B","","x-ray","1.54184","CuKα","","0.1373","0.1322","","","0.3014","0.3031","","","","","","1.002","","","","has coordinates","304944","2026-03-05","13:04:39",""
"7064246","18.8457","0.0003","6.69128","0.00006","13.29018","0.00011","90","","90","","90","","1675.92","0.03","125","1","125","1","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C17 H17 Cl Cu N4 O3 -","- C17 H17 Cl Cu N4 O3 -","- C68 H68 Cl4 Cu4 N16 O12 -","4","1","","Nowicka, Daria; Garbaczewski, Karol; Consiglio, Giuseppe; Forte, Giuseppe; Kubicki, Maciej; Łuczak, Teresa; Patroniak, Violetta; Gorczyński, Adam","Biomimetic O-demethylation at a copper(ii) center with imine ligand: a structural and computational study","New Journal of Chemistry","2026","50","9","3843","3856","10.1039/D5NJ04478B","","x-ray","1.54184","CuKα","","0.0258","0.0258","","","0.0744","0.0744","","","","","","1.078","","","","has coordinates","304944","2026-03-05","13:04:40",""
"7064247","12.26303","0.0001","18.89895","0.00016","17.09492","0.00014","90","","97.1415","0.0007","90","","3931.16","0.06","130","1","130","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H44 Cl2 Cu N8 O9 -","- C37 H44 Cl2 Cu N8 O9 -","- C148 H176 Cl8 Cu4 N32 O36 -","4","1","","Nowicka, Daria; Garbaczewski, Karol; Consiglio, Giuseppe; Forte, Giuseppe; Kubicki, Maciej; Łuczak, Teresa; Patroniak, Violetta; Gorczyński, Adam","Biomimetic O-demethylation at a copper(ii) center with imine ligand: a structural and computational study","New Journal of Chemistry","2026","50","9","3843","3856","10.1039/D5NJ04478B","","x-ray","1.54184","CuKα","","0.0534","0.0469","","","0.1199","0.1243","","","","","","1.027","","","","has coordinates","304944","2026-03-05","13:04:40",""
"7064248","16.90445","0.00013","12.18931","0.00008","22.04368","0.00013","90","","101.912","0.0007","90","","4444.36","0.05","130","1","130","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H46 Cl2 Cu2 N8 O14 -","- C37 H46 Cl2 Cu2 N8 O14 -","- C148 H184 Cl8 Cu8 N32 O56 -","4","1","","Nowicka, Daria; Garbaczewski, Karol; Consiglio, Giuseppe; Forte, Giuseppe; Kubicki, Maciej; Łuczak, Teresa; Patroniak, Violetta; Gorczyński, Adam","Biomimetic O-demethylation at a copper(ii) center with imine ligand: a structural and computational study","New Journal of Chemistry","2026","50","9","3843","3856","10.1039/D5NJ04478B","","x-ray","1.54184","CuKα","","0.0475","0.044","","","0.1261","0.1308","","","","","","1.022","","","","has coordinates,has disorder","304944","2026-03-05","13:04:40",""
"7064249","16.794","0.003","11.032","0.002","7.8875","0.0017","90","","101.768","0.007","90","","1430.6","0.5","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 Cl N2 O S -","- C16 H9 Cl N2 O S -","- C64 H36 Cl4 N8 O4 S4 -","4","1","","Liu, Xiaowei; Shao, Chukai; Yin, Hongquan; Liu, Kaixiang; Chen, Fu-Xue","Tandem electrophilic thiocyanation/cyclization of α-alkynyl oximes for synthesis of 4-thiocyanatoisoxazoles","New Journal of Chemistry","2026","50","6","2589","2593","10.1039/D5NJ03863D","","x-ray","0.71073","MoKα","","0.06","0.0428","","","0.133","0.1494","","","","","","1.052","","","","has coordinates","304359","2026-02-13","01:26:05",""
"7064250","30.31","0.008","8.438","0.002","23.246","0.006","90","","116.897","0.005","90","","5302","2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[2,2'-[(1E,2E)-hydrazinediylidenedi-(E)-methanylylidene]bis(5-methoxyphenolato)]{Bis[(2-hydroxy-3-methoxyphenyl)methylene] succino hydrazide}Manganese(II)bis[dimethylformamide). di[dimethylformamide]","","- C48 H60 Mn2 N10 O14 -","- C48 H60 Mn2 N10 O14 -","- C192 H240 Mn8 N40 O56 -","4","0.5","","Lauqman, Muhammad; Javaid, Nida; Ilyas, Mubashar; Tahir, Muhammad Nawaz; Ashfaq, Muhammad; Ali, Junaid; Saqlain, Madiha; Li, Hui","A hydrazone Schiff base as a Fe(iii) sensor and precursor to a violet-emissive Mn(ii) complex: synthesis, crystal structure, luminescence, supramolecular and DFT studies","New Journal of Chemistry","2026","50","8","3738","3747","10.1039/D5NJ04171F","","","0.71073","MoKα","","0.1727","0.0819","","","0.174","0.2211","","","","","","1.062","","","","has coordinates,has disorder","305417","2026-04-05","12:22:19",""
"7064251","5.6948","0.0006","5.6948","0.0006","5.6948","0.0006","90","","90","","90","","184.69","0.03","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","Copper tin yttrium selenide (0.667/0.328/0.005/1)","","","- Cu0.667 Se Sn0.328 Y0.005 -","- Cu0.667 Se Sn0.328 Y0.005 -","- Cu2.668 Se4 Sn1.312 Y0.02 -","4","0.0416667","","Palani, Narasimman; Gopalsamy, Karuppasamy; Bhuvanesh, Nattamai; Ajaykamal, Tamilarasan; Maurin, Guillaume; Sundaravel, Karuppasamy","Manganese(ii) complexes of tridentate 3N ligands as functional models of phenoxazinone synthase: impact of ligand steric hindrance on reactivity","New Journal of Chemistry","2026","50","14","5768","5789","10.1039/D5NJ03127C","","","","","","","","","","","","","","","","","","","","","has coordinates","305839","2026-05-05","09:29:34",""
"7064252","6.2324","0.0004","18.1633","0.0011","14.3366","0.0009","90","","102.317","0.002","90","","1585.56","0.17","110","","110","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C18 H23 N3 -","- C18 H23 N3 -","- C72 H92 N12 -","4","1","","Palani, Narasimman; Gopalsamy, Karuppasamy; Bhuvanesh, Nattamai; Ajaykamal, Tamilarasan; Maurin, Guillaume; Sundaravel, Karuppasamy","Manganese(ii) complexes of tridentate 3N ligands as functional models of phenoxazinone synthase: impact of ligand steric hindrance on reactivity","New Journal of Chemistry","2026","50","14","5768","5789","10.1039/D5NJ03127C","","","1.54178","CuKα","","0.0286","0.0271","","","0.0624","0.0635","","","","","","1.092","","","","has coordinates","305839","2026-05-05","09:29:34",""
"7064253","7.6216","0.0004","8.6279","0.0005","14.0599","0.0007","97.04","0.002","101.032","0.002","114.334","0.002","805.61","0.08","110","","110","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 Cl2 Mn N3 -","- C15 H17 Cl2 Mn N3 -","- C30 H34 Cl4 Mn2 N6 -","2","1","","Palani, Narasimman; Gopalsamy, Karuppasamy; Bhuvanesh, Nattamai; Ajaykamal, Tamilarasan; Maurin, Guillaume; Sundaravel, Karuppasamy","Manganese(ii) complexes of tridentate 3N ligands as functional models of phenoxazinone synthase: impact of ligand steric hindrance on reactivity","New Journal of Chemistry","2026","50","14","5768","5789","10.1039/D5NJ03127C","","","0.71073","MoKα","","0.0256","0.0228","","","0.058","0.0589","","","","","","1.072","","","","has coordinates","305839","2026-05-05","09:29:34",""
"7064254","9.7129","0.0004","13.6339","0.0006","21.313","0.0008","97.307","0.003","93.53","0.003","104.433","0.004","2698.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H19 N O -","- C23 H19 N O -","- C138 H114 N6 O6 -","6","3","","Singh, Gurjaspreet; Jyoti,; Singh, Amanpreet; Sharma, Devina; Gill, Baljinder Singh; Singh, Jandeep; George, Nancy; Baliyan, Deepanjali; Kaur, Amarjit","Fluorescence quenching of V(iii) ions by a 4-benzylaniline-derived Schiff base-functionalized organosilane: unveiling antiproliferative potential through in vitro analysis and molecular docking","New Journal of Chemistry","2026","50","10","4596","4607","10.1039/D5NJ04884B","","x-ray","0.71073","MoKα","","0.2036","0.0593","","","0.1262","0.1812","","","","","","0.944","","","","has coordinates","305413","2026-04-05","12:21:04",""
"7064255","16.88798","0.00012","11.87134","0.00007","20.5286","0.00014","90","","90","","90","","4115.63","0.05","100","0.1","100","0.1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H22 Fe N4 O2 -","- C24 H22 Fe N4 O2 -","- C192 H176 Fe8 N32 O16 -","8","1","","Proshutinskaya, Varvara Yu.; Krylova, Irina V.; Shangin, Pavel G.; Vilman, Victoriya A.; Minyaev, Mikhail E.; Gorbunov, Dmitry E.; Gritsan, Nina P.; Nikolaevskaya, Elena N.; Egorov, Mikhail P.; Tretyakov, Evgeny V.; Syroeshkin, Mikhail A.","Ferrocene-containing Schiff bases and their Sn(iv) complexes with two non-conjugated redox-active fragments: dependence of spectroscopic and redox properties on complexation and solvent","New Journal of Chemistry","2026","50","9","3906","3925","10.1039/D5NJ04462F","","x-ray","1.54184","CuKα","","0.0332","0.0307","","","0.0877","0.0896","","","","","","1.093","","","","has coordinates","304945","2026-03-05","13:04:56",""
"7064256","7.63447","0.00012","10.59566","0.00018","17.044","0.0003","97.9351","0.0014","90.0735","0.0013","104.065","0.0014","1323.72","0.04","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C52 H72 Fe2 N8 O8 Sn2 -","- C52 H72 Fe2 N8 O8 Sn2 -","- C52 H72 Fe2 N8 O8 Sn2 -","1","0.5","","Proshutinskaya, Varvara Yu.; Krylova, Irina V.; Shangin, Pavel G.; Vilman, Victoriya A.; Minyaev, Mikhail E.; Gorbunov, Dmitry E.; Gritsan, Nina P.; Nikolaevskaya, Elena N.; Egorov, Mikhail P.; Tretyakov, Evgeny V.; Syroeshkin, Mikhail A.","Ferrocene-containing Schiff bases and their Sn(iv) complexes with two non-conjugated redox-active fragments: dependence of spectroscopic and redox properties on complexation and solvent","New Journal of Chemistry","2026","50","9","3906","3925","10.1039/D5NJ04462F","","x-ray","1.54184","CuKα","","0.0475","0.047","","","0.1328","0.1331","","","","","","1.067","","","","has coordinates,has disorder","304945","2026-03-05","13:04:57",""
"7064257","8.1568","0.0005","11.8101","0.0008","12.095","0.0008","90","","106.848","0.002","90","","1115.13","0.13","302","","302","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 Cl N O2 S -","- C11 H10 Cl N O2 S -","- C44 H40 Cl4 N4 O8 S4 -","4","1","","Zou, ShengLi; Zhou, Yihang; Chen, Xuerui; Liu, Xiaobing; Zhou, Yao","Rongalite as the C1 synthon to assemble 2,3-dihydrobenzothiazin-4-ones and benzo[d][1,3]oxathiin-4-ones","New Journal of Chemistry","2026","50","9","3926","3932","10.1039/D5NJ04477D","","","0.71076","MoKα","","0.0647","0.0478","","","0.1141","0.1303","","","","","","1.122","","","","has coordinates","304942","2026-03-05","13:03:53",""
"7064258","9.91","0.0013","22.22","0.003","7.4284","0.0008","90","","90","","90","","1635.7","0.4","303","","303","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","1","","- C8 H5 Br O2 S -","- C8 H5 Br O2 S -","- C64 H40 Br8 O16 S8 -","8","1","","Zou, ShengLi; Zhou, Yihang; Chen, Xuerui; Liu, Xiaobing; Zhou, Yao","Rongalite as the C1 synthon to assemble 2,3-dihydrobenzothiazin-4-ones and benzo[d][1,3]oxathiin-4-ones","New Journal of Chemistry","2026","50","9","3926","3932","10.1039/D5NJ04477D","","","0.71076","MoKα","","0.0752","0.0566","","","0.1238","0.1311","","","","","","1.172","","","","has coordinates","304942","2026-03-05","13:03:53",""
"7064259","10.5574","0.0003","11.1304","0.0003","22.6838","0.0008","90","","92.752","0.002","90","","2662.46","0.14","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H17 Cl3 Cu N6 O2 S2 -","- C23 H17 Cl3 Cu N6 O2 S2 -","- C92 H68 Cl12 Cu4 N24 O8 S8 -","4","1","","Gautam, Ram Nayan; Shukla, Alok; Jaiswal, Ankesh Kumar; Singh, Anupam; Vishwakarma, Ajay; Kumar, Rajesh; Prasad, L. B.; Butcher, R. J.; Bharty, M. K.","Metallo-hydrazones of pyridine–thiophene derivatives: structure–function insight and anticancer evaluation of Co(iii), Ni(ii), Cu(ii), and Zn(ii) complexes","New Journal of Chemistry","2026","50","7","3394","3406","10.1039/D5NJ02095F","","","0.71073","MoKα","","0.0749","0.051","","","0.1255","0.1393","","","","","","1.1","","","","has coordinates","304445","2026-02-17","01:50:47",""
"7064260","11.2076","0.0002","8.6768","0.0002","22.6836","0.0005","90","","91.999","0.002","90","","2204.55","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 N6 O2 S2 Zn -","- C22 H16 N6 O2 S2 Zn -","- C88 H64 N24 O8 S8 Zn4 -","4","1","","Gautam, Ram Nayan; Shukla, Alok; Jaiswal, Ankesh Kumar; Singh, Anupam; Vishwakarma, Ajay; Kumar, Rajesh; Prasad, L. B.; Butcher, R. J.; Bharty, M. K.","Metallo-hydrazones of pyridine–thiophene derivatives: structure–function insight and anticancer evaluation of Co(iii), Ni(ii), Cu(ii), and Zn(ii) complexes","New Journal of Chemistry","2026","50","7","3394","3406","10.1039/D5NJ02095F","","","1.54184","CuKα","","0.0889","0.0696","","","0.2074","0.2262","","","","","","1.065","","","","has coordinates","304445","2026-02-17","01:50:48",""
"7064261","18.6836","0.0005","9.6572","0.0004","6.0454","0.0002","90","","90","","90","","1090.78","0.06","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C11 H9 N3 O S -","- C11 H9 N3 O S -","- C44 H36 N12 O4 S4 -","4","1","","Gautam, Ram Nayan; Shukla, Alok; Jaiswal, Ankesh Kumar; Singh, Anupam; Vishwakarma, Ajay; Kumar, Rajesh; Prasad, L. B.; Butcher, R. J.; Bharty, M. K.","Metallo-hydrazones of pyridine–thiophene derivatives: structure–function insight and anticancer evaluation of Co(iii), Ni(ii), Cu(ii), and Zn(ii) complexes","New Journal of Chemistry","2026","50","7","3394","3406","10.1039/D5NJ02095F","","","1.54184","CuKα","","0.0489","0.0449","","","0.1241","0.1287","","","","","","1.058","","","","has coordinates","304445","2026-02-17","01:50:48",""
"7064262","8.7079","0.0002","18.6932","0.0004","31.4238","0.0005","90","","97.552","0.002","90","","5070.75","0.18","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C44 H36 Cl4 Co3 N12 O6 S4 -","- C44 H36 Cl4 Co3 N12 O6 S4 -","- C176 H144 Cl16 Co12 N48 O24 S16 -","4","0.5","","Gautam, Ram Nayan; Shukla, Alok; Jaiswal, Ankesh Kumar; Singh, Anupam; Vishwakarma, Ajay; Kumar, Rajesh; Prasad, L. B.; Butcher, R. J.; Bharty, M. K.","Metallo-hydrazones of pyridine–thiophene derivatives: structure–function insight and anticancer evaluation of Co(iii), Ni(ii), Cu(ii), and Zn(ii) complexes","New Journal of Chemistry","2026","50","7","3394","3406","10.1039/D5NJ02095F","","","1.54184","CuKα","","0.1072","0.1041","","","0.3039","0.3138","","","","","","1.521","","","","has coordinates,has disorder","304445","2026-02-17","01:50:48",""
"7064263","11.155","0.0002","8.76","0.0002","22.492","0.0005","90","","93.234","0.002","90","","2194.37","0.08","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 N6 Ni O2 S2 -","- C22 H16 N6 Ni O2 S2 -","- C88 H64 N24 Ni4 O8 S8 -","4","1","","Gautam, Ram Nayan; Shukla, Alok; Jaiswal, Ankesh Kumar; Singh, Anupam; Vishwakarma, Ajay; Kumar, Rajesh; Prasad, L. B.; Butcher, R. J.; Bharty, M. K.","Metallo-hydrazones of pyridine–thiophene derivatives: structure–function insight and anticancer evaluation of Co(iii), Ni(ii), Cu(ii), and Zn(ii) complexes","New Journal of Chemistry","2026","50","7","3394","3406","10.1039/D5NJ02095F","","","1.54178","CuKα","","0.0857","0.0609","","","0.1563","0.1762","","","","","","1.03","","","","has coordinates,has disorder","304445","2026-02-17","01:50:49",""
"7064264","10.2561","0.0005","7.5393","0.0003","21.0409","0.0008","90","","98.471","0.004","90","","1609.21","0.12","293","2","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","HL","Crystal 7","","- C21 H16 N2 O2 -","- C21 H16 N2 O2 -","- C84 H64 N8 O8 -","4","1","","Haloi, Pankaj; Mandal, Ram Kumar; Das, Sanchita; Dinda, Rupam; Barman, Pranjit","A multifunctional stimuli-responsive AIE-active Schiff base for solvatochromism, mechanochromism, acidochromism, Cu2+ sensing and DNA binding","New Journal of Chemistry","2026","50","7","3169","3184","10.1039/D5NJ04403K","","x-ray","0.71073","MoKα","","0.0599","0.0407","","","0.109","0.1167","","","","","","1.1","","","","has coordinates","304446","2026-02-17","01:51:07",""
"7064265","11.0335","0.0004","21.1887","0.0008","33.5173","0.0013","90","","90","","90","","7835.9","0.5","297","2","297","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C46 H36 N6 Ni O2 S2 -","- C46 H36 N6 Ni O2 S2 -","- C368 H288 N48 Ni8 O16 S16 -","8","1","","Verma, Satyendra; Nath, Jitendra; Baruah, Jubaraj B.","See-saw Ni(ii) thiosemicarbazones: energy and photophysical properties","New Journal of Chemistry","2026","50","11","4884","4895","10.1039/D5NJ04119H","","","0.71073","MoKα","","0.1175","0.0611","","","0.1314","0.1519","","","","","","1.036","","","","has coordinates","305421","2026-04-05","12:23:19",""
"7064266","7.6501","0.0014","27.11","0.005","21.294","0.004","90","","90.173","0.006","90","","4416.2","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H29 Cl7 N6 Ni S2 -","- C45 H29 Cl7 N6 Ni S2 -","- C180 H116 Cl28 N24 Ni4 S8 -","4","1","","Verma, Satyendra; Nath, Jitendra; Baruah, Jubaraj B.","See-saw Ni(ii) thiosemicarbazones: energy and photophysical properties","New Journal of Chemistry","2026","50","11","4884","4895","10.1039/D5NJ04119H","","","0.71073","MoKα","","0.1634","0.0785","","","0.1685","0.2015","","","","","","1.032","","","","has coordinates","305421","2026-04-05","12:23:19",""
"7064267","13.4028","0.0016","25.516","0.003","11.7627","0.0014","90","","91.75","0.004","90","","4020.8","0.8","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H28 Cl4 N6 Ni S2 -","- C44 H28 Cl4 N6 Ni S2 -","- C176 H112 Cl16 N24 Ni4 S8 -","4","1","","Verma, Satyendra; Nath, Jitendra; Baruah, Jubaraj B.","See-saw Ni(ii) thiosemicarbazones: energy and photophysical properties","New Journal of Chemistry","2026","50","11","4884","4895","10.1039/D5NJ04119H","","","0.71073","MoKα","","0.0798","0.044","","","0.0862","0.0948","","","","","","1.059","","","","has coordinates","305421","2026-04-05","12:23:19",""
"7064268","13.0531","0.0002","7.0994","0.0001","14.8649","0.0002","90","","93.01","0.001","90","","1375.62","0.03","298","2","298","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N4 O7 -","- C12 H10 N4 O7 -","- C48 H40 N16 O28 -","4","1","","Sarkar, Sresha; Sultana, Shabnam; Jover, Jesús; Chowdhury, Nilkanta; Bagchi, Angshuman; Das, Chandan; Goswami, Swapnadeep; Chattopadhyay, Dipankar; Roy, Raj Kumar; Saha, Supriyo; Zangrando, Ennio; Sanyal, Ria","Supramolecular networks of picrate derivatives with tunable hydrogen-bonding densities for selective bacterial killing","New Journal of Chemistry","2026","50","7","2994","3018","10.1039/D5NJ04072H","","","1.54178","CuKα","","0.0429","0.0419","","","0.1114","0.1123","","","","","","1.046","","","","has coordinates","304448","2026-02-17","01:52:17",""
"7064269","17.316","0.0011","4.002","0.0004","21.9731","0.0013","90","","96.198","0.006","90","","1513.8","0.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 N4 O8 -","- C13 H12 N4 O8 -","- C52 H48 N16 O32 -","4","1","","Sarkar, Sresha; Sultana, Shabnam; Jover, Jesús; Chowdhury, Nilkanta; Bagchi, Angshuman; Das, Chandan; Goswami, Swapnadeep; Chattopadhyay, Dipankar; Roy, Raj Kumar; Saha, Supriyo; Zangrando, Ennio; Sanyal, Ria","Supramolecular networks of picrate derivatives with tunable hydrogen-bonding densities for selective bacterial killing","New Journal of Chemistry","2026","50","7","2994","3018","10.1039/D5NJ04072H","","","0.71073","MoKα","","0.1016","0.0786","","","0.2014","0.2387","","","","","","1.011","","","","has coordinates","304448","2026-02-17","01:52:18",""
"7064270","10.4079","0.0001","9.2402","0.0001","23.1207","0.0003","90","","90","","90","","2223.54","0.04","118","2","118","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C18 H12 N8 O16 -","- C18 H12 N8 O16 -","- C72 H48 N32 O64 -","4","1","","Sarkar, Sresha; Sultana, Shabnam; Jover, Jesús; Chowdhury, Nilkanta; Bagchi, Angshuman; Das, Chandan; Goswami, Swapnadeep; Chattopadhyay, Dipankar; Roy, Raj Kumar; Saha, Supriyo; Zangrando, Ennio; Sanyal, Ria","Supramolecular networks of picrate derivatives with tunable hydrogen-bonding densities for selective bacterial killing","New Journal of Chemistry","2026","50","7","2994","3018","10.1039/D5NJ04072H","","","1.54184","CuKα","","0.0267","0.0267","","","0.0719","0.0719","","","","","","1.074","","","","has coordinates,has disorder","304448","2026-02-17","01:52:18",""
"7064271","4.242","0.0002","14.9824","0.0006","24.6205","0.0011","90","","91.692","0.004","90","","1564.08","0.12","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 Cl N5 O8 -","- C13 H10 Cl N5 O8 -","- C52 H40 Cl4 N20 O32 -","4","1","","Sarkar, Sresha; Sultana, Shabnam; Jover, Jesús; Chowdhury, Nilkanta; Bagchi, Angshuman; Das, Chandan; Goswami, Swapnadeep; Chattopadhyay, Dipankar; Roy, Raj Kumar; Saha, Supriyo; Zangrando, Ennio; Sanyal, Ria","Supramolecular networks of picrate derivatives with tunable hydrogen-bonding densities for selective bacterial killing","New Journal of Chemistry","2026","50","7","2994","3018","10.1039/D5NJ04072H","","","0.71073","MoKα","","0.1142","0.0668","","","0.1587","0.2161","","","","","","1.162","","","","has coordinates","304448","2026-02-17","01:52:18",""
"7064272","8.0915","0.0004","8.4379","0.0004","10.3328","0.0005","79.285","0.004","82.174","0.004","88.062","0.004","686.69","0.06","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H10 N4 O8 -","- C12 H10 N4 O8 -","- C24 H20 N8 O16 -","2","1","","Sarkar, Sresha; Sultana, Shabnam; Jover, Jesús; Chowdhury, Nilkanta; Bagchi, Angshuman; Das, Chandan; Goswami, Swapnadeep; Chattopadhyay, Dipankar; Roy, Raj Kumar; Saha, Supriyo; Zangrando, Ennio; Sanyal, Ria","Supramolecular networks of picrate derivatives with tunable hydrogen-bonding densities for selective bacterial killing","New Journal of Chemistry","2026","50","7","2994","3018","10.1039/D5NJ04072H","","","0.71073","MoKα","","0.0542","0.0499","","","0.1376","0.1425","","","","","","1.081","","","","has coordinates","304448","2026-02-17","01:52:18",""
"7064273","13.1194","0.0004","12.8734","0.0004","10.0344","0.0005","90","","100.177","0.004","90","","1668.06","0.11","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C20 H16 N2 O4 -","- C20 H16 N2 O4 -","- C80 H64 N8 O16 -","4","1","","Jia, Yun-Qing; Mu, Ting-ting; Liu, Hong-xian; Xiang, Min; Shen, Li-Wen","DBU-promoted [3+2] cycloaddition for the synthesis of trispiro heterocycles from acetylpyrazolyl-substituted oxindoles and substituted isatins","New Journal of Chemistry","2026","50","9","3947","3951","10.1039/D5NJ04657B","","","1.54184","CuKα","","0.0484","0.0457","","","0.1298","0.1343","","","","","","1.057","","","","has coordinates","304939","2026-03-05","13:03:17",""
"7064274","11.07456","0.00008","19.22227","0.00013","23.30686","0.00016","90","","90","","90","","4961.52","0.06","100","0.1","100","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H33 F N2 O4 -","- C28 H33 F N2 O4 -","- C224 H264 F8 N16 O32 -","8","2","","Guo, Dong-Gui; Zhang, Sijie; Liu, Lin-Lu; Cen, Hong-Xing; Liu, Xiong-Li; Wang, Hui-Juan; Peng, Li-Jun","Biomimetic synthesis of dispiro sesquiterpene lactone type alkaloids and discovery of potential anticancer scaffolds","New Journal of Chemistry","2026","50","7","3225","3238","10.1039/D5NJ04317D","","x-ray","1.54184","CuKα","","0.0311","0.0296","","","0.0709","0.0718","","","","","","1.043","","","","has coordinates","304450","2026-02-17","01:52:54",""
"7064275","5.999","0.004","21.072","0.013","12.373","0.008","90","","94.18","0.03","90","","1559.9","1.7","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 Cl Cu N3 O S -","- C13 H16 Cl Cu N3 O S -","- C52 H64 Cl4 Cu4 N12 O4 S4 -","4","1","","Roy, Indrani; Sarkar, Tapan; Brandao, Paula; Banerjee, Abhijit; Saha, Sandip; Bera, Manindranath","Thiocyanato-bridged new copper(ii) 1D polymeric chains: structures, electrical properties, catecholase activity and DFT studies","New Journal of Chemistry","2026","50","7","3065","3077","10.1039/D5NJ04496K","","","0.71073","MoKα","","0.0479","0.0464","","","0.1324","0.1338","","","","","","1.158","","","","has coordinates","304451","2026-02-17","01:53:10",""
"7064276","6.0003","0.0002","21.1415","0.0008","12.3189","0.0004","90","","94.472","0.002","90","","1557.96","0.09","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 Br Cu N3 O S -","- C13 H16 Br Cu N3 O S -","- C52 H64 Br4 Cu4 N12 O4 S4 -","4","1","","Roy, Indrani; Sarkar, Tapan; Brandao, Paula; Banerjee, Abhijit; Saha, Sandip; Bera, Manindranath","Thiocyanato-bridged new copper(ii) 1D polymeric chains: structures, electrical properties, catecholase activity and DFT studies","New Journal of Chemistry","2026","50","7","3065","3077","10.1039/D5NJ04496K","","","0.71073","MoKα","","0.0304","0.0256","","","0.0659","0.0691","","","","","","1.03","","","","has coordinates","304451","2026-02-17","01:53:13",""
"7064277","7.0173","0.0004","14.213","0.001","15.1454","0.001","64.302","0.002","81.405","0.002","77.696","0.002","1327.09","0.15","296.9","","296.9","","","","","","","","","7","P -1","-P 1","2","","","","- C25 H25 Br I N O3 S2 -","- C25 H25 Br I N O3 S2 -","- C50 H50 Br2 I2 N2 O6 S4 -","2","1","","Zhang, Simiao; Deng, Jianbin; Wang, Junqi; Lv, Bingzhen; Weng, Peixu; Wang, Yong; Wan, Xiaobing","Substrate-initiated radical relay: redox-neutral iodo/bromo sulfoximination of alkynes","New Journal of Chemistry","2026","50","7","3267","3274","10.1039/D5NJ04903B","","","0.71073","MoKα","","0.0587","0.0416","","","0.0916","0.1016","","","","","","1.033","","","","has coordinates","304452","2026-02-17","01:53:29",""
"7064278","13.6265","0.0017","15.0163","0.0014","16.2071","0.0019","77.116","0.009","70.89","0.01","66.469","0.008","2856.6","0.6","100","","100","","","","","","","","","8","P -1","-P 1","2","","","","- C98 H110.72 B6 Cl6 F12 Fe N40 O8.36 -","- C98 H110 B6 Cl6 F12 Fe N40 O8.36 -","- C98 H110 B6 Cl6 F12 Fe N40 O8.36 -","1","0.5","","Schöbinger, Matthias; Huber, Martin; Stöger, Berthold; Weinberger, Peter","Linkage isomerism in a homoleptic Fe(ii) complex with BODIPY-1H-tetrazole ligands","New Journal of Chemistry","2026","50","10","4271","4277","10.1039/D5NJ03028E","","x-ray","1.54186","CuKα","","0.0589","0.0471","","","0.1168","0.1249","","","","","","1.036","","","","has coordinates,has disorder","305411","2026-04-05","12:20:47",""
"7064279","13.6961","0.0009","15.0329","0.0009","16.4033","0.0011","76.081","0.005","70.357","0.005","66.017","0.005","2884.9","0.3","100","","100","","","","","","","","","9","P -1","-P 1","2","Trirubidium sodium tetraplumbate","","","- C98 H110 B6 Br4 Cl2 F12 Fe N40 O8 -","- C98 H110 B6 Br4 Cl2 F12 Fe N40 O8 -","- C98 H110 B6 Br4 Cl2 F12 Fe N40 O8 -","1","0.5","","Schöbinger, Matthias; Huber, Martin; Stöger, Berthold; Weinberger, Peter","Linkage isomerism in a homoleptic Fe(ii) complex with BODIPY-1H-tetrazole ligands","New Journal of Chemistry","2026","50","10","4271","4277","10.1039/D5NJ03028E","","x-ray","1.54186","CuKα","","0.0735","0.0654","","","0.1772","0.1872","","","","","","1.043","","","","has coordinates,has disorder","305411","2026-04-05","12:20:47",""
"7064280","13.783","0.0004","15.1424","0.0004","16.3431","0.0005","78.046","0.002","71.282","0.002","66.404","0.002","2948.24","0.16","300","","300","","","","","","","","","8","P -1","-P 1","2","","","","- C98 H110 B6 Cl6 F12 Fe N40 O8 -","- C98 H110 B6 Cl6 F12 Fe N40 O8 -","- C98 H110 B6 Cl6 F12 Fe N40 O8 -","1","0.5","","Schöbinger, Matthias; Huber, Martin; Stöger, Berthold; Weinberger, Peter","Linkage isomerism in a homoleptic Fe(ii) complex with BODIPY-1H-tetrazole ligands","New Journal of Chemistry","2026","50","10","4271","4277","10.1039/D5NJ03028E","","x-ray","1.54186","CuKα","","0.0922","0.0659","","","0.184","0.2058","","","","","","1.056","","","","has coordinates,has disorder","305411","2026-04-05","12:20:47",""
"7064281","33.0397","0.0009","14.6823","0.0003","17.0224","0.0005","90","","95.455","0.002","90","","8220.1","0.4","100","","100","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C70.62 H98.5 B4 Cl2 F8 Fe N24 O12.62 -","- C70.628 H94 B4 Cl2 F8 Fe N24 O12.628 -","- C282.512 H376 B16 Cl8 F32 Fe4 N96 O50.512 -","4","0.5","","Schöbinger, Matthias; Huber, Martin; Stöger, Berthold; Weinberger, Peter","Linkage isomerism in a homoleptic Fe(ii) complex with BODIPY-1H-tetrazole ligands","New Journal of Chemistry","2026","50","10","4271","4277","10.1039/D5NJ03028E","","x-ray","1.54186","CuKα","","0.0664","0.057","","","0.1459","0.1531","","","","","","1.035","","","","has coordinates,has disorder","305411","2026-04-05","12:20:47",""
"7064282","9.2755","0.0002","16.9467","0.0002","24.313","0.0005","90","","94.373","0.002","90","","3810.61","0.12","100","","100","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C66 H80 B4 Cl2 F8 Fe N24 O10 -","- C66 H80 B4 Cl2 F8 Fe N24 O10 -","- C132 H160 B8 Cl4 F16 Fe2 N48 O20 -","2","0.5","","Schöbinger, Matthias; Huber, Martin; Stöger, Berthold; Weinberger, Peter","Linkage isomerism in a homoleptic Fe(ii) complex with BODIPY-1H-tetrazole ligands","New Journal of Chemistry","2026","50","10","4271","4277","10.1039/D5NJ03028E","","x-ray","1.54186","CuKα","","0.0545","0.0485","","","0.1253","0.1299","","","","","","1.061","","","","has coordinates","305411","2026-04-05","12:20:47",""
"7064283","13.1934","0.0006","15.1208","0.0006","18.2955","0.0008","88.901","0.003","90.465","0.004","85.38","0.003","3637.2","0.3","100","","100","","","","","","","","","8","P -1","-P 1","2","","","","- C60 H72 B4 Cl2 F8 Fe N24 O10 -","- C60 H72 B4 Cl2 F8 Fe N24 O10 -","- C120 H144 B8 Cl4 F16 Fe2 N48 O20 -","2","1","","Schöbinger, Matthias; Huber, Martin; Stöger, Berthold; Weinberger, Peter","Linkage isomerism in a homoleptic Fe(ii) complex with BODIPY-1H-tetrazole ligands","New Journal of Chemistry","2026","50","10","4271","4277","10.1039/D5NJ03028E","","x-ray","0.71073","MoKα","","0.1484","0.0695","","","0.1874","0.2079","","","","","","0.938","","","","has coordinates","305411","2026-04-05","12:20:47",""
"7064284","14.1696","0.0013","5.9807","0.0008","26.5375","0.0015","90","","93.217","0.003","90","","2245.4","0.4","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Aqua-bis(imidazole-N)-bis(methylbenzoato-O)-mangase(II)","","","- C22 H24 Mn N4 O5 -","- C22 H24 Mn N4 O5 -","- C88 H96 Mn4 N16 O20 -","4","1","","Sikdar, Papiya; Choudhuri, Tathagata; Das, Sourav; Paul, Suvam; Bagdi, Avik Kumar","Photocatalyst-free visible-light-induced cross-dehydrogenative sulfenylation of aminocoumarins and amino-1,4-naphthoquinones","New Journal of Chemistry","2026","50","9","4074","4079","10.1039/D5NJ04082E","","","0.71073","MoKα","","0.04","0.033","","","0.08","0.088","","","","","","1.123","","","","has coordinates","304940","2026-03-05","13:03:25",""
"7064285","8.4678","","4.9958","","9.9513","","90","","90","","90","","420.974","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Barium Europium Bromide Iodide (0.95/0.05/1.52/0.48)","","- Ba0.95 Br1.52 Eu0.05 I0.48 -","- Ba Br2 Eu I -","- Ba4 Br8 Eu4 I4 -","4","0.5","","Sikdar, Papiya; Choudhuri, Tathagata; Das, Sourav; Paul, Suvam; Bagdi, Avik Kumar","Photocatalyst-free visible-light-induced cross-dehydrogenative sulfenylation of aminocoumarins and amino-1,4-naphthoquinones","New Journal of Chemistry","2026","50","9","4074","4079","10.1039/D5NJ04082E","","","","","","0.0319","","","","","","","","","","","","","","","has coordinates","304940","2026-03-05","13:03:25",""
"7064286","13.27","0.0009","13.27","0.0009","14.494","0.002","90","","90","","120","","2210.3","0.4","296","2","296.15","","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- B15 K7 Mg O30 Y2 -","- B15 K7 Mg O30 Y2 -","- B45 K21 Mg3 O90 Y6 -","3","0.166667","","Liu, Haozhen; Du, Shiyu; Zhang, Paipai; Zhao, Jiawei; Chen, Yanna; An, Donghai","K7MgY2(B5O10)3: a novel ultraviolet nonlinear optical crystal based on the [B5O10] functional unit","New Journal of Chemistry","2026","50","9","4052","4058","10.1039/D5NJ04947D","","","0.71073","MoKα","","0.0226","0.0202","","","0.0453","0.046","","","","","","0.922","","","","has coordinates","304943","2026-03-05","13:04:03",""
"7064287","8.349","0.0002","9.2715","0.0002","15.566","0.0003","95.727","0.001","95.771","0.001","90.47","0.001","1192.64","0.04","295","","295","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H10 F N4 -","- C13 H10 F N4 -","- C52 H40 F4 N16 -","4","2","","Ge, Xuan; Cheng, Xuebo; Chen, Hualong; Tong, Jinghui; Zhang, Yongzhong; Liu, Yajing; Ai, Lin; Wu, Zehui","Species-dependent aromatase imaging in rodents, blood–brain barrier permeability, and tumor visualization with a novel 18F-labeled PET tracer, [18F]AromataPET-1","New Journal of Chemistry","2026","50","12","5156","5166","10.1039/D6NJ00151C","","","1.54184","CuKα","","0.086","0.0601","","","0.1759","0.1907","","","","","","1.075","","","","has coordinates","305426","2026-04-05","12:23:40",""
"7064288","3.6529","0.0002","31.8096","0.0012","14.7708","0.0006","90","","92.369","0.002","90","","1714.86","0.13","198","","198","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C7 H6 F N3 O4 -","- C7 H6 F N3 O4 -","- C56 H48 F8 N24 O32 -","8","2","","Yan, Yujie; Huang, Tao; Xiang, Yuge; Wang, Chengrong; Wang, Binshen; Luo, Liqiong; Peng, Rufang; Jin, Bo","Design and synthesis of fluorinated nitroaniline-fused carrier explosives","New Journal of Chemistry","2026","50","9","4146","4155","10.1039/D5NJ04260G","","x-ray","0.71073","MoKα","","0.0403","0.035","","","0.0792","0.0832","","","","","","1.059","","","","has coordinates","304941","2026-03-05","13:03:34",""
"7064289","8.06","0.004","16.847","0.009","8.157","0.004","90","","119.027","0.012","90","","968.5","0.9","293","2","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H3 F4 N3 O4 -","- C7 H3 F4 N3 O4 -","- C28 H12 F16 N12 O16 -","4","1","","Yan, Yujie; Huang, Tao; Xiang, Yuge; Wang, Chengrong; Wang, Binshen; Luo, Liqiong; Peng, Rufang; Jin, Bo","Design and synthesis of fluorinated nitroaniline-fused carrier explosives","New Journal of Chemistry","2026","50","9","4146","4155","10.1039/D5NJ04260G","","","0.71073","MoKα","","0.1094","0.0685","","","0.1367","0.1635","","","","","","1.116","","","","has coordinates","304941","2026-03-05","13:03:34",""
"7064290","7.777","0.0014","18.075","0.003","7.8704","0.0013","90","","96.382","0.006","90","","1099.5","0.3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H6 Cl N3 O3 S -","- C9 H6 Cl N3 O3 S -","- C36 H24 Cl4 N12 O12 S4 -","4","1","","Zaw, Hein Khant; Zhu, Li; Ju, Yichun; Jiang, Huijun; Wang, Yuan; Zhou, Ping; Yang, Yi; Gao, Han; Chen, Yuncong; Xiong, Zhixin; Zhang, Zhenqin","Unveiling the role of CO2 in the spontaneous formation of a platinum(ii)–amino acid complex","New Journal of Chemistry","2026","50","9","4196","4205","10.1039/D5NJ04356E","","","0.71073","MoKα","","0.0475","0.0424","","","0.1307","0.1404","","","","","","0.979","","","","has coordinates","304938","2026-03-05","13:03:09",""
"7064291","9.2786","0.0005","16.7335","0.001","21.5989","0.0012","107.902","0.002","92.782","0.002","98.599","0.002","3139.3","0.3","273.15","","273.15","","","","","","","","","4","P -1","-P 1","2","","HL","","- C42 H30 N2 O -","- C42 H30 N2 O -","- C168 H120 N8 O4 -","4","2","","Wang, Dan; Han, Rong-Rong; Li, Shu-Mu; Shao, Tian-Fen; Yang, Xiufang; Ma, Yangmin","D–π–A-type tetraphenylethylene-based AIEgen: multi-stimuli-responsive behavior and multilevel anti-counterfeiting applications","New Journal of Chemistry","2026","50","12","5231","5239","10.1039/D6NJ00063K","","","0.71073","MoKα","","0.1207","0.062","","","0.1426","0.1713","","","","","","1.03","","","","has coordinates","305422","2026-04-05","12:23:22",""
"7064292","13.2971","0.0009","13.2971","0.0009","18.6295","0.0017","90","","90","","120","","2852.6","0.4","193","","193","","","","","","","","","7","P 63/m","-P 6c","176","","","","- C42 H28 K2.74 Li0.26 Ni6 O15 S8 -","- C42 H27.999 K2.735 Li0.265 Ni6 O14.9994 S8 -","- C84 H55.998 K5.47 Li0.53 Ni12 O29.9988 S16 -","2","0.166667","","Liu, Yuanyuan; Lin, Xihao; Li, Xinhua; Zhang, Weibing; Yang, Zhi; Xu, Xiangju","The energy-storage mechanism of a battery-type coordination polymer electrode material for hybrid supercapacitors","New Journal of Chemistry","2026","50","10","4322","4332","10.1039/D5NJ04227E","","x-ray","0.71073","MoKα","","0.0805","0.0506","","","0.1067","0.1214","","","","","","1.026","","","","has coordinates,has disorder","305416","2026-04-05","12:21:58",""
"7064293","9.1739","0.0007","14.8378","0.0011","16.1206","0.0013","106.896","0.003","94.066","0.003","91.916","0.003","2091","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C15.36 H19.2 I2 N7.68 O3.84 -","- C15.36 H19.2 I2 N7.68 O3.84 -","- C61.44 H76.8 I8 N30.72 O15.36 -","4","2","","Isaia, Francesco; Aragoni, Maria Carla; Arca, Massimiliano; Demartin, Francesco; Garau, Alessandra; Lippolis, Vito; Pivetta, Tiziana; Podda, Enrico","Supramolecular architectures in the reaction products of caffeine with dihalogens: crystal structures of the CT-adduct bis(caffeine)-diiodine and the caffeinium iodine dichloride salt","New Journal of Chemistry","2026","50","12","5253","5265","10.1039/D5NJ05002B","","x-ray","0.71073","MoKα","","0.0404","0.0316","","","0.0741","0.0795","","","","","","1.091","","","","has coordinates,has disorder","305425","2026-04-05","12:23:38",""
"7064294","8.77","0.003","10.79","0.002","14.274","0.007","90","","91.77","0.03","90","","1350.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","caffeinium iodine dichloride","","","- C8 H11 Cl2 I N4 O2 -","- C8 H11 Cl2 I N4 O2 -","- C32 H44 Cl8 I4 N16 O8 -","4","1","","Isaia, Francesco; Aragoni, Maria Carla; Arca, Massimiliano; Demartin, Francesco; Garau, Alessandra; Lippolis, Vito; Pivetta, Tiziana; Podda, Enrico","Supramolecular architectures in the reaction products of caffeine with dihalogens: crystal structures of the CT-adduct bis(caffeine)-diiodine and the caffeinium iodine dichloride salt","New Journal of Chemistry","2026","50","12","5253","5265","10.1039/D5NJ05002B","","","0.71073","MoKα","","0.0824","0.0548","","","0.1403","0.1586","","","","","","1.033","","","","has coordinates","305425","2026-04-05","12:23:38",""
"7064295","8.26","0.0017","31.508","0.006","13.655","0.003","90","","90","","90","","3553.8","1.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C36 H32 Cu2 N2 O13 -","- C36 H32 Cu2 N2 O13 -","- C144 H128 Cu8 N8 O52 -","4","1","","Sang, Wuhan; Liu, Miaomiao; Xu, Li; Yang, Shilong; Wang, Yanqin; Zhang, Caihua; Lu, Wen","Evaluation of anticancer potential of a binuclear copper(ii) complex with a 3-(pyridin-3-yl) coumarin ligand: synthesis, crystal structure, magnetism, DNA interaction and molecular dynamics simulations","New Journal of Chemistry","2026","50","8","3482","3494","10.1039/D5NJ04590H","","","0.71073","MoKα","","0.2282","0.0844","","","0.1491","0.2077","","","","","","1.002","","","","has coordinates","304599","2026-02-24","01:54:41",""
"7064296","10.541","0.0004","15.7908","0.0005","16.3627","0.0007","108.584","0.003","102.988","0.003","105.227","0.003","2345","0.18","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C76 H72 N8 O8 -","- C76 H72 N8 O8 -","- C76 H72 N8 O8 -","1","0.5","","Kishimoto, Yuto; Katagiri, Hiroshi; Yamada, Manabu","Synthesis and crystal structure of a [2+4]-type organic cage based on calix[4]arene","New Journal of Chemistry","2026","50","8","3450","3456","10.1039/D5NJ03563E","","x-ray","0.71073","MoKα","","0.1539","0.1078","","","0.289","0.3154","","","","","","1.128","","","","has coordinates","304600","2026-02-24","01:54:53",""
"7064297","9.9287","0.0002","11.2711","0.0002","13.6153","0.0002","82.45","0.001","80.077","0.001","88.319","0.001","1487.81","0.05","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H30 Br Cl F6 N5 P Ru -","- C24 H30 Br Cl F6 N5 P Ru -","- C48 H60 Br2 Cl2 F12 N10 P2 Ru2 -","2","1","","Bhunya, Debasis; Datta, Riya; Maity, Swapan; Sahoo, Subhasish; Samanta, Bidhan Chandra","Engineering Ru(ii) Schiff base complexes as biofunctional materials: cytotoxic and cell imaging perspectives","New Journal of Chemistry","2026","50","12","5266","5276","10.1039/D6NJ00553E","","x-ray","0.71073","MoKα","","0.0556","0.046","","","0.1403","0.1459","","","","","","1.028","","","","has coordinates","305424","2026-04-05","12:23:35",""
"7064298","17.9849","0.0017","14.7321","0.0013","31.121","0.003","90","","91.603","0.004","90","","8242.4","1.3","120","2","120","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C60.6 H46.7 F18 Ho2 N3.5 O15.5 -","- C55.418 H33.582 F18 Ho2 N2 O14 -","- C221.672 H134.328 F72 Ho8 N8 O56 -","4","1","","Princík, Dávid; Zeleňák, Vladimír; Gyepes, Róbert; Čižmár, Erik; Zeleňáková, Adriána; Zelenková, Gabriela; Elečko, Ján","Structure, spectral, thermal, and magnetic properties, and hydrolytic stability of three novel fluorinated MOFs based on Ho(iii), Dy(iii), and Yb(iii) ions","New Journal of Chemistry","2026","50","12","5334","5352","10.1039/D5NJ04235F","","x-ray","1.54178","CuKα","","0.0596","0.0518","","","0.1468","0.1553","","","","","","1.023","","","","has coordinates,has disorder","305423","2026-04-05","12:23:32",""
"7064299","8.0141","0.0008","14.6271","0.0015","21.274","0.002","104.827","0.002","97.524","0.002","101.728","0.002","2315.9","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H34 F12 N2 O14 Yb2 -","- C43 H34 F12 N2 O14 Yb2 -","- C86 H68 F24 N4 O28 Yb4 -","2","1","","Princík, Dávid; Zeleňák, Vladimír; Gyepes, Róbert; Čižmár, Erik; Zeleňáková, Adriána; Zelenková, Gabriela; Elečko, Ján","Structure, spectral, thermal, and magnetic properties, and hydrolytic stability of three novel fluorinated MOFs based on Ho(iii), Dy(iii), and Yb(iii) ions","New Journal of Chemistry","2026","50","12","5334","5352","10.1039/D5NJ04235F","","x-ray","0.71073","MoKα","","0.0238","0.0196","","","0.0427","0.045","","","","","","1.093","","","","has coordinates,has disorder","305423","2026-04-05","12:23:32",""
"7064300","11.805","0.001","11.9329","0.001","13.5763","0.0012","103.728","0.007","91.311","0.007","104.029","0.008","1795.8","0.3","297","","297","","","","","","","","","4","P -1","-P 1","2","","","","- C40 H34 N10 O2 -","- C40 H34 N10 O2 -","- C80 H68 N20 O4 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","x-ray","0.71073","MoKα","","0.1661","0.0745","","","0.1679","0.2329","","","","","","1.019","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064301","13.5754","0.0009","10.0125","0.0007","12.8537","0.0008","90","","94.76","0.002","90","","1741.1","0.2","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17 N5 O -","- C20 H17 N5 O -","- C80 H68 N20 O4 -","4","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","","0.71073","MoKα","","0.146","0.0805","","","0.1348","0.1672","","","","","","1.169","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064302","9.992","0.005","12.228","0.006","17.586","0.009","90","","97.053","0.015","90","","2132.4","1.9","297","","297","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H23 N -","- C28 H23 N -","- C112 H92 N4 -","4","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","","0.71073","MoKα","","0.1681","0.0997","","","0.2084","0.2461","","","","","","1.153","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064303","8.3384","0.0009","10.0478","0.0006","10.3112","0.0007","73.262","0.006","83.132","0.007","82.57","0.007","817.26","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Imidazopy2Cl","","- C19 H14 Cl N5 -","- C19 H14 Cl N5 -","- C38 H28 Cl2 N10 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","x-ray","0.71073","MoKα","","0.0676","0.0465","","","0.1146","0.1347","","","","","","1.064","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064304","6.7421","0.0005","11.079","0.0013","12.2068","0.0015","75.582","0.01","74.358","0.008","87.772","0.007","849.98","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H14 Br N5 -","- C19 H14 Br N5 -","- C38 H28 Br2 N10 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","x-ray","0.71073","MoKα","","0.1261","0.0732","","","0.1652","0.2051","","","","","","0.995","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064305","29.778","0.009","29.778","0.009","26.221","0.012","90","","90","","90","","23251","15","298","","298","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C61 H83 Cl3 N17 O9 Pd2 -","- C40 H34 Cl3 N10 O2 Pd2 -","- C640 H544 Cl48 N160 O32 Pd32 -","16","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","","0.71073","MoKα","","0.1494","0.0921","","","0.1627","0.1912","","","","","","1.045","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064306","8.0457","0.0003","17.7155","0.0006","23.531","0.0008","90","","91.909","0.001","90","","3352.1","0.2","298","","298","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 N5 -","- C20 H17 N5 -","- C160 H136 N40 -","8","2","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","","0.71073","MoKα","","0.0771","0.0512","","","0.111","0.1293","","","","","","1.108","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064307","11.5271","0.0016","16.201","0.002","19.385","0.003","74.945","0.004","75.354","0.004","74.117","0.004","3297.4","0.8","298","","298","","","","","","","","","8","P -1","-P 1","2","","","","- C4.45 H5 Cl0.18 F1.09 N1.18 O0.27 P0.18 Pd0.18 -","- C4.45455 H5 Cl0.181818 F1.09091 N1.18182 O0.272727 P0.181818 Pd0.181818 -","- C98 H110 Cl4 F24 N26 O6 P4 Pd4 -","22","11","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","","0.71073","MoKα","","0.0763","0.0591","","","0.1539","0.1748","","","","","","1.032","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064308","13.7618","0.0008","14.285","0.0008","14.7187","0.0009","81.543","0.002","88.825","0.002","86.568","0.002","2856.7","0.3","297","","297","","","","","","","","","9","P -1","-P 1","2","","","","- C47 H49 Br2 Cl2 F12 N13 O3 P2 Pd2 -","- C41 H35 Br2 Cl2 F12 N11 O P2 Pd2 -","- C82 H70 Br4 Cl4 F24 N22 O2 P4 Pd4 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","","0.71073","MoKα","","0.0934","0.0561","","","0.1415","0.1768","","","","","","1.054","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064309","14.662","0.002","17.696","0.002","19.747","0.003","68.86","0.004","78.938","0.004","88.158","0.004","4686.1","1.1","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C91.25 H94.25 Cl4 N23.75 O7.75 Pd4 -","- C80 H68 Cl4 N20 O4 Pd4 -","- C160 H136 Cl8 N40 O8 Pd8 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","x-ray","0.71073","MoKα","","0.1616","0.0897","","","0.2205","0.3133","","","","","","1.086","","","","has coordinates","305420","2026-04-05","12:23:10",""
"7064310","12.611","0.003","13.376","0.003","14.162","0.003","71.22","0.005","80.398","0.005","78.127","0.005","2200.3","0.9","299","","299","","","","","","","","","6","P -1","-P 1","2","","2413Pd","","- C45.5 H45.5 Cl4 N12.5 O2.5 Pd2 -","- C38 H28 Cl4 N10 Pd2 -","- C76 H56 Cl8 N20 Pd4 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Dinuclear palladium(ii) complexes of N-(imidazo[1,5-a]pyridin-1-yl)picolinimidamides: highly active catalysts for C–C and C–P bond formation","New Journal of Chemistry","2026","50","13","5541","5550","10.1039/D5NJ04746C","","x-ray","0.71073","MoKα","","0.0439","0.0343","","","0.0912","0.1016","","","","","","1.099","","","","has coordinates,has disorder","305420","2026-04-05","12:23:10",""
"7064311","15.2981","0.0012","9.4511","0.0008","12.1139","0.0011","90","","95.35","0.005","90","","1743.8","0.3","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H26 N2 O3 -","- C17 H26 N2 O3 -","- C68 H104 N8 O12 -","4","1","","Avala, Priyanka; Kumar, Malavika S.; Das, Avijit Kumar; Sardar, Ankan; Maity, Tilak Raj; Samanta, Aveek; Dolai, Malay","Mechanistic elucidation of irreversible chemodosimetric sensing of hydrazine through structural, computational, and bioimaging analyses","New Journal of Chemistry","2026","50","1","433","440","10.1039/D5NJ04044B","","","0.71073","MoKα","","0.1423","0.0929","","","0.2538","0.2803","","","","","","1.181","","","","has coordinates","304782","2026-03-04","22:00:15",""
"7064312","9.341","0.0002","12.3538","0.0003","19.841","0.0005","90","","90","","90","","2289.59","0.09","304.6","0.2","304.6","0.2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C H N O -","- C2.4186 H2.13953 N0.465116 O0.27907 -","- C104 H92 N20 O12 -","43","10.75","","Sathish, Kota; Majhi, Subir; Parida, Ankita; Nagaraju, Sakkani; Kashinath, Dhurke","Solvent directed base-enabled diastereodivergent domino cycloaddition of isoxazole–oxindole styrenes and Michael additions of isoxazole–styrenes with vinyl malononitriles","New Journal of Chemistry","2026","50","5","2350","2355","10.1039/D5NJ03725E","","x-ray","0.71073","MoKα","","0.0794","0.0599","","","0.1617","0.1825","","","","","","1.055","","","","has coordinates","304783","2026-03-04","22:01:41",""
"7064313","11.5473","0.0003","13.99","0.0004","14.7675","0.0003","80.6","0.002","89.223","0.002","77.075","0.002","2293.32","0.1","304.9","","304.9","","","","","","","","","4","P -1","-P 1","2","","","","- C25 H23 N5 O4 -","- C25 H23 N5 O4 -","- C100 H92 N20 O16 -","4","2","","Sathish, Kota; Majhi, Subir; Parida, Ankita; Nagaraju, Sakkani; Kashinath, Dhurke","Solvent directed base-enabled diastereodivergent domino cycloaddition of isoxazole–oxindole styrenes and Michael additions of isoxazole–styrenes with vinyl malononitriles","New Journal of Chemistry","2026","50","5","2350","2355","10.1039/D5NJ03725E","","x-ray","0.71073","MoKα","","0.089","0.0552","","","0.152","0.1738","","","","","","1.076","","","","has coordinates","304783","2026-03-04","22:01:41",""
"7064314","9.5829","0.0005","9.6101","0.0005","12.9002","0.0008","90","","110.305","0.002","90","","1114.19","0.11","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 N6 O2 Zn -","- C26 H22 N6 O2 Zn -","- C52 H44 N12 O4 Zn2 -","2","0.5","","Tran, Vy-Phuong; Kundu, Arup; Scott, Madelyn N.; Iwanicki, Ainsley; Nalaoh, Phattananawee; Diers, James R.; Taniguchi, Masahiko; Bocian, David F.; Schlau-Cohen, Gabriela S.; Lindsey, Jonathan S.","Synthesis and characterization of 5,15-bis(hydroxymethyl)porphyrins – simple compounds distantly inspired by the chlorosomal bacteriochlorophylls","New Journal of Chemistry","2026","50","4","1990","2004","10.1039/D5NJ04118J","","","0.71073","MoKα","","0.0352","0.0322","","","0.0861","0.0891","","","","","","1.058","","","","has coordinates","304784","2026-03-04","22:02:23",""
"7064315","8.2431","0.0015","10.46","0.002","11.845","0.002","106.04","0.006","105.616","0.005","106.667","0.006","870.4","0.3","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H44 N4 O2 Zn -","- C44 H44 N4 O2 Zn -","- C44 H44 N4 O2 Zn -","1","0.5","","Tran, Vy-Phuong; Kundu, Arup; Scott, Madelyn N.; Iwanicki, Ainsley; Nalaoh, Phattananawee; Diers, James R.; Taniguchi, Masahiko; Bocian, David F.; Schlau-Cohen, Gabriela S.; Lindsey, Jonathan S.","Synthesis and characterization of 5,15-bis(hydroxymethyl)porphyrins – simple compounds distantly inspired by the chlorosomal bacteriochlorophylls","New Journal of Chemistry","2026","50","4","1990","2004","10.1039/D5NJ04118J","","","0.71073","MoKα","","0.0353","0.0345","","","0.0852","0.0858","","","","","","1.067","","","","has coordinates","304784","2026-03-04","22:02:23",""
"7064316","5.077","0.0008","15.715","0.003","23.357","0.003","90","","90","","90","","1863.5","0.5","100","","100","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H20 N4 Zn -","- C24 H20 N4 Zn -","- C96 H80 N16 Zn4 -","4","0.5","","Tran, Vy-Phuong; Kundu, Arup; Scott, Madelyn N.; Iwanicki, Ainsley; Nalaoh, Phattananawee; Diers, James R.; Taniguchi, Masahiko; Bocian, David F.; Schlau-Cohen, Gabriela S.; Lindsey, Jonathan S.","Synthesis and characterization of 5,15-bis(hydroxymethyl)porphyrins – simple compounds distantly inspired by the chlorosomal bacteriochlorophylls","New Journal of Chemistry","2026","50","4","1990","2004","10.1039/D5NJ04118J","","","0.71073","MoKα","","0.061","0.0469","","","0.1099","0.1182","","","","","","1.13","","","","has coordinates","304784","2026-03-04","22:02:23",""
"7064317","6.3194","0.0008","14.9366","0.0016","34.979","0.005","90","","90.408","0.004","90","","3301.6","0.7","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H24 N4 O2 Zn -","- C34 H24 N4 O2 Zn -","- C136 H96 N16 O8 Zn4 -","4","1","","Tran, Vy-Phuong; Kundu, Arup; Scott, Madelyn N.; Iwanicki, Ainsley; Nalaoh, Phattananawee; Diers, James R.; Taniguchi, Masahiko; Bocian, David F.; Schlau-Cohen, Gabriela S.; Lindsey, Jonathan S.","Synthesis and characterization of 5,15-bis(hydroxymethyl)porphyrins – simple compounds distantly inspired by the chlorosomal bacteriochlorophylls","New Journal of Chemistry","2026","50","4","1990","2004","10.1039/D5NJ04118J","","x-ray","0.71073","MoKα","","0.0496","0.0442","","","0.1021","0.1046","","","","","","1.074","","","","has coordinates","304784","2026-03-04","22:02:23",""
"7064318","10.5276","0.0011","11.5823","0.0012","10.782","0.0012","90","","95.162","0.003","90","","1309.4","0.2","296","2","296.15","","","","","","","","","7","P 1 21 1","P 2yb","4","","N-(6-iodo-1,1,7-trimethyldecahydro-3a,7-methanocyclopenta[8]annulen-3-yl)-N'-((4-(trifluoromethyl)phenyl)sulfonyl)acetimidamide","","- C24 H32 F3 I N2 O2 S -","- C24 H32 F3 I N2 O2 S -","- C48 H64 F6 I2 N4 O4 S2 -","2","1","","Moskalik, Mikhail Yu.; Garagan, Ivan A.; Myasnikova, Valentina S.; Borodina, Tatyana N.; Shainyan, Bagrat A.","Skeletal rearrangements and structures of halosulfonamidation products of caryophyllene","New Journal of Chemistry","2026","50","4","1935","1942","10.1039/D5NJ03976B","","","0.71073","MoKα","","0.0578","0.0436","","","0.1122","0.1204","","","","","","1.034","","","","has coordinates","304785","2026-03-04","22:02:52",""
"7064319","7.2852","0.0009","16.239","0.002","18.497","0.003","90","","90","","90","","2188.3","0.5","296","2","296.15","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","N-(9-iodo-4,4,8-trimethyltricyclo[6.3.1.0^2,5]dodecan-1-yl)-N'-((trifluoromethyl)sulfonyl)acetimidamide","","- C18 H28 F3 I N2 O2 S -","- C18 H28 F3 I N2 O2 S -","- C72 H112 F12 I4 N8 O8 S4 -","4","1","","Moskalik, Mikhail Yu.; Garagan, Ivan A.; Myasnikova, Valentina S.; Borodina, Tatyana N.; Shainyan, Bagrat A.","Skeletal rearrangements and structures of halosulfonamidation products of caryophyllene","New Journal of Chemistry","2026","50","4","1935","1942","10.1039/D5NJ03976B","","","0.71073","MoKα","","0.0692","0.0321","","","0.0741","0.0801","","","","","","0.991","","","","has coordinates","304785","2026-03-04","22:02:52",""
"7064320","7.3387","0.0005","8.9043","0.0006","32.227","0.002","90","","90","","90","","2105.9","0.2","296","2","296.15","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","N-(6-bromo-1,1,7-trimethyldecahydro-3a,7-methanocyclopenta[8]annulen-3-yl)-N'-((trifluoromethyl)sulfonyl)acetimidamide","","- C18 H28 Br F3 N2 O2 S -","- C18 H28 Br F3 N2 O2 S -","- C72 H112 Br4 F12 N8 O8 S4 -","4","1","","Moskalik, Mikhail Yu.; Garagan, Ivan A.; Myasnikova, Valentina S.; Borodina, Tatyana N.; Shainyan, Bagrat A.","Skeletal rearrangements and structures of halosulfonamidation products of caryophyllene","New Journal of Chemistry","2026","50","4","1935","1942","10.1039/D5NJ03976B","","","1.54178","CuKα","","0.0307","0.029","","","0.0712","0.0722","","","","","","1.063","","","","has coordinates","304785","2026-03-04","22:02:52",""
"7064321","10.3167","0.0013","10.7257","0.0014","11.5944","0.0014","90.113","0.004","93.196","0.004","93.055","0.004","1279.1","0.3","296","2","296.15","","","","","","","","","7","P 1","P 1","1","","N-(6-bromo-1,1,7-trimethyldecahydro-3a,7-methanocyclopenta[8]annulen-3-yl)-N'-((4-(trifluoromethyl)phenyl)sulfonyl)acetimidamide","","- C24 H32 Br F3 N2 O2 S -","- C24 H32 Br F3 N2 O2 S -","- C48 H64 Br2 F6 N4 O4 S2 -","2","2","","Moskalik, Mikhail Yu.; Garagan, Ivan A.; Myasnikova, Valentina S.; Borodina, Tatyana N.; Shainyan, Bagrat A.","Skeletal rearrangements and structures of halosulfonamidation products of caryophyllene","New Journal of Chemistry","2026","50","4","1935","1942","10.1039/D5NJ03976B","","","0.71073","MoKα","","0.0961","0.0555","","","0.1371","0.1505","","","","","","1.048","","","","has coordinates","304785","2026-03-04","22:02:52",""
"7064322","7.2188","0.001","15.8711","0.0018","18.129","0.003","90","","98.025","0.005","90","","2056.7","0.5","296","2","296.15","","","","","","","","","6","P 1 21 1","P 2yb","4","","N-(9-iodo-4,4,8-trimethyltricyclo[6.3.1.0^2,5]dodecan-1-yl)-N'- (methylsulfonyl)acetimidamide","","- C18 H31 I N2 O2 S -","- C18 H31 I N2 O2 S -","- C72 H124 I4 N8 O8 S4 -","4","2","","Moskalik, Mikhail Yu.; Garagan, Ivan A.; Myasnikova, Valentina S.; Borodina, Tatyana N.; Shainyan, Bagrat A.","Skeletal rearrangements and structures of halosulfonamidation products of caryophyllene","New Journal of Chemistry","2026","50","4","1935","1942","10.1039/D5NJ03976B","","","0.71073","MoKα","","0.1359","0.0455","","","0.0894","0.1004","","","","","","1.048","","","","has coordinates","304785","2026-03-04","22:02:53",""
"7064323","7.4384","0.0003","15.5722","0.0006","29.4061","0.0011","90","","90","","90","","3406.2","0.2","100","2","100","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C36 H28 Cl2 N6 O7 Re2 -","- C36 H28 Cl2 N6 O7 Re2 -","- C144 H112 Cl8 N24 O28 Re8 -","4","1","","Sithole, Sibusiso A.; Mansour, Ahmed M.; Malan, Frederick P.; Manikandan, Gurusamy; Katerere, David R.; Shehab, Ola R.; Manicum, Amanda-Lee E.","Structural and antimicrobial studies on a tricarbonyl rhenium(i) complex with the 6,7-dimethyl-2-(pyridin-2-yl)quinoxaline ligand","New Journal of Chemistry","2026","50","4","1844","1856","10.1039/D5NJ04125B","","","0.71073","MoKα","","0.0275","0.0272","","","0.0612","0.0613","","","","","","1.188","","","","has coordinates","304786","2026-03-04","22:03:14",""
"7064324","11.9662","0.0004","7.4448","0.0003","26.0051","0.0009","90","","90","","90","","2316.69","0.15","150","0.1","150","0.1","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C15 H13 N3 -","- C15 H13 N3 -","- C120 H104 N24 -","8","1","","Sithole, Sibusiso A.; Mansour, Ahmed M.; Malan, Frederick P.; Manikandan, Gurusamy; Katerere, David R.; Shehab, Ola R.; Manicum, Amanda-Lee E.","Structural and antimicrobial studies on a tricarbonyl rhenium(i) complex with the 6,7-dimethyl-2-(pyridin-2-yl)quinoxaline ligand","New Journal of Chemistry","2026","50","4","1844","1856","10.1039/D5NJ04125B","","x-ray","0.71073","MoKα","","0.0499","0.0406","","","0.1159","0.1222","","","","","","1.049","","","","has coordinates","304786","2026-03-04","22:03:15",""
"7064325","5.385","0.0006","10.5397","0.0009","14.0749","0.0014","87.615","0.007","82.484","0.009","78.659","0.008","776.41","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","(Z)-3-(butylamino)-4,4,4-trifluoro-1-(2-hydroxy-5-nitrophenyl)but-2-en-1-one","","- C14 H15 F3 N2 O4 -","- C14 H15 F3 N2 O4 -","- C28 H30 F6 N4 O8 -","2","1","","Jios, Eliana; Salvador Vallejo, Lorena E.; Echeverría, Gustavo A.; Piro, Oscar E.; Jios, Jorge L.; Naso, Luciana G.; Ulic, Sonia E.","Hydrogen bonding and charge transfer in trifluoromethylated β-aminoenones: a combined experimental and theoretical study","New Journal of Chemistry","2026","50","4","1809","1823","10.1039/D5NJ04291G","","x-ray","0.71073","MoKα","","0.1587","0.078","","","0.2149","0.2887","","","","","","1.034","","","","has coordinates","304787","2026-03-04","22:03:31",""
"7064326","5.0511","0.0003","15.3395","0.0007","14.7473","0.0011","90","","94.606","0.007","90","","1138.95","0.12","293","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2Z)-3-amino-4,4,4-trifluoro-1-(2-hidroxy-5-nitrophenyl)but-2-en-1-one","","- C10 H7 F3 N2 O4 -","- C10 H7 F3 N2 O4 -","- C40 H28 F12 N8 O16 -","4","1","","Jios, Eliana; Salvador Vallejo, Lorena E.; Echeverría, Gustavo A.; Piro, Oscar E.; Jios, Jorge L.; Naso, Luciana G.; Ulic, Sonia E.","Hydrogen bonding and charge transfer in trifluoromethylated β-aminoenones: a combined experimental and theoretical study","New Journal of Chemistry","2026","50","4","1809","1823","10.1039/D5NJ04291G","","x-ray","0.71073","MoKα","","0.0938","0.0607","","","0.1612","0.1884","","","","","","1.035","","","","has coordinates","304787","2026-03-04","22:03:31",""
"7064327","9.211","0.0001","8.0189","0.0001","29.0172","0.0002","90","","93.288","0.001","90","","2139.74","0.04","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 Mo N2 O8 S -","- C19 H22 Mo N2 O8 S -","- C76 H88 Mo4 N8 O32 S4 -","4","1","","Nafisa,; Rana, Lata; Mahiya, Kuldeep","Catalytic oxidation of tetralin by dioxomolybdenum complexes: design, synthesis, characterization and DFT investigations","New Journal of Chemistry","2026","50","2","798","809","10.1039/D5NJ04083C","","x-ray","1.54184","CuKα","","0.0284","0.0246","","","0.0634","0.0654","","","","","","1.06","","","","has coordinates","304788","2026-03-04","22:04:29",""
"7064328","8.574","0.0001","16.4334","0.0001","14.3946","0.0001","90","","93.908","0.001","90","","2023.48","0.03","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 Mo N2 O7 S -","- C18 H20 Mo N2 O7 S -","- C72 H80 Mo4 N8 O28 S4 -","4","1","","Nafisa,; Rana, Lata; Mahiya, Kuldeep","Catalytic oxidation of tetralin by dioxomolybdenum complexes: design, synthesis, characterization and DFT investigations","New Journal of Chemistry","2026","50","2","798","809","10.1039/D5NJ04083C","","x-ray","1.54184","CuKα","","0.0229","0.0214","","","0.0571","0.0579","","","","","","1.048","","","","has coordinates,has disorder","304788","2026-03-04","22:04:29",""
"7064329","8.4494","0.0002","11.4162","0.0003","12.3491","0.0003","65.537","0.002","79.809","0.002","83.735","0.002","1066.3","0.05","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C18 H19 Cl Mo N2 O7 S -","- C18 H19 Cl Mo N2 O7 S -","- C36 H38 Cl2 Mo2 N4 O14 S2 -","2","1","","Nafisa,; Rana, Lata; Mahiya, Kuldeep","Catalytic oxidation of tetralin by dioxomolybdenum complexes: design, synthesis, characterization and DFT investigations","New Journal of Chemistry","2026","50","2","798","809","10.1039/D5NJ04083C","","x-ray","1.54184","CuKα","","0.0302","0.0291","","","0.0783","0.0793","","","","","","1.053","","","","has coordinates","304788","2026-03-04","22:04:30",""
"7064330","9","0.004","11.709","0.006","13.983","0.007","111.08","0.02","90.57","0.03","105.13","0.02","1318.4","1.1","110","","110","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H24 Cl2 N2 O2 Pt S -","- C27 H24 Cl2 N2 O2 Pt S -","- C54 H48 Cl4 N4 O4 Pt2 S2 -","2","1","","İrişli, Sevil; Doğan, Umut; Günnaz, Salih; Yurt, Fatma; Şahin, Onur","Novel Schiff base-Pt(ii) complexes: inhibition of Aβ aggregation via histidine interaction","New Journal of Chemistry","2026","50","2","1125","1138","10.1039/D5NJ04180E","","","0.71073","MoKα","","0.0806","0.052","","","0.1066","0.1171","","","","","","1.063","","","","has coordinates","304789","2026-03-04","22:04:44",""
"7064331","8.4878","0.0008","11.0977","0.0011","11.1379","0.0011","111.827","0.003","109.312","0.003","93.968","0.003","896.74","0.16","273","","273","","","","","","","","","7","P -1","-P 1","2","","","","- C15 H18 Cl N5 O2 Pd S -","- C15 H18 Cl N5 O2 Pd S -","- C30 H36 Cl2 N10 O4 Pd2 S2 -","2","1","","Nandhini, S.; Dharani, S.; Mugesh, B.; Prabusankar, G.; Mohanapriya, S.; Shankar, R.; Prabhakaran, R.","Bromoamination of α,β-unsaturated keto alkenes by palladium(ii) metalallocycles: experimental and theoretical approaches","New Journal of Chemistry","2026","50","3","1602","1612","10.1039/D5NJ02138C","","","0.71073","MoKα","","0.0553","0.0355","","","0.0798","0.0876","","","","","","1.0319","","","","has coordinates","304790","2026-03-04","22:07:58",""
"7064332","7.5069","0.0008","12.9454","0.0014","12.9847","0.0014","61.465","0.003","88.838","0.004","85.449","0.004","1104.8","0.2","273","2","273.15","","","","","","","","","7","P -1","-P 1","2","","","","- C21 H21 Cl N5 O2 Pd S -","- C21 H21 Cl N5 O2 Pd S -","- C42 H42 Cl2 N10 O4 Pd2 S2 -","2","1","","Nandhini, S.; Dharani, S.; Mugesh, B.; Prabusankar, G.; Mohanapriya, S.; Shankar, R.; Prabhakaran, R.","Bromoamination of α,β-unsaturated keto alkenes by palladium(ii) metalallocycles: experimental and theoretical approaches","New Journal of Chemistry","2026","50","3","1602","1612","10.1039/D5NJ02138C","","","0.71073","MoKα","","0.098","0.0871","","","0.2998","0.3094","","","","","","1.0377","","","","has coordinates","304790","2026-03-04","22:07:59",""
"7064333","8.6492","0.0003","10.9746","0.0004","11.5173","0.0004","69.71","0.001","68.738","0.001","89.247","0.001","947.64","0.06","273","","273","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H20 Cl N5 O2 Pd S -","- C16 H20 Cl N5 O2 Pd S -","- C32 H40 Cl2 N10 O4 Pd2 S2 -","2","1","","Nandhini, S.; Dharani, S.; Mugesh, B.; Prabusankar, G.; Mohanapriya, S.; Shankar, R.; Prabhakaran, R.","Bromoamination of α,β-unsaturated keto alkenes by palladium(ii) metalallocycles: experimental and theoretical approaches","New Journal of Chemistry","2026","50","3","1602","1612","10.1039/D5NJ02138C","","","0.71073","MoKα","","0.0301","0.0253","","","0.0656","0.0683","","","","","","1.0563","","","","has coordinates","304790","2026-03-04","22:07:59",""
"7064334","11.1748","0.0008","8.1368","0.0004","18.37","0.0013","90","","107.57","0.007","90","","1592.41","0.19","100","0.1","100","0.1","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C15 H20 Co N3 O3 S -","- C15 H20 Co N3 O3 S -","- C60 H80 Co4 N12 O12 S4 -","4","1","","Malik, Suvamoy; Jana, Narayan Ch.; Saren, Shibnath; Saha, Amrita","Chelate ligand-driven structural diversity and modeling studies on the phenoxazinone synthase-like activity of cobalt(iii) complexes","New Journal of Chemistry","2026","50","13","5669","5678","10.1039/D5NJ05015D","","","0.71073","MoKα","","0.0439","0.0353","","","0.0903","0.0952","","","","","","1.052","","","","has coordinates","305419","2026-04-05","12:22:57",""
"7064335","12.0785","0.0005","14.3615","0.0005","14.9258","0.0006","90","","103.188","0.004","90","","2520.83","0.17","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H28 Co N3 O5 S -","- C25 H28 Co N3 O5 S -","- C100 H112 Co4 N12 O20 S4 -","4","1","","Malik, Suvamoy; Jana, Narayan Ch.; Saren, Shibnath; Saha, Amrita","Chelate ligand-driven structural diversity and modeling studies on the phenoxazinone synthase-like activity of cobalt(iii) complexes","New Journal of Chemistry","2026","50","13","5669","5678","10.1039/D5NJ05015D","","","0.71073","MoKα","","0.1673","0.1041","","","0.2069","0.2435","","","","","","1.122","","","","has coordinates","305419","2026-04-05","12:22:57",""
"7064336","13.3857","0.0004","13.408","0.0003","15.7779","0.0004","90","","90","","90","","2831.75","0.13","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","30%Mn:C6H14N2O?CdBr4","","- C4 H10.67 Br2.67 Cd0.55 Mn0.12 N1.33 O0.67 -","- C4 H10.6667 Br2.66667 Cd0.546667 Mn0.12 N1.33333 O0.666667 -","- C48 H128 Br32 Cd6.56 Mn1.44 N16 O8 -","12","1.5","","Li, Jinwei; Jin, Yuling; Xu, Zhihuang; Ye, Liwang; Wu, Diwei; Yan, Kailun; Zhuang, Xinxin","Mn(ii)-doped zero-dimensional hybrid Cd bromide with efficient green emission","New Journal of Chemistry","2026","50","15","6367","6371","10.1039/D6NJ00543H","","x-ray","1.54184","CuKα","","0.0439","0.0354","","","0.0939","0.1003","","","","","","1.033","","","","has coordinates,has disorder","305842","2026-05-05","09:29:50",""
"7064337","13.3903","0.0002","13.4096","0.0002","15.8024","0.0002","90","","90","","90","","2837.46","0.07","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","C6H14N2O?CdBr4","","- C4 H10.67 Br2.67 Cd0.67 N1.33 O0.67 -","- C4 H10.6667 Br2.66667 Cd0.666667 N1.33333 O0.666667 -","- C48 H128 Br32 Cd8 N16 O8 -","12","1.5","","Li, Jinwei; Jin, Yuling; Xu, Zhihuang; Ye, Liwang; Wu, Diwei; Yan, Kailun; Zhuang, Xinxin","Mn(ii)-doped zero-dimensional hybrid Cd bromide with efficient green emission","New Journal of Chemistry","2026","50","15","6367","6371","10.1039/D6NJ00543H","","x-ray","1.54184","CuKα","","0.0334","0.029","","","0.0752","0.0785","","","","","","1.044","","","","has coordinates","305842","2026-05-05","09:29:50",""
"7064338","11.422","0.0018","13.846","0.002","23.515","0.004","90","","94.321","0.005","90","","3708.3","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H35 Co N6 O11 -","- C39 H35 Co N6 O11 -","- C156 H140 Co4 N24 O44 -","4","1","","Sun, Yi-Lian; Wan, Jia-Qi; He, Ying; Lv, Bin; Zhou, Shi-Yu; Li, Si-Tong; Liu, Yu; Li, Wen-Ze; Luan, Jian; Zhang, Xiao-Sa","Cobalt-based metal–organic framework derived Co/CoO@C under moderate temperature for improving the performance of photocatalytic degradation of organic pollutants","New Journal of Chemistry","2026","50","15","6280","6288","10.1039/D5NJ03932K","","","0.71073","MoKα","","0.0811","0.046","","","0.1122","0.1303","","","","","","1.011","","","","has coordinates,has disorder","305841","2026-05-05","09:29:47",""
"7064339","7.4167","0.0002","11.8025","0.0003","13.2319","0.0004","114.554","0.001","92.49","0.001","96.267","0.001","1042.16","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H22 N4 O6 -","- C22 H22 N4 O6 -","- C44 H44 N8 O12 -","2","1","","Borth, Ketlyn Wolfart; Leal, Letícia dos Santos; Teixeira, Verônica de Carvalho; da Rocha, Grazielli; Simões, Tatiana Renata Gomes","Hybrid azine–oxamic acid molecular design: synthesis, structure, and supramolecular implications","New Journal of Chemistry","2026","50","18","7619","7634","10.1039/D5NJ04656D","","","1.54184","CuKα","","0.047","0.0382","","","0.0853","0.0905","","","","","","1.115","","","","has coordinates","306474","2026-06-05","19:28:33",""
"7064340","13.269","0.004","5.3039","0.0006","24.374","0.004","90","","105.583","0.015","90","","1652.3","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H38 N4 O10 S4 -","- C26 H38 N4 O10 S4 -","- C52 H76 N8 O20 S8 -","2","0.5","","Borth, Ketlyn Wolfart; Leal, Letícia dos Santos; Teixeira, Verônica de Carvalho; da Rocha, Grazielli; Simões, Tatiana Renata Gomes","Hybrid azine–oxamic acid molecular design: synthesis, structure, and supramolecular implications","New Journal of Chemistry","2026","50","18","7619","7634","10.1039/D5NJ04656D","","","1.54178","CuKα","","0.0334","0.0328","","","0.0878","0.0886","","","","","","1.061","","","","has coordinates","306474","2026-06-05","19:28:33",""
"7064341","11.5962","0.0002","19.0791","0.0003","13.6158","0.0002","90","","91.535","0.001","90","","3011.35","0.08","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H29 N3 O4 Sn -","- C34 H29 N3 O4 Sn -","- C136 H116 N12 O16 Sn4 -","4","1","","Das, Anisha; Nama, Debabrata; Majumder, Chinmoy; Roy, Subhadip; Singh, S. Sureshkumar; Sandham, Alka; Singh, Salam Pradeep; Roy, Manojit; Misra, Tarun Kumar","Crystallographic, topological, antidiabetic, and docking evaluation of an azo-enamine ligand and its triphenyltin(iv) coordination polymer","New Journal of Chemistry","2026","50","17","7142","7151","10.1039/D5NJ03575A","","","1.54178","CuKα","","0.0359","0.0307","","","0.071","0.0748","","","","","","1.077","","","","has coordinates","306454","2026-06-05","19:25:19",""
"7064342","4.3533","0.0003","12.7658","0.0009","26.8421","0.0018","90","","90","","90","","1491.71","0.18","298","","298","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N3 O4 -","- C16 H15 N3 O4 -","- C64 H60 N12 O16 -","4","1","","Das, Anisha; Nama, Debabrata; Majumder, Chinmoy; Roy, Subhadip; Singh, S. Sureshkumar; Sandham, Alka; Singh, Salam Pradeep; Roy, Manojit; Misra, Tarun Kumar","Crystallographic, topological, antidiabetic, and docking evaluation of an azo-enamine ligand and its triphenyltin(iv) coordination polymer","New Journal of Chemistry","2026","50","17","7142","7151","10.1039/D5NJ03575A","","","0.71073","MoKα","","0.0813","0.0711","","","0.1457","0.1509","","","","","","1.086","","","","has coordinates,has disorder","306454","2026-06-05","19:25:19",""
"7064343","3.8829","0.0005","6.2026","0.0007","24.973","0.003","90","","92.208","0.004","90","","601.01","0.13","293","","293","","","","","","","","","4","P 1 n 1","P -2yac","7","","75A7","","- C16 H10 N2 O2 -","- C16 H10 N2 O2 -","- C32 H20 N4 O4 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","x-ray","0.71073","MoKα","","0.0768","0.053","","","0.1031","0.1136","","","","","","1.135","","","","has coordinates","306464","2026-06-05","19:27:33",""
"7064344","11.346","0.004","24.735","0.008","13.365","0.005","90","","109.158","0.004","90","","3543","2","297","","297","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H26 Br2 N12 Ni O -","- C36 H24 Br2 N12 Ni -","- C144 H96 Br8 N48 Ni4 -","4","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","","0.71073","MoKα","","0.0907","0.0578","","","0.1556","0.1779","","","","","","1.083","","","","has coordinates,has disorder","306464","2026-06-05","19:27:33",""
"7064345","9.8198","0.0019","11.4573","0.0015","13.2236","0.0017","90","","90","","90","","1487.8","0.4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","107_2","","- C18 H12 Br N3 -","- C18 H12 Br N3 -","- C72 H48 Br4 N12 -","4","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","x-ray","0.71073","MoKα","","0.1108","0.0711","","","0.1575","0.1793","","","","","","1.007","","","","has coordinates","306464","2026-06-05","19:27:33",""
"7064346","26.286","0.002","11.0439","0.0009","15.2328","0.0013","90","","118.195","0.002","90","","3897.4","0.6","297","","297","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C19.5 H15.5 Br Cl2 N3.5 O0.5 Pd -","- C18 H12 Br Cl2 N3 Pd -","- C144 H96 Br8 Cl16 N24 Pd8 -","8","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","x-ray","0.71073","MoKα","","0.0929","0.0662","","","0.1096","0.1199","","","","","","1.16","","","","has coordinates","306464","2026-06-05","19:27:33",""
"7064347","11.2189","0.0017","12.5312","0.0019","14.612","0.002","94.067","0.005","109.34","0.004","102.568","0.004","1868.9","0.5","295","","295","","","","","","","","","7","P -1","-P 1","2","","","","- C36 H30 Br2 Cl2 N6 Ni O3 -","- C36 H30 Br2 Cl2 N6 Ni O3 -","- C72 H60 Br4 Cl4 N12 Ni2 O6 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","x-ray","0.71073","MoKα","","0.1932","0.0999","","","0.269","0.3506","","","","","","1.066","","","","has coordinates,has disorder","306464","2026-06-05","19:27:33",""
"7064348","18.832","0.003","8.2583","0.0009","18.462","0.003","90","","118.054","0.019","90","","2533.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","75A7Cu","","- C32 H18 Cu N4 O4 -","- C32 H18 Cu N4 O4 -","- C128 H72 Cu4 N16 O16 -","4","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","x-ray","0.71073","MoKα","","0.1845","0.0887","","","0.1615","0.2158","","","","","","0.983","","","","has coordinates,has disorder","306464","2026-06-05","19:27:33",""
"7064349","11.1681","0.0011","12.8349","0.0012","14.5183","0.0014","70.117","0.003","77.736","0.003","85.953","0.003","1912.4","0.3","297","","297","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H34 Br4 Cu N6 O5 -","- C36 H24 Br4 Cu N6 -","- C72 H48 Br8 Cu2 N12 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","","0.71073","MoKα","","0.0992","0.0647","","","0.1789","0.2255","","","","","","1.086","","","","has coordinates,has disorder","306464","2026-06-05","19:27:33",""
"7064350","11.074","0.0009","12.8377","0.001","14.4872","0.0012","69.906","0.002","76.732","0.002","85.853","0.002","1882.5","0.3","297","","297","","","","","","","","","7","P -1","-P 1","2","","","","- C36 H34 Br2 Cl2 Cu N6 O5 -","- C36 H24 Br2 Cl2 Cu N6 -","- C72 H48 Br4 Cl4 Cu2 N12 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","","0.71073","MoKα","","0.1244","0.0877","","","0.2407","0.3112","","","","","","1.148","","","","has coordinates,has disorder","306464","2026-06-05","19:27:33",""
"7064351","17.2559","0.0006","11.6096","0.0003","18.5736","0.0007","90","","107.44","0.004","90","","3549.9","0.2","293","","293","2","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","75A7Ni","","- C38 H36 N6 Ni O8 -","- C38 H36 N6 Ni O8 -","- C152 H144 N24 Ni4 O32 -","4","0.5","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","","0.71073","MoKα","","0.0487","0.0405","","","0.1154","0.1297","","","","","","1.095","","","","has coordinates","306464","2026-06-05","19:27:33",""
"7064352","25.7953","0.0009","11.0716","0.0004","14.8496","0.0005","90","","116.095","0.001","90","","3808.7","0.2","295","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H12 Br Cl2 N3 Pt -","- C18 H12 Br Cl2 N3 Pt -","- C144 H96 Br8 Cl16 N24 Pt8 -","8","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","x-ray","0.71073","MoKα","","0.0436","0.031","","","0.0607","0.0682","","","","","","1.094","","","","has coordinates","306464","2026-06-05","19:27:33",""
"7064353","10.7057","0.0006","11.2188","0.0005","12.7019","0.0006","68.128","0.005","69.582","0.005","62.805","0.005","1229.41","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","75A7Pd","","- C32 H18 N4 O4 Pd -","- C32 H18 N4 O4 Pd -","- C64 H36 N8 O8 Pd2 -","2","1","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","x-ray","0.71073","MoKα","","0.071","0.0585","","","0.1576","0.1663","","","","","","1.097","","","","has coordinates","306464","2026-06-05","19:27:33",""
"7064354","13.76","0.005","14.324","0.005","22.444","0.008","80.129","0.011","82.246","0.011","75.657","0.011","4202","3","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H26 N4 O6 Pt -","- C32 H18 N4 O4 Pt -","- C192 H108 N24 O24 Pt6 -","6","3","","Rayasingh, Amlan Ranjan; Manivannan, Vadivelu","Synthesis, structure, and catalytic- and bio-activity of some metal complexes and a coordination polymer featuring imidazo[1,5-a]pyridine and chromen[4,3-b]pyrrole-4-one","New Journal of Chemistry","2026","50","16","6746","6760","10.1039/D6NJ00431H","","","0.71073","MoKα","","0.1325","0.0727","","","0.1073","0.1301","","","","","","1.107","","","","has coordinates","306464","2026-06-05","19:27:33",""
"7064355","9.403","0.0001","10.1164","0.0001","13.0455","0.0001","83.04","","69.069","0.001","69.003","0.001","1082.06","0.02","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","4-phenylpyrazole-dibenzofuran 6a","","- C30 H20 N4 O -","- C30 H20 N4 O -","- C60 H40 N8 O2 -","2","1","","Kumari, Sonu; Biswas, Nupur; Thirumoorthi, Ramalingam; Roy, Bibhisan; Rajagopala Reddy, S.; Bhanuchandra, M.","4-Arylpyrazole-decorated dibenzofuran: synthesis, characterization, optical studies and computational analysis","New Journal of Chemistry","2026","50","17","7196","7208","10.1039/D6NJ00832A","","","1.54184","CuKα","","0.0333","0.0329","","","0.0807","0.0809","","","","","","1.038","","","","has coordinates","306455","2026-06-05","19:25:21",""
"7064356","9.3763","0.0006","11.8162","0.0007","13.2214","0.0009","97.863","0.005","105.578","0.006","97.842","0.005","1374.54","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","N'-(2-trifluoroacetylcyclopent-1-enyl)benzohydrazide","bezoylhydrazone 2-trifluoroacetylsiklopentanone","","- C14 H13 F3 N2 O2 -","- C14 H13 F3 N2 O2 -","- C56 H52 F12 N8 O8 -","4","2","","Panova, Elizaveta V.; Ganiev, Bakhtiyor Sh.; Avezov, Kuvondik G.; Umarov, Bako B.; Voronina, Julia K.; Safin, Damir A.","Synthesis and structural elucidation of a trifluoromethylated cyclopentene hydrazone: a combined X-ray and computational study","New Journal of Chemistry","2026","50","17","7490","7504","10.1039/D6NJ00632A","","","1.54184","CuKα","","0.1134","0.0634","","","0.1614","0.2008","","","","","","1.033","","","","has coordinates,has disorder","306457","2026-06-05","19:25:31",""
"7064357","8.215","0.00017","18.6047","0.0003","10.3154","0.00018","90","","110.984","0.002","90","","1472.02","0.05","295.53","0.1","295.53","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H12 I N O Se -","- C15 H12 I N O Se -","- C60 H48 I4 N4 O4 Se4 -","4","1","","Yue, Yikun; Zhang, Yixin; Li, Weijie; Lu, Zhande; Jin, Yiyang; Hu, Botao; Yang, Lu","Catalyst-free direct C–H selenoxylation of (hetero)arenes","New Journal of Chemistry","2026","50","15","6243","6247","10.1039/D6NJ00684A","","x-ray","1.54184","CuKα","","0.0811","0.0798","","","0.1987","0.2014","","","","","","1.077","","","","has coordinates","305843","2026-05-05","09:30:03",""
"7064358","6.9714","0.0004","10.8737","0.0007","14.1939","0.0008","90","","90","","90","","1075.97","0.11","120","","120","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C3 H11 B10 N S -","- C3 H11 B10 N S -","- C12 H44 B40 N4 S4 -","4","1","","Alpatova, Victoria M.; Rys, Evgeny G.; Smol’yakov, Alexander F.; Kononova, Elena G.; Ol'shevskaya, Valentina A.","Carborane isothiocyanates: synthesis, characterization and conjugation with N-nucleophiles","New Journal of Chemistry","2026","50","14","6197","6204","10.1039/D6NJ00718J","","","0.71073","MoKα","","0.0315","0.0291","","","0.078","0.0789","","","","","","1.08","","","","has coordinates","305840","2026-05-05","09:29:38",""
"7064359","7.6763","0.0003","23.3782","0.0009","10.193","0.0004","90","","92.084","0.002","90","","1828.01","0.12","120","","120","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C9 H24 B10 N2 O3 S -","- C9 H24 B10 N2 O3 S -","- C36 H96 B40 N8 O12 S4 -","4","2","","Alpatova, Victoria M.; Rys, Evgeny G.; Smol’yakov, Alexander F.; Kononova, Elena G.; Ol'shevskaya, Valentina A.","Carborane isothiocyanates: synthesis, characterization and conjugation with N-nucleophiles","New Journal of Chemistry","2026","50","14","6197","6204","10.1039/D6NJ00718J","","","0.71073","MoKα","","0.0408","0.0365","","","0.0946","0.0964","","","","","","1.067","","","","has coordinates","305840","2026-05-05","09:29:38",""
"7064360","15.4827","0.0006","7.5722","0.0003","21.84","0.0008","90","","94.311","0.002","90","","2553.24","0.17","120","","120","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C5 H15 B10 N S -","- C5 H15 B10 N S -","- C40 H120 B80 N8 S8 -","8","2","","Alpatova, Victoria M.; Rys, Evgeny G.; Smol’yakov, Alexander F.; Kononova, Elena G.; Ol'shevskaya, Valentina A.","Carborane isothiocyanates: synthesis, characterization and conjugation with N-nucleophiles","New Journal of Chemistry","2026","50","14","6197","6204","10.1039/D6NJ00718J","","","0.71073","MoKα","","0.0561","0.038","","","0.1175","0.1248","","","","","","1.123","","","","has coordinates","305840","2026-05-05","09:29:38",""
"7064361","22.317","0.005","22.317","0.005","11.022","0.004","90","","90","","90","","5489","3","300","2","300","","","","","","","","","5","I -4","I -4","82","","","","- C32 H28.85 N3 O2.2 S2 -","- C32 H28.447 N3 O2 S2 -","- C256 H227.576 N24 O16 S16 -","8","1","","Ajaydev, Rameshbabu; Joy, Wilson; Krishnan, Aravind; Shanmugam, Sivakumar","Stereoselective one-pot synthesis of spiro-indenoquinoxaline–pyrrolidine hybrids: structural elucidation and biological evaluation","New Journal of Chemistry","2026","50","20","8573","8580","10.1039/D6NJ00925E","","","0.71073","MoKα","","0.1238","0.0648","","","0.1644","0.2367","","","","","","1.162","","","","has coordinates,has disorder","306465","2026-06-05","19:27:38",""
"7064362","9.3753","0.0005","9.3753","0.0005","9.3753","0.0005","90","","90","","90","","824.05","0.08","473","2","473","2","","","","","","","","6","P m -3 m","-P 4 2 3","221","","","","- C18 H36 Cl0.33 I6.67 N3 Pt -","- C22.08 Cl0.56 I6.44 Pt -","- C22.08 Cl0.56 I6.44 Pt -","1","0.0208333","","Zhou, Wen; Shi, Chao; Xu, Liang; Wang, Ze-Jie; Wang, Na; Liao, Rong-Meng; An, Zhen; Ye, Heng-Yun; Miao, Le-Ping","A hybrid metal–halide antiperovskite semiconductor ferroelectric","New Journal of Chemistry","2026","50","17","7432","7437","10.1039/D6NJ00529B","","","0.71073","MoKα","","0.104","0.0602","","","0.1585","0.1835","","","","","","0.887","","","","has coordinates","306459","2026-06-05","19:25:51",""
"7064363","9.33719","0.00018","9.33719","0.00018","37.1328","0.0012","90","","90","","90","","3237.35","0.14","413","2","413","2","","","","","","","","6","P 41","P 4w","76","","","","- C18 H36 Cl0.32 I6.68 N3 Pt -","- C18 H36 Cl0.33 I6.67 N3 Pt -","- C72 H144 Cl1.32 I26.68 N12 Pt4 -","4","1","","Zhou, Wen; Shi, Chao; Xu, Liang; Wang, Ze-Jie; Wang, Na; Liao, Rong-Meng; An, Zhen; Ye, Heng-Yun; Miao, Le-Ping","A hybrid metal–halide antiperovskite semiconductor ferroelectric","New Journal of Chemistry","2026","50","17","7432","7437","10.1039/D6NJ00529B","","","0.71073","MoKα","","0.092","0.0674","","","0.2035","0.2157","","","","","","1.083","","","","has coordinates","306459","2026-06-05","19:25:51",""
"7064364","12.9639","0.0005","13.3992","0.0007","18.308","","90","0.003","91.96","","90","","3178.3","0.2","298","2","298","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C18 H36 Cl0.32 I6.57 N3 Pt -","- C18 H36 Cl0.324 I6.676 N3 Pt -","- C72 H144 Cl1.296 I26.704 N12 Pt4 -","4","1","","Zhou, Wen; Shi, Chao; Xu, Liang; Wang, Ze-Jie; Wang, Na; Liao, Rong-Meng; An, Zhen; Ye, Heng-Yun; Miao, Le-Ping","A hybrid metal–halide antiperovskite semiconductor ferroelectric","New Journal of Chemistry","2026","50","17","7432","7437","10.1039/D6NJ00529B","","","0.71073","MoKα","","0.0649","0.0441","","","0.1057","0.1129","","","","","","1.038","","","","has coordinates","306459","2026-06-05","19:25:51",""
"7064365","11.219","0.0009","14.2559","0.0013","18.0089","0.0014","103.156","0.002","98.473","0.002","90.14","0.002","2772.1","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H60 Cl2 N2 O15 -","- C52 H60 Cl2 N2 O15 -","- C104 H120 Cl4 N4 O30 -","2","1","","Zhu, Xin-Ru; Li, Ze; Sun, Dan; Elmidaoui, Roudaina; Dai, Meng-Xuan; Zhao, Zhi-Long; Chen, Xiang-Zhu; Jiang, Fei; Liu, Lu","Novel palmatine hydrochloride–phenolic acid cocrystals: effects of different phenolic acids on hygroscopicity improvement and antibacterial activity enhancement","New Journal of Chemistry","2026","50","18","7647","7657","10.1039/D5NJ04579G","","","0.71073","MoKα","","0.1444","0.0707","","","0.159","0.1999","","","","","","1.018","","","","has coordinates","306473","2026-06-05","19:28:25",""
"7064366","10.8962","0.0008","15.0725","0.0011","15.0474","0.0011","104.598","0.002","92.94","0.002","93.154","0.002","2382.4","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H29 Cl N O7.5 -","- C25 H29 Cl N O7.5 -","- C100 H116 Cl4 N4 O30 -","4","2","","Zhu, Xin-Ru; Li, Ze; Sun, Dan; Elmidaoui, Roudaina; Dai, Meng-Xuan; Zhao, Zhi-Long; Chen, Xiang-Zhu; Jiang, Fei; Liu, Lu","Novel palmatine hydrochloride–phenolic acid cocrystals: effects of different phenolic acids on hygroscopicity improvement and antibacterial activity enhancement","New Journal of Chemistry","2026","50","18","7647","7657","10.1039/D5NJ04579G","","","0.71073","MoKα","","0.2312","0.0888","","","0.1773","0.2455","","","","","","1.007","","","","has coordinates","306473","2026-06-05","19:28:25",""
"7064367","9.261","0.0011","22.228","0.002","10.4259","0.0013","90","","110.918","0.014","90","","2004.8","0.4","293","2","293","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C41 H37 F6 N2 O P3 Ru -","- C41 H37 F6 N2 O P3 Ru -","- C82 H74 F12 N4 O2 P6 Ru2 -","2","0.5","","Sharma, Sahil; Pandey, Pradeep Kumar; Trivedi, Manoj; Rath, Nigam P.; Sharma, Raj Kishore","Catalytic hydrogenation of carbon dioxide to methanol by homogenous ruthenium(ii) hydrido carbonyl complexes","New Journal of Chemistry","2026","50","13","5679","5686","10.1039/D6NJ00102E","","","0.71073","MoKα","","0.0774","0.0736","","","0.1855","0.1882","","","","","","1.228","","","","has coordinates,has disorder","305271","2026-04-05","03:10:31",""
"7064368","7.284","0.0002","18.1468","0.0005","12.2852","0.0003","90","","102.552","0.002","90","","1585.06","0.07","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 Br Cu N5 O -","- C16 H12 Br Cu N5 O -","- C64 H48 Br4 Cu4 N20 O4 -","4","1","","Dhar, Aditi; Biswas, Sneha; Barman, Nandini; Naskar, Pappu; Chowdhury, Tania; Banerjee, Anjan; Das, Debasis","Designing of Fe3O4-supported reduced graphene oxide-based 1-D copper(ii) polymeric materials: a comparative study on high-performance supercapacitive behaviour","New Journal of Chemistry","2026","50","11","4839","4851","10.1039/D5NJ02462E","","x-ray","0.71073","MoKα","","0.0646","0.0369","","","0.0683","0.0743","","","","","","1.034","","","","has coordinates","305272","2026-04-05","03:10:40",""
"7064369","18.357","0.01","11.122","0.005","16.532","0.007","90","","90","","90","","3375","3","160","2","160","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C31 H44 Cl Co2 N5 O7 -","- C31 H44 Cl Co2 N5 O7 -","- C124 H176 Cl4 Co8 N20 O28 -","4","1","","Pramanik, Abhishek; Majumder, Samit; Hazra, Susanta; Mohanta, Sasankasekhar","Transmetalated synthesis of homodinuclear MnII and CoII complexes containing Robson type macrocyclic ligands: crystal structure, magnetic investigation and DFT calculations","New Journal of Chemistry","2026","50","20","8802","8813","10.1039/D5NJ04703J","","","0.71073","MoKα","","0.0755","0.0505","","","0.1281","0.157","","","","","","1.097","","","","has coordinates","306469","2026-06-05","19:27:55",""
"7064370","9.7907","0.0006","11.778","0.0007","13.208","0.0008","90","","110.505","0.002","90","","1426.58","0.15","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 Cl2 Mn2 N4 O2 -","- C28 H34 Cl2 Mn2 N4 O2 -","- C56 H68 Cl4 Mn4 N8 O4 -","2","0.5","","Pramanik, Abhishek; Majumder, Samit; Hazra, Susanta; Mohanta, Sasankasekhar","Transmetalated synthesis of homodinuclear MnII and CoII complexes containing Robson type macrocyclic ligands: crystal structure, magnetic investigation and DFT calculations","New Journal of Chemistry","2026","50","20","8802","8813","10.1039/D5NJ04703J","","","0.71073","MoKα","","0.0466","0.0309","","","0.0668","0.0725","","","","","","1.025","","","","has coordinates","306469","2026-06-05","19:27:55",""
"7064371","9.9821","0.0006","9.5637","0.0006","30.9166","0.0019","90","","92.524","0.003","90","","2948.6","0.3","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H25 N2 O11 -","- C34 H25 N2 O11 -","- C136 H100 N8 O44 -","4","1","","Li, Li; Liu, Chun-Jie; Guo, Hang-Hang; Zhang, Ning-Ning; Wang, Hong-Li","Multi-functional applications of a metal-free viologen supramolecular compound: UV detection, amine sensing, and ink-free printing","New Journal of Chemistry","2026","50","16","6898","6903","10.1039/D6NJ00792A","","","0.71073","MoKα","","0.1091","0.0929","","","0.2344","0.2443","","","","","","1.099","","","","has coordinates,has disorder","305838","2026-05-05","09:29:00",""
"7064372","5.9257","0.0003","16.5073","0.0009","24.362","0.0012","90","","91.913","0.001","90","","2381.7","0.2","293.15","","293.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H22 Br O2 S2 -","- C27 H22 Br O2 S2 -","- C108 H88 Br4 O8 S8 -","4","1","","Xu, Jiefang; Fan, Haoqun; Cao, Feng; Yang, Xiaohu; Huang, Chunyan","Photo-induced tandem cyclization of alkynes with sodium sulfinates to access sulfonated exocyclic alkenes","New Journal of Chemistry","2026","50","17","7515","7519","10.1039/D6NJ00474A","","","0.71073","MoKα","","0.0866","0.0449","","","0.0955","0.1136","","","","","","1.023","","","","has coordinates,has disorder","306458","2026-06-05","19:25:43",""
"7064373","11.3775","0.0006","11.5862","0.0007","25.9327","0.0006","91.335","0.003","99.372","0.003","118.66","0.006","2939.3","0.3","296.15","0.1","296.15","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C50 H56 B20 O4 -","- C50 H56 B20 O4 -","- C100 H112 B40 O8 -","2","1","","Chen, Wenlong; Yuan, Shuai; Lin, Caixia; Yuan, Yaofeng","An o-carborane-based naphthalene macrocyclic arene: dual-state emission and C60 recognition","New Journal of Chemistry","2026","50","16","6989","6995","10.1039/D6NJ00521G","","x-ray","1.54184","CuKα","","0.1853","0.1054","","","0.2927","0.3545","","","","","","1.046","","","","has coordinates","305837","2026-05-05","09:28:56",""
"7064374","9.148","0.0002","17.3159","0.0003","18.9994","0.0004","105.491","0.002","102.728","0.002","90.995","0.002","2819.7","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C2.74 H1.43 Cu0.06 N0.23 O0.46 -","- C2.74286 H1.42857 Cu0.0571429 N0.228571 O0.457143 -","- C96 H50 Cu2 N8 O16 -","35","17.5","","Wang, Taihe; Zou, Chengling; Li, Yu; Mu, Yuxin; Wei, Jiale; Chen, Chao; Zhang, Yan; Li, Haijian; Yi, Jianhua; Ma, Haixia; Zhao, Fengqi","Characterizing the decomposition of CL-20 catalyzed by hydrophobic porphyrin MOFs","New Journal of Chemistry","2026","50","17","7236","7246","10.1039/D6NJ00288A","","","0.71073","MoKα","","0.1325","0.105","","","0.3144","0.3403","","","","","","1.091","","","","has coordinates","306460","2026-06-05","19:26:15",""
"7064375","17.0826","0.0002","18.5694","0.0003","19.5561","0.0003","104.992","0.001","90.269","0.001","103.557","0.001","5811.23","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C2.9 H1.97 Cu0.05 N0.27 O0.52 -","- C2.90411 H1.9726 Cu0.0547945 N0.273973 O0.520548 -","- C212 H144 Cu4 N20 O38 -","73","36.5","","Wang, Taihe; Zou, Chengling; Li, Yu; Mu, Yuxin; Wei, Jiale; Chen, Chao; Zhang, Yan; Li, Haijian; Yi, Jianhua; Ma, Haixia; Zhao, Fengqi","Characterizing the decomposition of CL-20 catalyzed by hydrophobic porphyrin MOFs","New Journal of Chemistry","2026","50","17","7236","7246","10.1039/D6NJ00288A","","","0.71073","MoKα","","0.0887","0.0588","","","0.1741","0.1943","","","","","","1.086","","","","has coordinates","306460","2026-06-05","19:26:15",""
"7064376","18.973","0.0003","19.4512","0.0002","25.4299","0.0004","74.131","0.001","88.579","0.001","70.066","0.001","8462","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C2.72 H1.45 Cu0.06 N0.23 O0.45 -","- C2.71698 H1.45283 Cu0.0566038 N0.226415 O0.45283 -","- C288 H154 Cu6 N24 O48 -","106","53","","Wang, Taihe; Zou, Chengling; Li, Yu; Mu, Yuxin; Wei, Jiale; Chen, Chao; Zhang, Yan; Li, Haijian; Yi, Jianhua; Ma, Haixia; Zhao, Fengqi","Characterizing the decomposition of CL-20 catalyzed by hydrophobic porphyrin MOFs","New Journal of Chemistry","2026","50","17","7236","7246","10.1039/D6NJ00288A","","","0.71073","MoKα","","0.0969","0.0771","","","0.2212","0.2383","","","","","","1.041","","","","has coordinates","306460","2026-06-05","19:26:15",""
"7064377","12.3289","0.0005","11.9065","0.0004","12.6831","0.0004","90","","105.699","0.001","90","","1792.35","0.11","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 Mo N2 O9 -","- C16 H18 Mo N2 O9 -","- C64 H72 Mo4 N8 O36 -","4","1","","Dheeraj,; Rana, Lata; Mahiya, Kuldeep","Synthesis of reduced graphene oxide-based catalytic complexes for benzylamine–o-phenylenediamine oxidative coupling","New Journal of Chemistry","2026","50","17","7247","7258","10.1039/D6NJ01022A","","","0.71073","MoKα","","0.0251","0.0238","","","0.0657","0.0667","","","","","","1.088","","","","has coordinates","306453","2026-06-05","19:25:08",""
"7064378","12.2318","0.0009","6.9036","0.0005","23.6607","0.0018","90","","92.445","0.002","90","","1996.2","0.3","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 Mo N2 O11 -","- C17 H22 Mo N2 O11 -","- C68 H88 Mo4 N8 O44 -","4","1","","Dheeraj,; Rana, Lata; Mahiya, Kuldeep","Synthesis of reduced graphene oxide-based catalytic complexes for benzylamine–o-phenylenediamine oxidative coupling","New Journal of Chemistry","2026","50","17","7247","7258","10.1039/D6NJ01022A","","","0.71073","MoKα","","0.0603","0.0419","","","0.0946","0.1011","","","","","","1.041","","","","has coordinates","306453","2026-06-05","19:25:08",""
"7064379","10.069","0.0009","10.0652","0.0011","26.246","0.003","90","","90","","90","","2659.9","0.5","298","2","298","2","","","","","","","","3","P b c 21","P 2c -2b","29","","","","- C36 H24 N6 -","- C36 H24 N6 -","- C144 H96 N24 -","4","1","","Calvache, Edward; Pastrana-Dávila, Andrea; Rengifo, Emerson; Macias, Mario; Rojas, Oscar; Pentlehner, Dominik; Arteaga, Danny; D’Vries, Richard","Exploring the intriguing world of terpyridines: synthesis, structural, optical, and theoretical insights into bis(p-phenyl-2,2′:6′,2″)terpyridine","New Journal of Chemistry","2026","50","19","8270","8280","10.1039/D6NJ01158F","","x-ray","1.54184","CuKα","","0.0591","0.0544","","","0.1471","0.1572","","","","","","1.065","","","","has coordinates","306462","2026-06-05","19:26:47",""
"7064380","17.1285","0.0014","4.0509","0.0003","22.319","0.0018","90","","106.564","0.002","90","","1484.4","0.2","298","2","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H11 Cl O3 S2 -","- C15 H11 Cl O3 S2 -","- C60 H44 Cl4 O12 S8 -","4","1","","Kumar, Devendra; Ali, Ahmad; Sood, Mehak; Bharatam, Prasad V.; Khan, Abu Taleb","Reactivity study of 4-hydroxydithiocoumarin/4-hydroxythiocoumarin with vinyl ether/cyclic vinyl ether: synthesis of fused novel thiophene derivatives using CuO nanoparticles","New Journal of Chemistry","2026","50","17","7438","7447","10.1039/D6NJ00650G","","","0.71073","MoKα","","0.047","0.0409","","","0.0892","0.0935","","","","","","1.122","","","","has coordinates","306456","2026-06-05","19:25:24",""
"7064381","7.4957","0.0004","7.5172","0.0004","13.7183","0.0007","91.097","0.002","90.856","0.001","101.684","0.002","756.69","0.07","299","2","299","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H13 F O3 S2 -","- C16 H13 F O3 S2 -","- C32 H26 F2 O6 S4 -","2","1","","Kumar, Devendra; Ali, Ahmad; Sood, Mehak; Bharatam, Prasad V.; Khan, Abu Taleb","Reactivity study of 4-hydroxydithiocoumarin/4-hydroxythiocoumarin with vinyl ether/cyclic vinyl ether: synthesis of fused novel thiophene derivatives using CuO nanoparticles","New Journal of Chemistry","2026","50","17","7438","7447","10.1039/D6NJ00650G","","","0.71073","MoKα","","0.0472","0.0384","","","0.0914","0.0989","","","","","","1.069","","","","has coordinates","306456","2026-06-05","19:25:24",""
"7064382","8.4269","0.0008","10.2708","0.0011","10.7625","0.0012","112.254","0.004","110.239","0.004","97.809","0.004","769.74","0.15","293","2","293","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H17 N O4 -","- C18 H17 N O4 -","- C36 H34 N2 O8 -","2","1","","Gou, Yan; Wang, Jing; Li, Na; Hou, Shanling; Cheng, Yang; Li, Yuming","DBU-mediated [3+2] annulation of 3-hydroxyisoindolinones with vinylsulfonium salts: an efficient approach to functionalized oxazolo[2,3-a]isoindolones","New Journal of Chemistry","2026","50","18","7609","7613","10.1039/D6NJ00608F","","","0.71073","MoKα","","0.0714","0.0487","","","0.1353","0.1604","","","","","","0.751","","","","has coordinates","306472","2026-06-05","19:28:22",""
"7064383","18.236","0.003","9.023","0.0019","13.095","0.004","90","","128.825","0.004","90","","1678.6","0.7","293","","293","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C22 H17 N O2 -","- C22 H17 N O2 -","- C88 H68 N4 O8 -","4","0.5","","Gou, Yan; Wang, Jing; Li, Na; Hou, Shanling; Cheng, Yang; Li, Yuming","DBU-mediated [3+2] annulation of 3-hydroxyisoindolinones with vinylsulfonium salts: an efficient approach to functionalized oxazolo[2,3-a]isoindolones","New Journal of Chemistry","2026","50","18","7609","7613","10.1039/D6NJ00608F","","x-ray","0.71073","MoKα","","0.0862","0.0533","","","0.1169","0.1344","","","","","","1.086","","","","has coordinates,has disorder","306472","2026-06-05","19:28:22",""
"7064384","7.5973","0.0006","8.5961","0.0008","11.7834","0.0011","71.346","0.008","88.56","0.007","83.085","0.007","723.74","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H16 N2 O3 -","- C17 H16 N2 O3 -","- C34 H32 N4 O6 -","2","1","","Lyngkhoi, Deikrisha Lyngdoh; Baruah, Khanindram; Patra, Sumit Kumar; Khatua, Snehadrinarayan","A seven-membered heterocycle containing – coumarin-based probe for selective detection of chemical warfare agent phosgene in solution and the gas phase","New Journal of Chemistry","2026","50","19","8498","8509","10.1039/D6NJ00818F","","","0.71073","MoKα","","0.0693","0.049","","","0.113","0.1238","","","","","","1.026","","","","has coordinates","306463","2026-06-05","19:26:54",""
"7064390","9.3443","0.0003","28.4146","0.0009","13.5911","0.0005","90","","108.335","0.0007","90","","3425.4","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H46 F3 O5 P S -","- C34 H46 F3 O5 P S -","- C136 H184 F12 O20 P4 S4 -","4","1","","Pashirova, Tatiana N.; Titov, Evgenii A.; Nemtarev, Andrey V.; Lyubina, Anna P.; Shaihutdinova, Zukhra M.; Dimukhametov, Mudaris N.; Salnikov, Vadim V.; Fayzullin, Robert R.; Mursalova, Yuliya V.; Ryzhkina, Irina S.; Voloshina, Alexandra D.; Mironov, Vladimir F.","Mitochondria-targeted liposomes decorated by amphiphilic 2-hydroxypropylphosphonium salts for hyperthermia-induced release and antitumor application","New Journal of Chemistry","2026","50","19","8102","8111","10.1039/D5NJ05017K","","x-ray","0.71073","MoKα","","0.0494","0.0366","","","0.0903","0.0976","","","","","","1.047","","","","has coordinates","306461","2026-06-05","19:26:44",""
"7064391","8.5875","0.001","10.6673","0.001","11.4787","0.0014","78.905","0.004","85.544","0.004","85.215","0.004","1026.2","0.2","302","","302","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H24 N2 O4 S2 -","- C18 H24 N2 O4 S2 -","- C36 H48 N4 O8 S4 -","2","1","","Liu, Shuai; Liu, Yu-Tao; Liu, Jiahui; Chen, Zihao; Ding, Yue; Wu, Qiong; Zhang, Tian-Shu; Ding, Weijie","H2O-controlled selective disulfide etherification and thiocyanation of pyrroles via linear paired electrolysis","New Journal of Chemistry","2026","50","20","8727","8732","10.1039/D6NJ00883F","","","0.71073","MoKα","","0.048","0.04","","","0.1145","0.1223","","","","","","1.074","","","","has coordinates","306470","2026-06-05","19:28:11",""
"7064393","19.9418","0.0011","8.6405","0.0003","11.5476","0.0005","90","","104.228","0.006","90","","1928.7","0.16","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H20 N6 O4 -","- C20 H20 N6 O4 -","- C80 H80 N24 O16 -","4","0.5","","Adhikari, Suman; Nath, Sourav; Saha, Koushik; Baildya, Nabajyoti; Kaminsky, Werner; Kumar, Malavika S.; Roy, Subhadip; Das, Avijit Kumar","A turn-on bis-hydrazone fluorescent chemosensor for selective Cd2+ detection: synthesis, structural insights, and theoretical validation","New Journal of Chemistry","2026","50","20","8639","8645","10.1039/D6NJ00362A","","x-ray","0.71073","MoKα","","0.0878","0.0488","","","0.1125","0.1311","","","","","","1.071","","","","has coordinates","306468","2026-06-05","19:27:52",""
"7064394","12.77135","0.00006","14.8337","0.00007","9.99137","0.00005","90","","103.147","0.0004","90","","1843.22","0.016","100","0.3","100","0.3","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C22 H17 N3 O2 S -","- C22 H17 N3 O2 S -","- C88 H68 N12 O8 S4 -","4","1","","Shepelenko, Konstantin E.; Gnatiuk, Irina G.; Kolotova, Uliana A.; Minyaev, Mikhayl E.; Chernyshev, Victor M.","Sustainable ruthenium-catalyzed C–H alkylation of 2-(hetero)aryl benzimidazoles with maleimides","New Journal of Chemistry","2026","50","20","8550","8554","10.1039/D6NJ00299D","","x-ray","1.54184","CuKα","","0.0234","0.0233","","","0.0606","0.0606","","","","","","1.037","","","","has coordinates","306467","2026-06-05","19:27:44",""
"7064395","9.40197","0.00015","9.52044","0.00013","12.31548","0.00018","90","","110.156","0.0017","90","","1034.86","0.03","100","0.2","100","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H23 N3 O3 -","- C26 H23 N3 O3 -","- C52 H46 N6 O6 -","2","1","","Shepelenko, Konstantin E.; Gnatiuk, Irina G.; Kolotova, Uliana A.; Minyaev, Mikhayl E.; Chernyshev, Victor M.","Sustainable ruthenium-catalyzed C–H alkylation of 2-(hetero)aryl benzimidazoles with maleimides","New Journal of Chemistry","2026","50","20","8550","8554","10.1039/D6NJ00299D","","x-ray","1.54184","CuKα","","0.0364","0.0362","","","0.1028","0.1032","","","","","","1.064","","","","has coordinates","306467","2026-06-05","19:27:44",""
"7064396","8.9884","0.0004","11.021","0.0004","14.027","0.0005","110.534","0.001","104.021","0.001","95.898","0.001","1235.23","0.08","300","2","300","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H27 N3 O -","- C32 H27 N3 O -","- C64 H54 N6 O2 -","2","1","","Hariharan, Selvaraj; Muthusamy, Sengodagounder","A visible light-promoted C–H insertion reaction of diazoamides with 1,3-diketones","New Journal of Chemistry","2026","50","20","8784","8789","10.1039/D5NJ04942C","","","0.71073","MoKα","","0.0676","0.0475","","","0.1258","0.1466","","","","","","0.894","","","","has coordinates","306466","2026-06-05","19:27:42",""
"7064397","11.0524","0.0009","13.2206","0.001","15.5292","0.0013","89.481","0.003","89.181","0.003","74.888","0.003","2190.4","0.3","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H48 N12 O27 Sm2 -","- C24 H48 N12 O27 Sm2 -","- C48 H96 N24 O54 Sm4 -","2","1","","Hariharan, Selvaraj; Muthusamy, Sengodagounder","A visible light-promoted C–H insertion reaction of diazoamides with 1,3-diketones","New Journal of Chemistry","2026","50","20","8784","8789","10.1039/D5NJ04942C","","","0.71073","MoKα","","0.0248","0.0207","","","0.049","0.0512","","","","","","1.069","","","","has coordinates","306466","2026-06-05","19:27:42",""
"7064398","11.9646","0.001","16.0861","0.0012","16.6355","0.0015","74.568","0.007","78.164","0.008","79.707","0.007","2994.4","0.4","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H32 N3 Ni O3 P -","- C34 H32 N3 Ni O3 P -","- C136 H128 N12 Ni4 O12 P4 -","4","2","","Kavin, Sekar Pranesh; Ramesh, Rengan","Direct access to 2-amino-3-cyano-4H-pyrans/4H-chromenes by [ONO]-pincer supported nickel(ii) phosphine complexes via dehydrogenative annulation of alcohols","New Journal of Chemistry","2026","50","21","9245","9251","10.1039/D6NJ01107A","","x-ray","0.71073","MoKα","","0.2361","0.1453","","","0.3398","0.412","","","","","","1.151","","","","has coordinates","306476","2026-06-05","19:28:41",""
"7064399","5.08","0.02","16.32","0.07","13.82","0.06","90","","90.01","0.04","90","","1146","8","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H10 N4 -","- C13 H10 N4 -","- C52 H40 N16 -","4","2","","Almin, Arzu; Basumatary, Devi; Konwar, Dipika; Dutta, Prajjalita; Borah, Jagat C.; Bora, Utpal","Regioselective N2-arylation of tetrazoles under CuO nanocatalysis: a route to potent anti-MRSA agents","New Journal of Chemistry","2026","50","14","6040","6047","10.1039/D5NJ04286K","","","0.71073","MoKα","","0.1715","0.0688","","","0.1277","0.1576","","","","","","1.043","","","","has coordinates","305712","2026-05-04","22:24:13",""
"7064400","15.7225","0.0002","15.8143","0.0002","30.8255","0.0004","90","","100.323","0.001","90","","7540.4","0.17","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C34 H32 Fe2 N2 S6 Zn -","- C34 H32 Fe2 N2 S6 Zn -","- C272 H256 Fe16 N16 S48 Zn8 -","8","2","","Makwana, Bhaveshkumar B.; Parmar, Heena A.; Khan, Adam N.; Padrón, José M.; Tarpada, Umesh P.","Ferrocene-functionalized dithiocarbamate complexes bearing thiophene arms: synthesis, crystal structure, electrochemical characterization, in silico interaction profiling, and apoptosis induction in HeLa cells","New Journal of Chemistry","2026","50","14","5848","5864","10.1039/D6NJ00551A","","","0.71073","MoKα","","0.0985","0.0878","","","0.2483","0.263","","","","","","1.063","","","","has coordinates","305714","2026-05-04","22:24:23",""
"7064401","16.444","0.0006","21.6279","0.0008","23.6553","0.0008","103.938","0.001","96.07","0.001","90.266","0.001","8115.6","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C74.4 H90 Dy3 N9 O21.6 -","- C74.4 H90 Dy3 N9 O21.6 -","- C297.6 H360 Dy12 N36 O86.4 -","4","2","","Pramanik, Abhishek; Mandal, Shuvankar; Borgohain, Parismita; Martins, Daniel O. T. A.; Sparkes, Hazel A.; Tuna, Floriana; Singh, Saurabh Kumar; Mohanta, Sasankasekhar","Experimental and theoretical insights into two tri- and tetranuclear DyIII SMMs reveal the unusual superiority of triangular dodecahedral DyIII over square antiprismatic DyIII as an SIM centre","New Journal of Chemistry","2026","50","15","6330","6346","10.1039/D6NJ00729E","","","0.71073","MoKα","","0.0521","0.0384","","","0.092","0.1014","","","","","","1.091","","","","has coordinates,has disorder","305715","2026-05-04","22:24:43",""
"7064402","12.87","0.002","15.06","0.003","18.148","0.003","90","","102.123","0.002","90","","3439","1","296","2","296.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C66 H66 Dy4 N8 O22 -","- C66 H66 Dy4 N8 O22 -","- C132 H132 Dy8 N16 O44 -","2","0.5","","Pramanik, Abhishek; Mandal, Shuvankar; Borgohain, Parismita; Martins, Daniel O. T. A.; Sparkes, Hazel A.; Tuna, Floriana; Singh, Saurabh Kumar; Mohanta, Sasankasekhar","Experimental and theoretical insights into two tri- and tetranuclear DyIII SMMs reveal the unusual superiority of triangular dodecahedral DyIII over square antiprismatic DyIII as an SIM centre","New Journal of Chemistry","2026","50","15","6330","6346","10.1039/D6NJ00729E","","","0.71073","MoKα","","0.0654","0.0413","","","0.0953","0.1098","","","","","","1.012","","","","has coordinates","305715","2026-05-04","22:24:43",""
"7064403","8.311","0.0002","16.9374","0.0004","8.916","0.0002","90","","103.736","0.001","90","","1219.18","0.05","273.15","","273.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","","Yang, Xiaoning; Wu, Shuyan; Wang, Jiayi; Peng, Yanqing; Song, Gonghua","Facile and direct synthesis of 1-phenyl-substituted β-benzofused oxygen heterocycles from benzoxaboroles and salicylaldehydes under amine catalysis","New Journal of Chemistry","2026","50","21","8962","8968","10.1039/D6NJ01557C","","x-ray","1.54178","CuKα","","0.0482","0.0458","","","0.1169","0.119","","","","","","1.074","","","","has coordinates","306475","2026-06-05","19:28:38",""
"7064408","4.5721","0.0002","15.6411","0.0007","10.7748","0.0005","90","","98.719","0.002","90","","761.63","0.06","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H4 N2 O3 S -","- C7 H4 N2 O3 S -","- C28 H16 N8 O12 S4 -","4","1","","Jebbari, Said; Omari, Mohamed; Fouad, Mohammed Riad; Mohammad-Salim, Haydar; Alaqarbeh, Marwa; Ben Ahmed, Ali; Tounsi, Abdessamad; Harrad, Mohamed Anouar","Synthesis and multiscale computational analysis of 6-nitrobenzoxazole-2-thione: electronic structure, intermolecular interactions, and predicted protease inhibition","New Journal of Chemistry","2026","50","20","8856","8867","10.1039/D6NJ00979D","","x-ray","0.71073","MoKα","","0.0359","0.0273","","","0.0759","0.0785","","","","","","1.104","","","","has coordinates","306471","2026-06-05","19:28:14",""
"7064427","17.8685","0.0008","20.0947","0.0009","42.1985","0.0019","97.054","0.002","100.416","0.002","91.774","0.002","14767.4","1.2","296.15","","296.15","","","","","","","","","8","P -1","-P 1","2","","","","- C154 H208 Cu9 Mo36 N44 O183 P12 Sr2 -","- C154 H142 Cu9 Mo36 N44 O148 P12 Sr2 -","- C308 H284 Cu18 Mo72 N88 O296 P24 Sr4 -","2","1","","Zhang, Xiaoyan; Dou, Yanrui; Xu, Na; Tan, Hui; Wang, Xiuli","Unveiling the catalytic potency of copper-integrated [P6Mo18O73]n−-based complexes: structural basis and enhanced performance in selective oxidation of aromatic alcohol","New Journal of Chemistry","2026","50","17","7470","7479","10.1039/D6NJ00261G","","x-ray","0.71073","MoKα","K-L~3~","0.0834","0.0741","","","0.1972","0.2011","","","","","","1.057","","","","has coordinates,has disorder","306233","2026-06-05","04:22:45",""
"7064428","18.3207","0.0005","26.9821","0.0008","28.8827","0.0009","116.86","0.001","94.499","0.001","104.035","0.001","12061.9","0.6","296.15","","296.15","","","","","","","","","8","P -1","-P 1","2","","","","- C259 H321 Mo72 N74 Na2 O324 P24 Sr4 -","- C259 H285 Mo72 N74 Na2 O306 P24 Sr4 -","- C259 H285 Mo72 N74 Na2 O306 P24 Sr4 -","1","0.5","","Zhang, Xiaoyan; Dou, Yanrui; Xu, Na; Tan, Hui; Wang, Xiuli","Unveiling the catalytic potency of copper-integrated [P6Mo18O73]n−-based complexes: structural basis and enhanced performance in selective oxidation of aromatic alcohol","New Journal of Chemistry","2026","50","17","7470","7479","10.1039/D6NJ00261G","","x-ray","0.71073","MoKα","K-L~3~","0.0355","0.0306","","","0.0777","0.0806","","","","","","1.019","","","","has coordinates,has disorder","306233","2026-06-05","04:22:45",""
"7064429","21.1022","0.0007","7.4454","0.0003","17.2701","0.0006","90","","97.501","0.002","90","","2690.16","0.17","193","","193","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H24 N2 O -","- C37 H24 N2 O -","- C148 H96 N8 O4 -","4","1","","Zhang, Zhihua; Qu, Hongmei; Li, Xia; Li, Yameng; Dai, Ruihan; Zhang, Xuesong; Pan, Wenjing","D–π–A type AIE molecules exhibiting persistent room temperature phosphorescence and delayed fluorescence through structural regulation","New Journal of Chemistry","2026","50","20","8823","8834","10.1039/D6NJ00835F","","","1.54178","CuKα","","0.0625","0.0465","","","0.1086","0.1154","","","","","","1.1","","","","has coordinates","306234","2026-06-05","04:24:01",""
"7064430","18.7211","0.0006","9.7293","0.0003","11.9442","0.0004","90","","94.533","0.001","90","","2168.75","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H20 N2 O -","- C31 H20 N2 O -","- C124 H80 N8 O4 -","4","1","","Zhang, Zhihua; Qu, Hongmei; Li, Xia; Li, Yameng; Dai, Ruihan; Zhang, Xuesong; Pan, Wenjing","D–π–A type AIE molecules exhibiting persistent room temperature phosphorescence and delayed fluorescence through structural regulation","New Journal of Chemistry","2026","50","20","8823","8834","10.1039/D6NJ00835F","","","1.54178","CuKα","","0.0412","0.0408","","","0.1005","0.1008","","","","","","1.092","","","","has coordinates","306234","2026-06-05","04:24:01",""
"7064431","12.414","0.002","10.7894","0.0018","37.137","0.007","90","","99.503","0.006","90","","4905.9","1.5","193","","193","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C35 H22 N2 O -","- C35 H22 N2 O -","- C280 H176 N16 O8 -","8","4","","Zhang, Zhihua; Qu, Hongmei; Li, Xia; Li, Yameng; Dai, Ruihan; Zhang, Xuesong; Pan, Wenjing","D–π–A type AIE molecules exhibiting persistent room temperature phosphorescence and delayed fluorescence through structural regulation","New Journal of Chemistry","2026","50","20","8823","8834","10.1039/D6NJ00835F","","x-ray","1.34139","GaKα","","0.1916","0.0931","","","0.2345","0.2978","","","","","","0.996","","","","has coordinates","306234","2026-06-05","04:24:01",""
"7064432","8.4189","0.0006","9.7283","0.0006","16.3395","0.0011","79.07","0.003","79.629","0.002","81.041","0.003","1282.2","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H26 N2 O -","- C34 H26 N2 O -","- C68 H52 N4 O2 -","2","1","","Arunkumar, S.; Kumar, George Rajendra","Regioisomers of carbazole- and triphenylamine-based D–A–D ternaries: synthesis, optical properties and colorimetric vapochromic anti-counterfeiting application","New Journal of Chemistry","2026","50","18","7706","7714","10.1039/D6NJ00809G","","","0.71073","MoKα","","0.1214","0.0804","","","0.2057","0.2231","","","","","","1.371","","","","has coordinates","306235","2026-06-05","04:24:10",""
"7064433","8.6028","","9.6724","","15.9684","","90.14","","96.18","","106.653","","1264.82","","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C68 H52 N4 O2 -","- C68 H52 N4 O2 -","- C68 H52 N4 O2 -","1","0.5","","Arunkumar, S.; Kumar, George Rajendra","Regioisomers of carbazole- and triphenylamine-based D–A–D ternaries: synthesis, optical properties and colorimetric vapochromic anti-counterfeiting application","New Journal of Chemistry","2026","50","18","7706","7714","10.1039/D6NJ00809G","","","0.71073","MoKα","","0.0606","0.051","","","0.1838","0.1968","","","","","","1.5573","","","","has coordinates","306235","2026-06-05","04:24:10",""