# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-24T16:44:47+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'New Journal of Chemistry') AND volume = 49 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
"1573391","19.927","0.003","21.694","0.003","34.974","0.006","90","","104.466","0.005","90","","14640","4","200","2","200","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C87 H81 B Cu F4 N4 O2.5 P2 -","- C81 H66 B Cu F4 N4 O P2 -","- C648 H528 B8 Cu8 F32 N32 O8 P16 -","8","1","","Wang, Xinwei; Li, Weijun; Li, Xiao; Hou, Chenlu; Wei, Sanyue; Lei, Wenxin; Chen, Xu-Lin","TADF-emitting copper(i) and silver(i) complexes featuring intra-ligand charge transfer based on a donor–acceptor–donor ligand","New Journal of Chemistry","2025","49","3","755","760","10.1039/D4NJ04193C","","","0.71073","MoKα","","0.1146","0.0779","","","0.2148","0.2459","","","","","","1.04","","","","has coordinates,has disorder","299050","2025-04-05","03:53:52",""
"1573392","19.2498","0.0002","25.6897","0.0003","31.4864","0.0004","77.9013","0.001","78.6755","0.001","89.8003","0.0009","14916.9","0.3","113","20","113","20","","","","","","","","8","P -1","-P 1","2","","","","- C85 H76 Ag B F4 N4 O2 P2 -","- C85 H75.625 Ag B F4 N4 O2 P2 -","- C680 H605 Ag8 B8 F32 N32 O16 P16 -","8","4","","Wang, Xinwei; Li, Weijun; Li, Xiao; Hou, Chenlu; Wei, Sanyue; Lei, Wenxin; Chen, Xu-Lin","TADF-emitting copper(i) and silver(i) complexes featuring intra-ligand charge transfer based on a donor–acceptor–donor ligand","New Journal of Chemistry","2025","49","3","755","760","10.1039/D4NJ04193C","","x-ray","1.54184","CuKα","","0.0759","0.0696","","","0.1899","0.1939","","","","","","1.065","","","","has coordinates,has disorder","299050","2025-04-05","03:53:52",""
"1573393","10.556","0.002","5.7279","0.0012","21.606","0.005","90","","97.049","0.008","90","","1296.5","0.5","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 N7 O5 -","- C9 H7 N7 O5 -","- C36 H28 N28 O20 -","4","1","","Cai, Ziwu; Shi, Junhao; Yu, Qian; Jiang, Tianyu; Zhang, Wenquan","4-Amino-1,2,3-triazine 2-oxide: a promising structural unit for the design and synthesis of novel energetic materials with good thermal stability and low impact sensitivity","New Journal of Chemistry","2025","49","1","302","310","10.1039/D4NJ04219K","","","0.71073","MoKα","","0.1126","0.0565","","","0.1249","0.1587","","","","","","1.018","","","","has coordinates","298994","2025-04-05","03:40:08",""
"1573394","5.8169","0.0003","10.8115","0.0005","15.0344","0.0008","90","","90","","90","","945.5","0.08","102","","102","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H5 N7 O5 -","- C7 H5 N7 O5 -","- C28 H20 N28 O20 -","4","1","","Cai, Ziwu; Shi, Junhao; Yu, Qian; Jiang, Tianyu; Zhang, Wenquan","4-Amino-1,2,3-triazine 2-oxide: a promising structural unit for the design and synthesis of novel energetic materials with good thermal stability and low impact sensitivity","New Journal of Chemistry","2025","49","1","302","310","10.1039/D4NJ04219K","","","0.71073","MoKα","","0.0562","0.0389","","","0.0844","0.0939","","","","","","1.037","","","","has coordinates","298994","2025-04-05","03:40:09",""
"1573395","9.1158","0.001","9.8374","0.0013","25.365","0.003","90","","90","","90","","2274.6","0.5","149.99","0.1","149.99","0.1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H13 N O -","- C14 H13 N O -","- C112 H104 N8 O8 -","8","1","","Qin, Chang-Qing; Liu, Xin-Ni; Gu, Man-Zhen; Xu, Yi-Bing; Chen, Guo-Shu; Liu, Yun-Lin","DBU-mediated synthesis of amides from carbodiimides and unstrained 1,3-diketones","New Journal of Chemistry","2025","49","2","366","370","10.1039/D4NJ04537H","","x-ray","1.54184","CuKα","","0.1071","0.0771","","","0.209","0.2623","","","","","","1.111","","","","has coordinates","299012","2025-04-05","03:43:51",""
"1573726","8.029","0.0003","12.7021","0.0004","13.0187","0.0004","90","","93.446","0.003","90","","1325.31","0.08","169.99","0.1","169.99","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 N3 O3 -","- C16 H13 N3 O3 -","- C64 H52 N12 O12 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0489","0.0409","","","0.1104","0.1157","","","","","","1.062","","","","has coordinates","299000","2025-04-05","03:41:37",""
"1573727","11.4544","0.0006","15.8163","0.0008","7.4627","0.0004","90","","103.569","0.006","90","","1314.25","0.12","294.98","0.13","294.98","0.13","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 N3 O -","- C16 H13 N3 O -","- C64 H52 N12 O4 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0649","0.0564","","","0.1072","0.1118","","","","","","1.047","","","","has coordinates","299000","2025-04-05","03:41:38",""
"1573728","3.9386","0.0001","29.5669","0.0007","11.7999","0.0002","90","","96.592","0.002","90","","1365.04","0.05","294.98","0.11","294.98","0.11","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2","3-{(E)-[(2,4-dihydroxyphenyl)methylidene]amino}-2-methylquinazolin-4(3H)-one","","- C16 H13 N3 O3 -","- C16 H13 N3 O3 -","- C64 H52 N12 O12 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","1.54184","CuKα","","0.0535","0.0442","","","0.1192","0.1275","","","","","","1.066","","","","has coordinates","299000","2025-04-05","03:41:38",""
"1573729","7.9879","0.0003","13.1032","0.0004","14.7678","0.0006","71.525","0.003","76.046","0.003","81.964","0.003","1419.4","0.09","294.99","0.12","294.99","0.12","","","","","","","","5","P -1","-P 1","2","","","","- C16 H12 Cl N3 O -","- C16 H12 Cl N3 O -","- C64 H48 Cl4 N12 O4 -","4","2","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0638","0.0477","","","0.1321","0.1415","","","","","","1.039","","","","has coordinates","299000","2025-04-05","03:41:38",""
"1573730","8.7501","0.001","8.951","0.0007","21.2255","0.0013","90","","97.446","0.008","90","","1648.4","0.3","294.98","0.11","294.98","0.11","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 N3 O4 -","- C17 H17 N3 O4 -","- C68 H68 N12 O16 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0959","0.0652","","","0.1633","0.1817","","","","","","1.024","","","","has coordinates","299000","2025-04-05","03:41:38",""
"7063510","27.1448","0.0013","9.4225","0.0004","27.3977","0.0012","90","","92.154","0.002","90","","7002.6","0.5","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H41 Cl3 Ni O4 P2 -","- C32 H41 Cl3 Ni O4 P2 -","- C256 H328 Cl24 Ni8 O32 P16 -","8","2","","López-Robledo, Luis E.; Ortiz-Fuentes, Evelin E.; Rufino-Felipe, Ernesto; Serrano-García, Juan S.; Arenaza-Corona, Antonino; Hernandez-Ortega, Simón; Valdés, Hugo; Gonzalez-Sebastian, Lucero; Reyes-Márquez, Viviana; Morales-Morales, David","Naphthyl and biphenyl para-substituted POCOP-Ni(ii) pincer complexes as efficient catalysts in C–S cross-coupling reactions","New Journal of Chemistry","2025","49","9","3426","3435","10.1039/D4NJ03776F","","","0.71073","MoKα","","0.0701","0.0591","","","0.1273","0.1326","","","","","","1.164","","","","has coordinates","299036","2025-04-05","03:50:51",""
"7063511","9.136","0.0004","29.4452","0.0016","12.7283","0.0007","90","","94.484","0.002","90","","3413.6","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H29 Cl Ni O4 P2 -","- C41 H29 Cl Ni O4 P2 -","- C164 H116 Cl4 Ni4 O16 P8 -","4","1","","López-Robledo, Luis E.; Ortiz-Fuentes, Evelin E.; Rufino-Felipe, Ernesto; Serrano-García, Juan S.; Arenaza-Corona, Antonino; Hernandez-Ortega, Simón; Valdés, Hugo; Gonzalez-Sebastian, Lucero; Reyes-Márquez, Viviana; Morales-Morales, David","Naphthyl and biphenyl para-substituted POCOP-Ni(ii) pincer complexes as efficient catalysts in C–S cross-coupling reactions","New Journal of Chemistry","2025","49","9","3426","3435","10.1039/D4NJ03776F","","","0.71073","MoKα","","0.0561","0.0436","","","0.0883","0.0948","","","","","","1.116","","","","has coordinates","299036","2025-04-05","03:50:51",""
"7063512","8.0438","0.0002","28.5592","0.001","16.4261","0.0005","90","","102.766","0.001","90","","3680.2","0.19","199","2","199","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C73 H98 Cl2 Ni2 O8 P4 -","- C73 H98 Cl2 Ni2 O8 P4 -","- C146 H196 Cl4 Ni4 O16 P8 -","2","0.5","","López-Robledo, Luis E.; Ortiz-Fuentes, Evelin E.; Rufino-Felipe, Ernesto; Serrano-García, Juan S.; Arenaza-Corona, Antonino; Hernandez-Ortega, Simón; Valdés, Hugo; Gonzalez-Sebastian, Lucero; Reyes-Márquez, Viviana; Morales-Morales, David","Naphthyl and biphenyl para-substituted POCOP-Ni(ii) pincer complexes as efficient catalysts in C–S cross-coupling reactions","New Journal of Chemistry","2025","49","9","3426","3435","10.1039/D4NJ03776F","","","0.71073","MoKα","","0.0768","0.0502","","","0.0971","0.1089","","","","","","1.068","","","","has coordinates,has disorder","299036","2025-04-05","03:50:51",""
"7063530","13.8856","0.0003","15.5863","0.0004","12.3909","0.0003","90","","92.948","0.002","90","","2678.15","0.11","93","","93","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis[5-(4-chlorophenyl)-3-hydroxy-4-methylthiazole-2(3H)-thionolato]zinc(II)","","- C25 H19 Cl2 N3 O2 S4 Zn -","- C25 H19 Cl2 N3 O2 S4 Zn -","- C100 H76 Cl8 N12 O8 S16 Zn4 -","4","1","","Saito, Ryota; Naito, Yuki; Yoshikawa, Yutaka; Yasui, Hiroyuki; Kikkawa, Shoko; Ju, Huiyeong; Ohba, Rintaro; Miyamoto, Tae; Sano, Shogo; Maeda, Kazuya; Tamura, Mako; Azumaya, Isao","Synthesis, crystal structure, and insulin-mimetic activity of zinc(ii) complexes with 4-alkyl- and 4,5-dialkyl-3-hydroxythiazole-2(3H)-thiones as a new class of hypoglycemic agent candidates","New Journal of Chemistry","2025","49","4","1145","1158","10.1039/D4NJ04035J","","","0.71073","MoKα","","0.0442","0.0317","","","0.0662","0.0696","","","","","","1.027","","","","has coordinates","299008","2025-04-05","03:43:18",""
"7063531","11.6997","0.0005","7.5824","0.0003","17.0546","0.0007","90","","108.729","0.0006","90","","1432.83","0.1","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[3-hydroxy-4,5-dimethyl-2-thioxo-3-thiazololato]zinc(II)","","- C10 H12 N2 O2 S4 Zn -","- C10 H12 N2 O2 S4 Zn -","- C40 H48 N8 O8 S16 Zn4 -","4","1","","Saito, Ryota; Naito, Yuki; Yoshikawa, Yutaka; Yasui, Hiroyuki; Kikkawa, Shoko; Ju, Huiyeong; Ohba, Rintaro; Miyamoto, Tae; Sano, Shogo; Maeda, Kazuya; Tamura, Mako; Azumaya, Isao","Synthesis, crystal structure, and insulin-mimetic activity of zinc(ii) complexes with 4-alkyl- and 4,5-dialkyl-3-hydroxythiazole-2(3H)-thiones as a new class of hypoglycemic agent candidates","New Journal of Chemistry","2025","49","4","1145","1158","10.1039/D4NJ04035J","","","0.71073","MoKα","","0.0312","0.0299","","","0.0855","0.0865","","","","","","1.045","","","","has coordinates","299008","2025-04-05","03:43:19",""
"7063532","7.5733","0.0016","8.7066","0.0019","13.442","0.003","78.741","0.002","74.963","0.002","88.673","0.003","839.2","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","Bis[4-ethyl-3-hydroxy-5-methylthiazole-2(3H)-thionolato]zinc(II)","","- C12 H16 N2 O2 S4 Zn -","- C12 H16 N2 O2 S4 Zn -","- C24 H32 N4 O4 S8 Zn2 -","2","1","","Saito, Ryota; Naito, Yuki; Yoshikawa, Yutaka; Yasui, Hiroyuki; Kikkawa, Shoko; Ju, Huiyeong; Ohba, Rintaro; Miyamoto, Tae; Sano, Shogo; Maeda, Kazuya; Tamura, Mako; Azumaya, Isao","Synthesis, crystal structure, and insulin-mimetic activity of zinc(ii) complexes with 4-alkyl- and 4,5-dialkyl-3-hydroxythiazole-2(3H)-thiones as a new class of hypoglycemic agent candidates","New Journal of Chemistry","2025","49","4","1145","1158","10.1039/D4NJ04035J","","","0.71073","MoKα","","0.0609","0.0376","","","0.0844","0.0963","","","","","","1.006","","","","has coordinates","299008","2025-04-05","03:43:19",""
"7063533","8.6523","0.0003","21.5296","0.0008","10.1015","0.0004","90","","103.203","0.0006","90","","1831.97","0.12","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis[4-(tert-butyl)-3-hydroxythiazole-2(3H)-thionolato]zinc(II)","","- C14 H20 N2 O2 S4 Zn -","- C14 H20 N2 O2 S4 Zn -","- C56 H80 N8 O8 S16 Zn4 -","4","1","","Saito, Ryota; Naito, Yuki; Yoshikawa, Yutaka; Yasui, Hiroyuki; Kikkawa, Shoko; Ju, Huiyeong; Ohba, Rintaro; Miyamoto, Tae; Sano, Shogo; Maeda, Kazuya; Tamura, Mako; Azumaya, Isao","Synthesis, crystal structure, and insulin-mimetic activity of zinc(ii) complexes with 4-alkyl- and 4,5-dialkyl-3-hydroxythiazole-2(3H)-thiones as a new class of hypoglycemic agent candidates","New Journal of Chemistry","2025","49","4","1145","1158","10.1039/D4NJ04035J","","","0.71073","MoKα","","0.0249","0.0223","","","0.0553","0.057","","","","","","1.03","","","","has coordinates","299008","2025-04-05","03:43:19",""
"7063534","8.3806","0.0003","13.3652","0.0004","9.0229","0.0003","90","","103.793","0.0004","90","","981.5","0.06","120","","120","","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis[3-hydroxy-4,5-dimethyl-2-thioxo-3-thiazololato]zinc(II)","","- C15 H17 N3 O2 S4 Zn -","- C15 H17 N3 O2 S4 Zn -","- C30 H34 N6 O4 S8 Zn2 -","2","1","","Saito, Ryota; Naito, Yuki; Yoshikawa, Yutaka; Yasui, Hiroyuki; Kikkawa, Shoko; Ju, Huiyeong; Ohba, Rintaro; Miyamoto, Tae; Sano, Shogo; Maeda, Kazuya; Tamura, Mako; Azumaya, Isao","Synthesis, crystal structure, and insulin-mimetic activity of zinc(ii) complexes with 4-alkyl- and 4,5-dialkyl-3-hydroxythiazole-2(3H)-thiones as a new class of hypoglycemic agent candidates","New Journal of Chemistry","2025","49","4","1145","1158","10.1039/D4NJ04035J","","","0.71073","MoKα","","0.0169","0.0168","","","0.0444","0.0445","","","","","","1.064","","","","has coordinates","299008","2025-04-05","03:43:19",""
"7063535","11.9955","0.0007","10.9525","0.0007","12.7788","0.0008","90","","94.206","0.001","90","","1674.37","0.18","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis[3-hydroxy-4,5,6,7-tetrahydrobenzo[d]thiazole-2(3H)-thionolato]zinc(II)","","- C14 H16 N2 O2 S4 Zn -","- C14 H16 N2 O2 S4 Zn -","- C56 H64 N8 O8 S16 Zn4 -","4","0.5","","Saito, Ryota; Naito, Yuki; Yoshikawa, Yutaka; Yasui, Hiroyuki; Kikkawa, Shoko; Ju, Huiyeong; Ohba, Rintaro; Miyamoto, Tae; Sano, Shogo; Maeda, Kazuya; Tamura, Mako; Azumaya, Isao","Synthesis, crystal structure, and insulin-mimetic activity of zinc(ii) complexes with 4-alkyl- and 4,5-dialkyl-3-hydroxythiazole-2(3H)-thiones as a new class of hypoglycemic agent candidates","New Journal of Chemistry","2025","49","4","1145","1158","10.1039/D4NJ04035J","","","0.71073","MoKα","","0.0262","0.0232","","","0.0568","0.06","","","","","","1.033","","","","has coordinates","299008","2025-04-05","03:43:19",""
"7063542","6.7789","0.0003","28.837","0.0012","9.0488","0.0004","90","","106.466","0.001","90","","1696.34","0.13","293","2","293.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2","","- C15 H13 N2 O5 Re S -","- C15 H13 N2 O5 Re S -","- C60 H52 N8 O20 Re4 S4 -","4","1","","Das, Akash; Guha, Subhabrata; Halder, Arpan; Gharami, Saswati; Naskar, Rahul; Das, Gaurav; Mondal, Tapan K.","Synthesis, characterization, DNA/protein-binding study and anticancer activity of novel tricarbonyl Re(i) complexes with an ONS donor azo-thioether pincer ligand","New Journal of Chemistry","2025","49","2","559","571","10.1039/D4NJ03255A","","","0.71073","MoKα","","0.0313","0.0281","","","0.0698","0.0719","","","","","","1.12","","","","has coordinates","299015","2025-04-05","03:44:21",""
"7063543","12.3197","0.0013","18.6903","0.0019","9.6299","0.0011","90","","111.997","0.003","90","","2056","0.4","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 N2 O4 Re S -","- C21 H15 N2 O4 Re S -","- C84 H60 N8 O16 Re4 S4 -","4","1","","Das, Akash; Guha, Subhabrata; Halder, Arpan; Gharami, Saswati; Naskar, Rahul; Das, Gaurav; Mondal, Tapan K.","Synthesis, characterization, DNA/protein-binding study and anticancer activity of novel tricarbonyl Re(i) complexes with an ONS donor azo-thioether pincer ligand","New Journal of Chemistry","2025","49","2","559","571","10.1039/D4NJ03255A","","","0.71073","MoKα","","0.0277","0.023","","","0.0541","0.0566","","","","","","1.065","","","","has coordinates","299015","2025-04-05","03:44:32",""
"7063544","8.7357","0.0004","12.7597","0.0006","14.3635","0.0006","90","","90","","90","","1601.03","0.12","300","","300","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- B8 Cs1.13 N O16 Rb1.87 -","- B8 Cs1.131 N O16 Rb1.869 -","- B32 Cs4.524 N4 O64 Rb7.476 -","4","1","","Liu, Changyou; Liu, Xu; Feng, Qiuyuan; Hou, Ketian; Zhang, Bei; Lu, Juanjuan","Rb1.87Cs1.13B8O13(NO3): a new acentric borate-nitrate with two types of three-dimensional interpenetrating lattices","New Journal of Chemistry","2025","49","2","360","365","10.1039/D4NJ04372C","","","0.71073","MoKα","","0.0359","0.0296","","","0.0574","0.0606","","","","","","1.043","","","","has coordinates","299016","2025-04-05","03:44:39",""
"7063545","25.474","0.014","14.648","0.008","6.969","0.004","90","","94.997","0.017","90","","2591","2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H7 Ag N3 O6 -","- C12 H7 Ag N3 O6 -","- C96 H56 Ag8 N24 O48 -","8","1","","Kaur, Rupali; Yadav, Neeraj; Gouda, Laxman; Jassal, Amanpreet Kaur","Insight into the diversity of dimensionality in silver-based coordination polymers for enhanced supercapacitor performance","New Journal of Chemistry","2025","49","1","141","159","10.1039/D4NJ04451G","","","0.71073","MoKα","","0.1263","0.0594","","","0.1436","0.1781","","","","","","0.883","","","","has coordinates","298995","2025-04-05","03:40:19",""
"7063546","7.1387","0.0003","9.6061","0.0004","11.4125","0.0005","90.441","0.0017","94.919","0.0015","108.822","0.0016","737.52","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H15 Ag N2 O4 -","- C16 H15 Ag N2 O4 -","- C32 H30 Ag2 N4 O8 -","2","1","","Kaur, Rupali; Yadav, Neeraj; Gouda, Laxman; Jassal, Amanpreet Kaur","Insight into the diversity of dimensionality in silver-based coordination polymers for enhanced supercapacitor performance","New Journal of Chemistry","2025","49","1","141","159","10.1039/D4NJ04451G","","","0.71073","MoKα","","0.0341","0.0279","","","0.0706","0.0753","","","","","","1.057","","","","has coordinates","298995","2025-04-05","03:40:20",""
"7063550","17.3013","0.0015","4.7563","0.0004","26.838","0.002","90","","98.01","0.004","90","","2187","0.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 Br2 O2 S4 Zn -","- C20 H16 Br2 O2 S4 Zn -","- C80 H64 Br8 O8 S16 Zn4 -","4","0.5","","Yadav, Chote Lal; Anamika,; Singh, Rajan; Kumar, Akhilesh; Singh, Rakesh K.; Drew, Michael G. B.; Manar, Krishna K.; Singh, Nanhai","Anti-leishmanial study of discrete tetrahedral zinc(ii) β-oxodithioester complexes","New Journal of Chemistry","2025","49","2","484","496","10.1039/D4NJ04275A","","","0.71073","MoKα","","0.0932","0.048","","","0.0814","0.0934","","","","","","1.03","","","","has coordinates","299014","2025-04-05","03:44:07",""
"7063551","24.5268","0.0014","4.7097","0.0003","16.8095","0.0009","90","","110.665","0.003","90","","1816.8","0.19","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 O4 S4 Zn -","- C16 H14 O4 S4 Zn -","- C64 H56 O16 S16 Zn4 -","4","0.5","","Yadav, Chote Lal; Anamika,; Singh, Rajan; Kumar, Akhilesh; Singh, Rakesh K.; Drew, Michael G. B.; Manar, Krishna K.; Singh, Nanhai","Anti-leishmanial study of discrete tetrahedral zinc(ii) β-oxodithioester complexes","New Journal of Chemistry","2025","49","2","484","496","10.1039/D4NJ04275A","","","0.71073","MoKα","","0.0443","0.0363","","","0.0833","0.088","","","","","","1.072","","","","has coordinates,has disorder","299014","2025-04-05","03:44:08",""
"7063552","17.3481","0.0016","51.429","0.005","4.7643","0.0004","90","","90","","90","","4250.7","0.7","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C20 H16 F2 O2 S4 Zn -","- C20 H16 F2 O2 S4 Zn -","- C160 H128 F16 O16 S32 Zn8 -","8","0.5","","Yadav, Chote Lal; Anamika,; Singh, Rajan; Kumar, Akhilesh; Singh, Rakesh K.; Drew, Michael G. B.; Manar, Krishna K.; Singh, Nanhai","Anti-leishmanial study of discrete tetrahedral zinc(ii) β-oxodithioester complexes","New Journal of Chemistry","2025","49","2","484","496","10.1039/D4NJ04275A","","","0.71073","MoKα","","0.0199","0.0189","","","0.0449","0.0455","","","","","","1.07","","","","has coordinates","299014","2025-04-05","03:44:08",""
"7063553","3.59786","0.00013","11.9961","0.0004","4.7679","0.0002","90","","105.285","0.0006","90","","198.505","0.013","298","","298","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","1,4-dihydro[1,2,3]triazolo[4,5-d][1,2,3]triazole","","- C2 H2 N6 -","- C2 H2 N6 -","- C4 H4 N12 -","2","0.5","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","powder diffraction","x-ray","1.5406","CuKα~1~","","","","","","","","","0.00889","3.602","","","","","","","has coordinates","298997","2025-04-05","03:40:47",""
"7063554","4.1132","0.0006","6.0633","0.0008","6.1413","0.0008","92.207","0.005","96.659","0.005","100.975","0.005","149.06","0.04","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C4 H6 N6 -","- C4 H6 N6 -","- C4 H6 N6 -","1","0.5","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","","0.71073","MoKα","","0.0517","0.0424","","","0.1041","0.1117","","","","","","1.015","","","","has coordinates","298997","2025-04-05","03:40:47",""
"7063555","3.879","0.0003","6.2602","0.0005","12.9022","0.0011","90","","98.274","0.002","90","","310.05","0.04","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C4 H6 N6 -","- C4 H6 N6 -","- C8 H12 N12 -","2","0.5","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","","0.71073","MoKα","","0.0392","0.0379","","","0.0975","0.0984","","","","","","1.07","","","","has coordinates,has disorder","298997","2025-04-05","03:40:47",""
"7063556","3.6557","0.0005","10.3968","0.0014","13.7717","0.0018","90","","90","","90","","523.43","0.12","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H2 N6 O -","- C3 H2 N6 O -","- C12 H8 N24 O4 -","4","1","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","","0.71073","MoKα","","0.0382","0.0312","","","0.0763","0.0783","","","","","","0.999","","","","has coordinates","298997","2025-04-05","03:40:47",""
"7063557","10.1984","0.0009","13.0426","0.0011","14.4939","0.0012","90","","90","","90","","1927.9","0.3","140","2","140","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H27 Cl N6 O4 -","- C14 H27 Cl N6 O4 -","- C56 H108 Cl4 N24 O16 -","4","1","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","","0.71073","MoKα","","0.056","0.0407","","","0.1008","0.1054","","","","","","1.081","","","","has coordinates","298997","2025-04-05","03:40:47",""
"7063558","12.0258","0.0005","9.4375","0.0004","25.3166","0.0012","90","","103.74","0.001","90","","2791","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H54 N8 O7 -","- C18 H54 N8 O7 -","- C72 H216 N32 O28 -","4","0.5","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","","0.71073","MoKα","","0.0643","0.045","","","0.1108","0.1205","","","","","","1.015","","","","has coordinates,has disorder","298997","2025-04-05","03:40:47",""
"7063559","7.349","0.0002","7.9396","0.0002","10.7583","0.0003","95.085","0.002","92.657","0.002","96.029","0.002","620.82","0.03","100","0.1","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C4 H6 N6 -","- C4 H6 N6 -","- C16 H24 N24 -","4","2","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","x-ray","1.54184","CuKα","","0.0441","0.0416","","","0.1043","0.1065","","","","","","1.038","","","","has coordinates","298997","2025-04-05","03:40:47",""
"7063560","10.7292","0.0001","7.5194","0.0001","12.3463","0.0001","90","","96.776","0.001","90","","989.107","0.018","99.99","0.1","99.99","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H13 N7 O -","- C7 H13 N7 O -","- C28 H52 N28 O4 -","4","1","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","x-ray","1.54184","CuKα","","0.0392","0.0385","","","0.0969","0.0975","","","","","","1.09","","","","has coordinates","298997","2025-04-05","03:40:47",""
"7063561","6.5074","0.0003","13.053","0.0006","7.7581","0.0004","90","","114.532","0.002","90","","599.49","0.05","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H3 Cl N6 -","- C2 H3 Cl N6 -","- C8 H12 Cl4 N24 -","4","1","","Kuznetsova, Agata N.; Leonov, Nikita E.; Anikin, Oleg V.; Klenov, Michael S.; Churakov, Aleksandr M.; Strelenko, Yurii A.; Novikov, Roman A.; Fedyanin, Ivan V.; Pivkina, Alla N.; Kon’kova, Tatiana S.; Sinditskii, Valery P.; Smirnova, Anastasia D.; Tartakovsky, Vladimir A.","Parent 1,4-dihydro-[1,2,3]triazolo[4,5-d][1,2,3]triazole and its derivatives as precursors for the design of promising high energy density materials","New Journal of Chemistry","2025","49","1","311","320","10.1039/D4NJ04427D","","","0.71073","MoKα","","0.0323","0.0263","","","0.0719","0.0734","","","","","","1.151","","","","has coordinates","298997","2025-04-05","03:40:47",""
"7063565","27.756","0.003","4.6794","0.0005","19.632","0.002","90","","90.257","0.004","90","","2549.8","0.5","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H12 N6 O5 S -","- C9 H12 N6 O5 S -","- C72 H96 N48 O40 S8 -","8","1","","Liang, Ying; Hu, Xian-Kun; Yang, Zhang-Lei; Liu, Miao-Miao; Zhang, Yao; Wu, Jin-Ting; Zhang, Jian-Guo; Zhao, Ting-Xing; Sun, Shan-Hu; Wang, Shu-Min","Benzimidazole-based low-sensitivity and heat-resistant energetic materials: design and synthesis","New Journal of Chemistry","2025","49","1","257","262","10.1039/D4NJ04471A","","","0.71073","MoKα","","0.1382","0.0731","","","0.1322","0.1669","","","","","","1.05","","","","has coordinates,has disorder","298996","2025-04-05","03:40:33",""
"7063567","14.4806","0.0003","23.7117","0.0007","8.07794","0.00019","90","","101.305","0.002","90","","2719.82","0.12","100.01","0.1","100.01","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24.92 H28.92 Co N2 O13 -","- C24.922 H28.922 Co N2 O13 -","- C99.688 H115.688 Co4 N8 O52 -","4","0.5","","Gumtya, Milan; Mondal, Ayan; Banerjee, Rahul; Haldar, Debasish","Efficient electrocatalytic water oxidation by N-phthaloyl-γ-aminobutyric acid-cobalt 1D MOF","New Journal of Chemistry","2025","49","2","530","535","10.1039/D4NJ03470H","","x-ray","1.54184","CuKα","","0.0523","0.0468","","","0.1279","0.1322","","","","","","1.058","","","","has coordinates","299013","2025-04-05","03:43:59",""
"7063568","8.04154","0.00011","15.1977","0.0002","19.5905","0.0003","90","","93.9704","0.0013","90","","2388.47","0.06","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 Co N2 O11 -","- C24 H26 Co N2 O11 -","- C96 H104 Co4 N8 O44 -","4","1","","Gumtya, Milan; Mondal, Ayan; Banerjee, Rahul; Haldar, Debasish","Efficient electrocatalytic water oxidation by N-phthaloyl-γ-aminobutyric acid-cobalt 1D MOF","New Journal of Chemistry","2025","49","2","530","535","10.1039/D4NJ03470H","","x-ray","1.54184","CuKα","","0.0553","0.0449","","","0.1197","0.1259","","","","","","1.074","","","","has coordinates","299013","2025-04-05","03:43:59",""
"7063569","11.8334","0.0005","17.227","0.0007","8.0612","0.0003","90","","98.576","0.004","90","","1624.93","0.11","301.2","0.1","301.2","0.1","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C16 H30 Cl2 I6 N2 O2 Pb2 -","- C16 H30 Cl2 I6 N2 O2 Pb2 -","- C32 H60 Cl4 I12 N4 O4 Pb4 -","2","1","","Hu, Hui-Yi; Xu, Ya-Xin; Yuan, Shu-Ting; Ma, Jing-Yang; Xia, Guang; Shi, Shu-Ting; Zhou, Zi-Xiong; Yuan, Jin-Bin; Yu, Li-De","Halogen engineering tuned band gap and structural phase transition in lead iodide hybrid perovskite semiconductors","New Journal of Chemistry","2025","49","2","600","604","10.1039/D4NJ04595E","","x-ray","0.71073","MoKα","","0.0532","0.0368","","","0.0832","0.0882","","","","","","0.954","","","","has coordinates","299017","2025-04-05","03:44:46",""
"7063570","8.0496","0.0004","9.9774","0.0005","21.0802","0.0013","90","","94.908","0.005","90","","1686.83","0.16","301.18","0.1","301.18","0.1","","","","","","","","6","I 1 2 1","I 2y","5","","","","- C8 H15 I4 N O Pb -","- C8 H15 I4 N O Pb -","- C32 H60 I16 N4 O4 Pb4 -","4","1","","Hu, Hui-Yi; Xu, Ya-Xin; Yuan, Shu-Ting; Ma, Jing-Yang; Xia, Guang; Shi, Shu-Ting; Zhou, Zi-Xiong; Yuan, Jin-Bin; Yu, Li-De","Halogen engineering tuned band gap and structural phase transition in lead iodide hybrid perovskite semiconductors","New Journal of Chemistry","2025","49","2","600","604","10.1039/D4NJ04595E","","x-ray","0.71073","MoKα","","0.0476","0.0375","","","0.0927","0.0966","","","","","","1.01","","","","has coordinates","299017","2025-04-05","03:44:46",""
"7063571","17.9058","0.001","8.079","0.0004","23.1217","0.0011","90","","90","","90","","3344.8","0.3","286.9","0.3","286.9","0.3","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 Br2 I6 N2 O2 Pb2 -","- C16 H28 Br2 I6 N2 O2 Pb2 -","- C64 H112 Br8 I24 N8 O8 Pb8 -","4","1","","Hu, Hui-Yi; Xu, Ya-Xin; Yuan, Shu-Ting; Ma, Jing-Yang; Xia, Guang; Shi, Shu-Ting; Zhou, Zi-Xiong; Yuan, Jin-Bin; Yu, Li-De","Halogen engineering tuned band gap and structural phase transition in lead iodide hybrid perovskite semiconductors","New Journal of Chemistry","2025","49","2","600","604","10.1039/D4NJ04595E","","x-ray","0.71073","MoKα","","0.0975","0.0712","","","0.1972","0.2136","","","","","","0.983","","","","has coordinates","299017","2025-04-05","03:44:46",""
"7063572","7.1121","0.0002","21.6576","0.0007","6.59","0.0002","90","","92.236","0.003","90","","1014.29","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 Ca O7 -","- C8 H10 Ca O7 -","- C32 H40 Ca4 O28 -","4","1","","Wang, Na; Ding, Li; Zou, Huiqi; Huan, Zhipeng; Lu, Jing; Liu, Houting; Wang, Suna; Li, Yunwu","Enhancing the proton conduction performance of Nafion composite membranes through doping simple and low-cost hydrated calcium terephthalate","New Journal of Chemistry","2025","49","3","1043","1052","10.1039/D4NJ05056H","","","1.54184","CuKα","","0.0427","0.0413","","","0.1114","0.1126","","","","","","1.057","","","","has coordinates","299049","2025-04-05","03:53:30",""
"7063573","14.5389","0.0009","14.5389","0.0009","25.5523","0.0016","90","","90","","120","","4677.6","0.5","293","2","293","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C39 H29 F N6 -","- C39 H28.9998 F1.0002 N6 -","- C234 H173.999 F6.0012 N36 -","6","0.166667","","Guo, Qiang; Huang, Zixuan; Liu, Jiaqi; Li, Xiaoyu; Zheng, Yanqiong; Gao, Xiuying; Liu, Hui; Li, Jie","Positional effects of fluorine substitution on room temperature phosphorescence in hexaphenylmelamine derivatives","New Journal of Chemistry","2025","49","3","674","678","10.1039/D4NJ04627G","","","1.54184","CuKα","","0.0489","0.0462","","","0.1297","0.1334","","","","","","1.099","","","","has coordinates,has disorder","299045","2025-04-05","03:52:44",""
"7063574","14.3814","0.0004","14.3814","0.0004","25.5525","0.0013","90","","90","","120","","4576.8","0.3","298","","298","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C39 H29 F N6 -","- C39 H28.9998 F1.0002 N6 -","- C234 H173.999 F6.0012 N36 -","6","0.166667","","Guo, Qiang; Huang, Zixuan; Liu, Jiaqi; Li, Xiaoyu; Zheng, Yanqiong; Gao, Xiuying; Liu, Hui; Li, Jie","Positional effects of fluorine substitution on room temperature phosphorescence in hexaphenylmelamine derivatives","New Journal of Chemistry","2025","49","3","674","678","10.1039/D4NJ04627G","","","0.71073","MoKα","","0.0673","0.0417","","","0.1","0.1136","","","","","","1.04","","","","has coordinates,has disorder","299045","2025-04-05","03:52:44",""
"7063575","14.3978","0.0004","14.3978","0.0004","25.623","0.0011","90","","90","","120","","4599.9","0.3","298","","298","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C39 H29 F N6 -","- C39 H28.9998 F1.0002 N6 -","- C234 H173.999 F6.0012 N36 -","6","0.166667","","Guo, Qiang; Huang, Zixuan; Liu, Jiaqi; Li, Xiaoyu; Zheng, Yanqiong; Gao, Xiuying; Liu, Hui; Li, Jie","Positional effects of fluorine substitution on room temperature phosphorescence in hexaphenylmelamine derivatives","New Journal of Chemistry","2025","49","3","674","678","10.1039/D4NJ04627G","","","0.71073","MoKα","","0.0688","0.0414","","","0.096","0.1081","","","","","","1.04","","","","has coordinates,has disorder","299045","2025-04-05","03:52:44",""
"7063576","11.3573","0.0005","15.0998","0.0006","17.5183","0.0008","99.383","0.004","106.34","0.004","94.093","0.004","2822.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H30 Cl N O8 -","- C29 H30 Cl N O8 -","- C116 H120 Cl4 N4 O32 -","4","2","","Xiang, Min; Liu, Gang-Yong; Liu, Hui-Mei; Zhou, Wen-Yi; Wang, Guang-Wei; Fei, Fei; Jia, Yun-Qing; Shen, Li-Wen","The [4+2] annulation of o-acylamino-aryl MBH carbonates with coumarins: facile access to tetrahydrochromeno[4,3-b]quinolin-6-ones","New Journal of Chemistry","2025","49","3","683","686","10.1039/D4NJ04654D","","x-ray","1.54184","CuKα","","0.0753","0.0568","","","0.155","0.1751","","","","","","1.025","","","","has coordinates,has disorder","299051","2025-04-05","03:53:59",""
"7063577","17.4346","0.0003","8.9182","0.0001","17.58","0.0002","90","","105.318","0.002","90","","2636.32","0.07","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 N8 Ru S2 -","- C28 H20 N8 Ru S2 -","- C112 H80 N32 Ru4 S8 -","4","1","","Khatkar, Sunita; Dubey, Santosh Kumar; Trivedi, Manoj; Vashisth, Chanchal; Devi, Neeru; Raghav, Neera; Sharma, Meenakshi; Rajamoni, Jagan","Investigation of enzyme inhibition, serum protein protective effects, and molecular docking studies of mixed-ligand ruthenium(ii) polypyridyl complexes","New Journal of Chemistry","2025","49","4","1440","1450","10.1039/D4NJ04773G","","","0.71073","MoKα","","0.0309","0.0261","","","0.0687","0.0711","","","","","","1.085","","","","has coordinates","299010","2025-04-05","03:43:36",""
"7063578","11.0211","0.0014","17.798","0.002","15.593","0.002","90","","93.331","0.004","90","","3053.5","0.6","150.02","","150.02","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 Cu Gd N5 O14 -","- C24 H30 Cu Gd N5 O14 -","- C96 H120 Cu4 Gd4 N20 O56 -","4","1","","Nandy, Rakhi; Jana, Narayan Ch.; Jagodič, Marko; Jagličić, Zvonko; Brandão, Paula; Saha, Amrita; Panja, Anangamohan","Impact of paramagnetic CuII and diamagnetic ZnII ions on single-molecule magnetism in heterodinuclear 3d–4f complexes displaying slow relaxation of magnetization","New Journal of Chemistry","2025","49","4","1196","1207","10.1039/D4NJ04958F","","","0.71073","MoKα","","0.0578","0.0402","","","0.0871","0.0962","","","","","","1.101","","","","has coordinates,has disorder","299006","2025-04-05","03:42:59",""
"7063579","10.993","0.0009","17.7673","0.0013","15.5779","0.0012","90","","92.795","0.003","90","","3039","0.4","150","2","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 Cu N5 O14 Tb -","- C24 H30 Cu N5 O14 Tb -","- C96 H120 Cu4 N20 O56 Tb4 -","4","1","","Nandy, Rakhi; Jana, Narayan Ch.; Jagodič, Marko; Jagličić, Zvonko; Brandão, Paula; Saha, Amrita; Panja, Anangamohan","Impact of paramagnetic CuII and diamagnetic ZnII ions on single-molecule magnetism in heterodinuclear 3d–4f complexes displaying slow relaxation of magnetization","New Journal of Chemistry","2025","49","4","1196","1207","10.1039/D4NJ04958F","","","0.71073","MoKα","","0.0643","0.0506","","","0.1127","0.1204","","","","","","1.13","","","","has coordinates,has disorder","299006","2025-04-05","03:42:59",""
"7063580","11.307","0.013","12.824","0.015","12.936","0.016","91.62","0.03","113.14","0.03","98.79","0.03","1696","4","150","2","150","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H40 Dy N3 O11 Zn -","- C31 H40 Dy N3 O11 Zn -","- C62 H80 Dy2 N6 O22 Zn2 -","2","1","","Nandy, Rakhi; Jana, Narayan Ch.; Jagodič, Marko; Jagličić, Zvonko; Brandão, Paula; Saha, Amrita; Panja, Anangamohan","Impact of paramagnetic CuII and diamagnetic ZnII ions on single-molecule magnetism in heterodinuclear 3d–4f complexes displaying slow relaxation of magnetization","New Journal of Chemistry","2025","49","4","1196","1207","10.1039/D4NJ04958F","","","0.71073","MoKα","","0.0346","0.029","","","0.0652","0.0698","","","","","","1.134","","","","has coordinates,has disorder","299006","2025-04-05","03:42:59",""
"7063581","21.0666","0.0006","6.85937","0.00016","24.399","0.0006","90","","107.741","0.003","90","","3358.07","0.16","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H19 Ca N3 O12 -","- C9 H19 Ca N3 O12 -","- C72 H152 Ca8 N24 O96 -","8","2","","Shukla, Vibhav; Aalam, Gulshitab; Ali, S. Wazed; Ahamd, Musheer; Haq, Nazrul; Siddiqui, Kafeel Ahmad","Ag@Ca-MOF composite: a dual-function material for luminescence detection and dose reliant photocatalytic breakdown of Bisphenol A","New Journal of Chemistry","2025","49","5","1648","1662","10.1039/D4NJ04856C","","x-ray","1.54184","CuKα","","0.04","0.0356","","","0.1079","0.1115","","","","","","1.0354","","","","has coordinates","299004","2025-04-05","03:42:32",""
"7063582","15.6198","0.0006","15.6415","0.0006","17.9376","0.0004","95.465","0.002","92.67","0.002","90.759","0.003","4357.1","0.3","126","18","126","18","","","","","","","","8","P -1","-P 1","2","","","","- C78 H92 Cl4 Co3 K2 N19 O13 S3 -","- C78 H92 Cl4 Co3 K2 N19 O13 S3 -","- C156 H184 Cl8 Co6 K4 N38 O26 S6 -","2","1","","Nazarov, Dmitry I.; Kuzmin, Alexey V.; Islyaikin, Mikhail K.; Ivanov, Evgenii N.; Shestakov, Alexander F.; Faraonov, Maxim A.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V.","Macrocycle- and metal-centered reduction of cobalt trithiadodecaazahexaphyrin (Hhp). Metal-to-ligand charge transfer in {(CoI2CoIIO)(Hhp˙4−)}2−","New Journal of Chemistry","2025","49","5","1631","1639","10.1039/D4NJ04896B","","x-ray","0.71073","MoKα","","0.0982","0.0588","","","0.1282","0.1545","","","","","","1.018","","","","has coordinates,has disorder","299003","2025-04-05","03:42:24",""
"7063583","13.213","0.001","20.8813","0.0016","18.7007","0.0014","90","","97.169","0.002","90","","5119.3","0.7","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- H100 La6 O116 V23 -","- H44 La6 O92 V23 -","- H88 La12 O184 V46 -","2","0.5","","Somasundaram, Janaki Devi; Kabzan, Henrich; Gyepes, Róbert; Krivosudský, Lukáš","Breaking boundaries: novel tridecavanadate polyoxometalates with a unique six-fold tetradentate coordination capacity for lanthanum(iii) and a two-fold bidentate decavanadate ligand in a single compound","New Journal of Chemistry","2025","49","6","2096","2105","10.1039/D4NJ03690E","","","0.71073","MoKα","","0.049","0.0363","","","0.0809","0.0849","","","","","","1.075","","","","has coordinates,has disorder","299019","2025-04-05","03:45:44",""
"7063584","10.4779","0.0002","11.2361","0.0002","11.6788","0.0003","114.085","0.002","99.949","0.002","99.561","0.0019","1192.81","0.05","160","0.1","160","0.1","","","","","","","","4","P -1","-P 1","2","","","","- H28 La2 O50 V10 -","- H28 La2 O50 V10 -","- H28 La2 O50 V10 -","1","0.5","","Somasundaram, Janaki Devi; Kabzan, Henrich; Gyepes, Róbert; Krivosudský, Lukáš","Breaking boundaries: novel tridecavanadate polyoxometalates with a unique six-fold tetradentate coordination capacity for lanthanum(iii) and a two-fold bidentate decavanadate ligand in a single compound","New Journal of Chemistry","2025","49","6","2096","2105","10.1039/D4NJ03690E","","x-ray","0.71073","MoKα","","0.053","0.0462","","","0.1232","0.1302","","","","","","1.029","","","","has coordinates","299019","2025-04-05","03:45:44",""
"7063585","18.7636","0.0006","24.2176","0.0008","23.0563","0.0008","90","","90","","90","","10477","0.6","120","2","120","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- H96 La12 O232 V46 -","- La12 O184 V46 -","- La24 O368 V92 -","2","0.25","","Somasundaram, Janaki Devi; Kabzan, Henrich; Gyepes, Róbert; Krivosudský, Lukáš","Breaking boundaries: novel tridecavanadate polyoxometalates with a unique six-fold tetradentate coordination capacity for lanthanum(iii) and a two-fold bidentate decavanadate ligand in a single compound","New Journal of Chemistry","2025","49","6","2096","2105","10.1039/D4NJ03690E","","","0.71073","MoKα","","0.0902","0.0691","","","0.1516","0.1632","","","","","","1.092","","","","has coordinates","299019","2025-04-05","03:45:44",""
"7063586","11.5944","0.0002","22.4932","0.0004","17.7244","0.0004","90","","109.056","0.002","90","","4369.13","0.16","122.97","0.1","122.97","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C47 H69 Al N4 Se -","- C47 H69 Al N4 Se -","- C188 H276 Al4 N16 Se4 -","4","1","","Li, Bin; Wang, Yuanyuan; Suthar, Sonam; Zhang, Manbo; Mondal, Kartik Chandra","Comparable syntheses of terminal aluminum selenide and telluride","New Journal of Chemistry","2025","49","4","1133","1137","10.1039/D4NJ04255G","","x-ray","1.54184","CuKα","","0.0382","0.0343","","","0.0898","0.0934","","","","","","1.027","","","","has coordinates,has disorder","299005","2025-04-05","03:42:42",""
"7063587","12.4487","0.0001","10.8335","0.0001","33.6911","0.0003","90","","100.232","0.001","90","","4471.42","0.07","123.01","0.13","123.01","0.13","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C47 H69 Al N4 Te -","- C47 H69 Al N4 Te -","- C188 H276 Al4 N16 Te4 -","4","1","","Li, Bin; Wang, Yuanyuan; Suthar, Sonam; Zhang, Manbo; Mondal, Kartik Chandra","Comparable syntheses of terminal aluminum selenide and telluride","New Journal of Chemistry","2025","49","4","1133","1137","10.1039/D4NJ04255G","","x-ray","1.39222","CuKβ","","0.0405","0.0352","","","0.0912","0.096","","","","","","1.062","","","","has coordinates","299005","2025-04-05","03:42:43",""
"7063588","13.2041","0.0003","8.8612","0.0003","14.7734","0.0003","90","","92.657","0.002","90","","1726.69","0.08","169.99","0.1","169.99","0.1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H30 Cl2 N6 O2 -","- C34 H30 Cl2 N6 O2 -","- C68 H60 Cl4 N12 O4 -","2","1","","Wang, Xi-Rui; Hu, Pan; Jing, Hui-Xian; Yu, Zhang-Biao; Yao, Zhen; Liu, Xiong-Wei; Zhang, Wen-Jing; Peng, Li-Jun; Liu, Xiong-Li","Development of chiral modular bifunctional C2-symmetric bipyridine/phenanthroline-bipyrroloimidazolone ligands and application in noncovalent interaction-assisted enantioselective catalysis","New Journal of Chemistry","2025","49","4","1138","1144","10.1039/D4NJ05018E","","x-ray","1.54184","CuKα","","0.0716","0.0696","","","0.1974","0.1991","","","","","","1.057","","","","has coordinates,has disorder","299007","2025-04-05","03:43:07",""
"7063589","17.0366","0.0011","19.0753","0.0012","26.8991","0.0018","100.308","0.002","97.885","0.002","91.231","0.002","8509.7","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H100 Cu2 N4 O6 -","- C84 H100 Cu2 N4 O6 -","- C336 H400 Cu8 N16 O24 -","4","2","","Jain, Isha; Rohini,; Jain, Ravish Kumar; Devi, Sudha; Malik, Payal","Neutral self-assembly of dinuclear copper(ii) metallacycles derived from Schiff base ligands: synthesis, characterization and catalysis","New Journal of Chemistry","2025","49","3","951","958","10.1039/D4NJ03994G","","","0.71073","MoKα","","0.0769","0.0527","","","0.1206","0.1342","","","","","","1.061","","","","has coordinates,has disorder","299046","2025-04-05","03:53:00",""
"7063590","17.163","0.0009","21.2607","0.0011","18.3542","0.001","90","","111.948","0.002","90","","6212","0.6","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C59.98 H84 Cu2 N4 O4 -","- C59.9798 H84 Cu2 N4 O4 -","- C239.919 H336 Cu8 N16 O16 -","4","0.5","","Jain, Isha; Rohini,; Jain, Ravish Kumar; Devi, Sudha; Malik, Payal","Neutral self-assembly of dinuclear copper(ii) metallacycles derived from Schiff base ligands: synthesis, characterization and catalysis","New Journal of Chemistry","2025","49","3","951","958","10.1039/D4NJ03994G","","x-ray","0.71073","MoKα","","0.0773","0.05","","","0.1254","0.1526","","","","","","1.082","","","","has coordinates","299046","2025-04-05","03:53:00",""
"7063591","17.9238","0.0005","5.1151","0.0001","21.7565","0.0006","90","","113.15","0.003","90","","1834.07","0.09","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","(1'R,5S)-4T","(1'R,5S)-N-(1'-(3''-methoxyphenyl)-ethyl)-2-thioxo-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin-5-yl-acetamide,","","- C16 H17 N O2 S5 -","- C16 H17 N O2 S5 -","- C64 H68 N4 O8 S20 -","4","2","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","","1.54184","CuKα","","0.0371","0.0357","","","0.0948","0.0965","","","","","","1.034","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063592","4.7188","0.0001","8.5874","0.0001","11.6175","0.0002","100.029","0.001","99.597","0.002","100.468","0.002","446.191","0.014","120","","120.15","","","","","","","","","5","P 1","P 1","1","1S5S5T","(1'S,5S)-N-(1'-(4''-methylphenyl)-ethyl)-2-thioxo-5,6-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiin-5-yl-acetamide","","- C16 H17 N O S5 -","- C16 H17 N O S5 -","- C16 H17 N O S5 -","1","1","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0371","0.0361","","","0.0996","0.1006","","","","","","1.074","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063593","9.75418","0.00015","12.01883","0.00017","23.5844","0.0003","90","","95.4955","0.0012","90","","2752.18","0.07","120","","120","","","","","","","","","6","P 1 21 1","P 2yb","4","","[1''-S,5S-8]2I3","","- C44 H42 I3 N2 O6 S16 -","- C44 H42 I3 N2 O6 S16 -","- C88 H84 I6 N4 O12 S32 -","2","1","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0855","0.0812","","","0.2071","0.2117","","","","","","1.028","","","","has coordinates,has disorder","299048","2025-04-05","03:53:23",""
"7063594","4.7222","0.0001","15.9527","0.0003","35.4246","0.0005","90","","90","","90","","2668.6","0.08","120","","120","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1''S,5S)-N-(1''-(2''-phenyl-1''-methoxycarbonyl)ethyl)-(BEDT-TTF)-acetamide","","- C22 H21 N O3 S8 -","- C22 H21 N O3 S8 -","- C88 H84 N4 O12 S32 -","4","1","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0479","0.0464","","","0.1247","0.1258","","","","","","1.082","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063595","18.7628","0.0004","4.8885","0.0001","21.3421","0.0005","90","","90.515","0.002","90","","1957.46","0.07","150","","150.01","0.1","","","","","","","","5","C 1 2 1","C 2y","5","1R5R7T","(1'R,5R)-N-(1-(1'-naphthyl)-ethyl)-2-thioxo-5,6-dihydro-[1,3]dithiolo[4,5-b]dithiin -5-yl-acetamide","","- C19 H17 N O S5 -","- C19 H17 N O S5 -","- C76 H68 N4 O4 S20 -","4","1","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","","0.71073","MoKα","","0.0406","0.0366","","","0.0814","0.0831","","","","","","1.076","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063596","4.7058","0.0002","23.3373","0.0009","8.5808","0.0004","90","","103.703","0.005","90","","915.53","0.07","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","1R5R6T","(1'R,5R) N-(1'-cyclohexylethyl)-2-(-2-thioxo-5,6-dihydro-[1,3]dithiolo[4,5-b]- [1,4]dithiin-5-yl)acetamide(eluted first)","","- C15 H21 N O S5 -","- C15 H21 N O S5 -","- C30 H42 N2 O2 S10 -","2","1","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0344","0.033","","","0.0856","0.0863","","","","","","1.07","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063597","5.1016","0.0001","10.4751","0.0001","18.4059","0.0003","88.54","0.001","83.431","0.001","89.743","0.001","976.83","0.03","120","","120","","","","","","","","","5","P 1","P 1","1","1S5R8T","(1'S,5R)-N-(1'-(2'-phenyl-1'-methoxycarbonyl)ethyl)- 2-thioxo-5,6-dihydro-[1,3]dithiolo[4,5-b]dithiin -5-yl-acetamide","","- C17 H17 N O3 S5 -","- C17 H17 N O3 S5 -","- C34 H34 N2 O6 S10 -","2","2","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0548","0.0534","","","0.1453","0.1471","","","","","","1.083","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063598","5.371","0.00008","8.61043","0.00011","38.2183","0.0005","90","","90.1243","0.0013","90","","1767.46","0.04","120","","120","","","","","","","","","6","P 1 21 1","P 2yb","4","(1R,5S)7.TCNQF2","(1''R,5S)-N-(1''-(Naphth-1'''-yl)ethyl)-(BEDT-TTF)-acetamide. TCNQ-F4","","- C36 H23 F2 N5 O S8 -","- C36 H23 F2 N5 O S8 -","- C72 H46 F4 N10 O2 S16 -","2","1","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0382","0.0345","","","0.086","0.0875","","","","","","1.073","","","","has coordinates,has disorder","299048","2025-04-05","03:53:23",""
"7063599","4.9962","0.0001","20.156","0.0002","23.8244","0.0002","90","","90","","90","","2399.2","0.06","120","0.1","120","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(1''R,5S)-N-(1''-(3'''-Chlorophenyl)ethyl)-(BEDT-TTF)-acetamide","","- C20 H18 Cl N O S8 -","- C20 H18 Cl N O S8 -","- C80 H72 Cl4 N4 O4 S32 -","4","1","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0246","0.0232","","","0.0554","0.056","","","","","","1.046","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063600","9.492","0.00009","12.29801","0.00013","21.6372","0.0002","90","","100.093","0.001","90","","2486.68","0.04","120.01","0.1","120.01","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","(1''R,5R)-N-(3-chlorophenyl)ethyl-(BEDT-TTF)-acetamide","","- C20 H18 Cl N O S8 -","- C20 H18 Cl N O S8 -","- C80 H72 Cl4 N4 O4 S32 -","4","2","","Short, Jonathan I.; Rushbridge, Elizabeth K.; Blundell, Toby J.; Ogar, Joseph O.; Yang, Songjie; Wallis, John D.; Martin, Lee","A series of enantiopure BEDT-TTF-acetamide derivatives with two stereogenic centres","New Journal of Chemistry","2025","49","3","910","920","10.1039/D4NJ03967J","","x-ray","1.54184","CuKα","","0.0484","0.0422","","","0.1071","0.1106","","","","","","1.081","","","","has coordinates","299048","2025-04-05","03:53:23",""
"7063601","16.6283","0.0016","20.91","0.002","14.0123","0.0014","90","","90","","90","","4872","0.8","296","2","296.15","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C20 H25 Mo12 N4 O41 P -","- C20 H22 Mo12 N4 O42 P -","- C80 H88 Mo48 N16 O168 P4 -","4","0.5","","Zhang, Shuyuan; Wang, Guangning; Liu, Jie; Wang, Qian; Zhang, Chunjing; Pang, Haijun; Li, Xiaoyi; Wang, Shiming; Chen, Tingting","Polyoxometalate-based coordination polymers enhance electrocatalytic hydrogen evolution in trimetallic sulfides","New Journal of Chemistry","2025","49","3","1091","1099","10.1039/D4NJ04347B","","","0.71073","MoKα","","0.0793","0.0554","","","0.1245","0.1389","","","","","","1.191","","","","has coordinates,has disorder","299047","2025-04-05","03:53:07",""
"7063602","21.0907","0.0004","9.4161","0.0002","11.6444","0.0002","90","","107.118","0.001","90","","2210.04","0.07","303","","303","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C24 H20 N4 O3 S -","- C24 H20 N4 O3 S -","- C96 H80 N16 O12 S4 -","4","1","","Wang, Kaimin; Dong, Jianning; Sun, Leilei; Tu, Yayi; Pu, Shouzhi; Fan, Congbin","A turn-on benzothiazole-based fluorescent probe for rapid cysteine detection in living cells","New Journal of Chemistry","2025","49","5","1718","1724","10.1039/D4NJ04650A","","","1.54178","CuKα","","0.0432","0.0404","","","0.1154","0.1194","","","","","","1.039","","","","has coordinates","299002","2025-04-05","03:42:04",""
"7063603","6.1862","0.0001","10.9811","0.0002","14.9277","0.0002","68.947","0.001","87.848","0.001","78.761","0.001","927.64","0.03","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H20 N2 O2 S -","- C23 H20 N2 O2 S -","- C46 H40 N4 O4 S2 -","2","1","","Wang, Kaimin; Dong, Jianning; Sun, Leilei; Tu, Yayi; Pu, Shouzhi; Fan, Congbin","A turn-on benzothiazole-based fluorescent probe for rapid cysteine detection in living cells","New Journal of Chemistry","2025","49","5","1718","1724","10.1039/D4NJ04650A","","","1.54178","CuKα","","0.0401","0.0385","","","0.1104","0.1124","","","","","","1.046","","","","has coordinates","299002","2025-04-05","03:42:04",""
"7063604","8.3439","0.0014","15.187","0.003","14.026","0.003","90","","98.286","0.004","90","","1758.8","0.6","276","2","276","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C8 H20 Cl2 Cu N5 O8 -","- C8 H20 Cl2 Cu N5 O8 -","- C32 H80 Cl8 Cu4 N20 O32 -","4","1","","Qi, Zhichao; Hu, Jinlin; Ruan, Zhijun; Chen, Yanmei; Qu, Yanbo; Liang, Xiangming; Lin, Junqi","Impact of coordinated nitrogen atoms on the electrocatalytic water oxidation properties of copper complexes with pentadentate ligands","New Journal of Chemistry","2025","49","4","1451","1458","10.1039/D4NJ03482A","","","0.71073","MoKα","","0.1179","0.0627","","","0.1369","0.1641","","","","","","1.035","","","","has coordinates,has disorder","299009","2025-04-05","03:43:27",""
"7063605","14.987","0.0003","9.9557","0.0003","29.6358","0.0007","90","","90","","90","","4421.84","0.19","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H23 Cl2 Cu N5 O8 -","- C16 H23 Cl2 Cu N5 O8 -","- C128 H184 Cl16 Cu8 N40 O64 -","8","1","","Qi, Zhichao; Hu, Jinlin; Ruan, Zhijun; Chen, Yanmei; Qu, Yanbo; Liang, Xiangming; Lin, Junqi","Impact of coordinated nitrogen atoms on the electrocatalytic water oxidation properties of copper complexes with pentadentate ligands","New Journal of Chemistry","2025","49","4","1451","1458","10.1039/D4NJ03482A","","","","","","0.104","","","","","","","","","","","","","","","has coordinates","299009","2025-04-05","03:43:27",""
"7063606","9.1931","0.0001","9.1931","0.0001","23.9143","0.0004","90","","90","","90","","2021.07","0.05","100.01","0.1","100.01","0.1","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C20 H28 Br2 Co N4 -","- C20 H28 Br2 Co N4 -","- C80 H112 Br8 Co4 N16 -","4","0.5","","Yu, Ning; Zhang, Bowen; Liang, Shuyan; Shi, Minghui; Han, Feng; Zhang, Congcong; Yang, Qingfeng; Miao, Chengxia","Cobalt complex with a tetradentate aminopyridine ligand: a single-component and efficient catalytic system for the cycloaddition reactions of CO2 and epoxides","New Journal of Chemistry","2025","49","4","1430","1439","10.1039/D4NJ04346D","","x-ray","1.54184","CuKα","","0.03","0.0286","","","0.0717","0.0723","","","","","","1.057","","","","has coordinates","299011","2025-04-05","03:43:43",""
"7063607","17.9919","0.0006","11.6497","0.0004","18.6138","0.0006","90","","98.072","0.002","90","","3862.8","0.2","296.15","","296.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H36 N2 O4 P2 Ru -","- C45 H36 N2 O4 P2 Ru -","- C180 H144 N8 O16 P8 Ru4 -","4","1","","Dhibar, Papu; Chandra, Anushri; Paul, Piyali; Bhattacharya, Samaresh","Ancillary ligand-induced variation in electronic spectral and catalytic properties of heteroleptic ONO-pincer complexes of ruthenium","New Journal of Chemistry","2025","49","7","2674","2684","10.1039/D4NJ04996A","","","0.71073","MoKα","","0.0364","0.0276","","","0.0688","0.078","","","","","","1.0986","","","","has coordinates,has disorder","299032","2025-04-05","03:50:06",""
"7063608","11.009","0.003","33.411","0.011","11.823","0.004","90","","90.06","","90","","4349","2","252","2","252.17","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H44 N2 O6 P2 Ru -","- C49 H42 N2 O5 P2 Ru -","- C196 H168 N8 O20 P8 Ru4 -","4","1","","Dhibar, Papu; Chandra, Anushri; Paul, Piyali; Bhattacharya, Samaresh","Ancillary ligand-induced variation in electronic spectral and catalytic properties of heteroleptic ONO-pincer complexes of ruthenium","New Journal of Chemistry","2025","49","7","2674","2684","10.1039/D4NJ04996A","","","0.71073","MoKα","","0.0888","0.0592","","","0.1402","0.1627","","","","","","1.026","","","","has coordinates","299032","2025-04-05","03:50:06",""
"7063609","11.4","0.3","15.1","0.4","19.2","0.5","90","","101.3","0.3","90","","3241","15","293","2","293.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H30 N3 O6 P Ru -","- C35 H30 N3 O6 P Ru -","- C140 H120 N12 O24 P4 Ru4 -","4","1","","Dhibar, Papu; Chandra, Anushri; Paul, Piyali; Bhattacharya, Samaresh","Ancillary ligand-induced variation in electronic spectral and catalytic properties of heteroleptic ONO-pincer complexes of ruthenium","New Journal of Chemistry","2025","49","7","2674","2684","10.1039/D4NJ04996A","","","0.71073","MoKα","","0.0993","0.0703","","","0.1531","0.1618","","","","","","1.164","","","","has coordinates","299032","2025-04-05","03:50:06",""
"7063610","11.011","0.009","16.07","0.02","37.32","0.04","90","","90","","90","","6604","12","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C75 H55.8 Cl2 N6 O8.9 P2 Ru2 -","- C75 H54 Cl2 N6 O8 P2 Ru2 -","- C300 H216 Cl8 N24 O32 P8 Ru8 -","4","1","","Dhibar, Papu; Chandra, Anushri; Paul, Piyali; Bhattacharya, Samaresh","Ancillary ligand-induced variation in electronic spectral and catalytic properties of heteroleptic ONO-pincer complexes of ruthenium","New Journal of Chemistry","2025","49","7","2674","2684","10.1039/D4NJ04996A","","","0.71073","MoKα","","0.1796","0.0847","","","0.1819","0.2243","","","","","","1.014","","","","has coordinates","299032","2025-04-05","03:50:06",""
"7063611","7.0722","0.0001","10.1817","0.0002","10.6172","0.0002","95.843","0.002","107.336","0.002","106.89","0.002","683.29","0.03","293","2","293","","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 La O8 -","- C11 H12 La O8 -","- C22 H24 La2 O16 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","x-ray","0.71073","MoKα","","0.0178","0.0173","","","0.043","0.0432","","","","","","1.0337","","","","has coordinates","299018","2025-04-05","03:45:25",""
"7063612","7.0312","0.0003","10.1657","0.0003","10.6142","0.0004","95.19","0.003","107.78","0.003","107.272","0.003","676.03","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 Ce O8 -","- C11 H12 Ce O8 -","- C22 H24 Ce2 O16 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","x-ray","0.71073","MoKα","","0.0233","0.0227","","","0.0578","0.0582","","","","","","1.057","","","","has coordinates","299018","2025-04-05","03:45:25",""
"7063613","6.8323","0.0002","10.0734","0.0003","10.5238","0.0003","93.276","0.002","108.127","0.003","108.882","0.003","641.19","0.04","293","2","293","2","","","","","","","syntheiszed","4","P -1","-P 1","2","","","","- C11 H12 O8 Tb -","- C11 H12 O8 Tb -","- C22 H24 O16 Tb2 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","x-ray","0.71073","MoKα","","0.0417","0.0401","","","0.1007","0.1019","","","","","","1.066","","","","has coordinates,has disorder","299018","2025-04-05","03:45:25",""
"7063614","6.786","0.0002","10.0313","0.0003","10.499","0.0003","92.98","0.002","108.078","0.002","108.891","0.003","633.51","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 Ho O8 -","- C11 H12 Ho O8 -","- C22 H24 Ho2 O16 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","x-ray","0.71073","MoKα","","0.0356","0.0346","","","0.0897","0.0907","","","","","","1.028","","","","has coordinates","299018","2025-04-05","03:45:25",""
"7063615","6.8597","0.0002","10.094","0.0004","10.5435","0.0003","93.315","0.003","108.272","0.003","108.886","0.003","645.53","0.04","293","2","293","2","","","","","","","synthesized","4","P -1","-P 1","2","","","","- C11 H12 Gd O8 -","- C11 H12 Gd O8 -","- C22 H24 Gd2 O16 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","x-ray","0.71073","MoKα","","0.0501","0.0487","","","0.1287","0.13","","","","","","1.077","","","","has coordinates,has disorder","299018","2025-04-05","03:45:25",""
"7063616","6.9949","0.0001","10.1549","0.0002","10.6105","0.0002","94.705","0.002","107.924","0.002","107.681","0.002","670.31","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 O8 Pr -","- C11 H12 O8 Pr -","- C22 H24 O16 Pr2 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","x-ray","0.71073","MoKα","","0.0244","0.0236","","","0.0595","0.06","","","","","","1.049","","","","has coordinates","299018","2025-04-05","03:45:25",""
"7063617","6.8112","0.0002","10.0395","0.0003","10.5052","0.0003","93.118","0.002","108.138","0.002","108.871","0.003","636.29","0.04","293","2","293","2","","","","","","","synthesized","4","P -1","-P 1","2","","","","- C11 H12 Dy O8 -","- C11 H12 Dy O8 -","- C22 H24 Dy2 O16 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","x-ray","0.71073","MoKα","","0.0505","0.0493","","","0.1339","0.1355","","","","","","1.0301","","","","has coordinates,has disorder","299018","2025-04-05","03:45:25",""
"7063618","6.9193","0.0003","10.1654","0.0003","10.5906","0.0004","93.467","0.003","108.457","0.003","108.869","0.003","657.53","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 O8 Sm -","- C11 H12 O8 Sm -","- C22 H24 O16 Sm2 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","","0.71073","MoKα","","0.0822","0.0818","","","0.1907","0.1918","","","","","","1.0291","","","","has coordinates","299018","2025-04-05","03:45:25",""
"7063619","6.8831","0.0001","10.1047","0.0001","10.5688","0.0001","93.297","0.001","108.297","0.001","108.671","0.001","650.901","0.015","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 Eu O8 -","- C11 H12 Eu O8 -","- C22 H24 Eu2 O16 -","2","1","","Sen, Charanjeet; Singh, Rohit; Devi, Swaita; Niharika,; Singhaal, Richa; Sahoo, Subash Chandra; Sheikh, Haq Nawaz","Design and synthesis of 2D coordination polymers from isophthalic and adipic acids: exploring Tb-based luminescent sensors for Cr3+, Fe3+ and p-NA","New Journal of Chemistry","2025","49","6","2350","2364","10.1039/D4NJ05061D","","","0.71073","MoKα","","0.0212","0.0206","","","0.0509","0.0514","","","","","","1.0588","","","","has coordinates","299018","2025-04-05","03:45:25",""
"7063620","20.094","0.0007","20.094","0.0007","36.2908","0.0012","90","","90","","120","","12690","0.8","169.15","","169.15","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C66 H120 N9 Nd O18 -","- C66 H120 N9 Nd O18 -","- C396 H720 N54 Nd6 O108 -","6","0.166667","","Yin, Jingjing; Peng, Xiujing; Zhang, Miaomiao; Liu, Yifan; Wang, Haoran; Zheng, Jixi; Sun, Guoxin; Cui, Yu","Study on the extraction behavior of Nd(iii) in nitric acid medium by novel asymmetric alkyl diglycolamide extractants with different structures","New Journal of Chemistry","2025","49","7","2973","2979","10.1039/D4NJ04748F","","","1.54184","CuKα","","0.1174","0.0798","","","0.2421","0.2923","","","","","","1.107","","","","has coordinates,has disorder","299033","2025-04-05","03:50:18",""
"7063621","19.1538","0.0016","11.408","0.0009","7.429","0.0006","90","","101.402","0.003","90","","1591.2","0.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H8 F6 N2 O4 Zn -","- C16 H8 F6 N2 O4 Zn -","- C64 H32 F24 N8 O16 Zn4 -","4","0.5","","Uvarova, Marina A.; Dolgushin, Fedor M.; Shender, Victoriya O.; Metlin, Mikhail T.; Metlina, Daria A.; Taydakov, Ilya V.; Bekker, Olga B.; Lutsenko, Irina A.; Eremenko, Igor L.","A synthetic approach to heteroleptic Zn2Ln2 complexes featuring photoluminescence, antibacterial and anticancer properties","New Journal of Chemistry","2025","49","8","3236","3247","10.1039/D4NJ05283H","","","0.71073","MoKα","","0.059","0.0418","","","0.0949","0.1016","","","","","","1.062","","","","has coordinates","298999","2025-04-05","03:41:23",""
"7063622","11.593","0.004","12.012","0.005","16.849","0.006","88.419","0.006","70.048","0.006","80.18","0.006","2172","1.4","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C68 H99 Eu2 F6 N5 O26 S2 Zn2 -","- C68 H99 Eu2 F6 N5 O26 S2 Zn2 -","- C68 H99 Eu2 F6 N5 O26 S2 Zn2 -","1","0.5","","Uvarova, Marina A.; Dolgushin, Fedor M.; Shender, Victoriya O.; Metlin, Mikhail T.; Metlina, Daria A.; Taydakov, Ilya V.; Bekker, Olga B.; Lutsenko, Irina A.; Eremenko, Igor L.","A synthetic approach to heteroleptic Zn2Ln2 complexes featuring photoluminescence, antibacterial and anticancer properties","New Journal of Chemistry","2025","49","8","3236","3247","10.1039/D4NJ05283H","","","0.71073","MoKα","","0.043","0.0321","","","0.0774","0.084","","","","","","1.019","","","","has coordinates,has disorder","298999","2025-04-05","03:41:23",""
"7063623","9.3947","0.0003","12.3486","0.0003","14.4715","0.0004","94.127","0.001","103.744","0.001","94.635","0.001","1618.23","0.08","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H36 N4 O4 -","- C37 H36 N4 O4 -","- C74 H72 N8 O8 -","2","1","","Khatun, Mohafuza; Mandal, Jayanta; Ganguly, Rajdeep; Barui, Ananya; Banerjee, Snehasis; Saha, Amrita","Derivative of clove oil used as a chemosensor for the colorimetric and fluorometric detection of Al3+: crystal structure description and live cell imaging","New Journal of Chemistry","2025","49","9","3724","3735","10.1039/D4NJ04724A","","","0.71073","MoKα","","0.0876","0.0726","","","0.2041","0.2183","","","","","","1.042","","","","has coordinates","299035","2025-04-05","03:50:35",""
"7063624","12.3361","0.0003","13.4925","0.0004","13.6587","0.0005","111.746","0.003","105.302","0.003","108.565","0.002","1803.7","0.13","120.01","0.1","120.01","","","","","","","","","7","P -1","-P 1","2","","","","- C36 H84 Ag8 Cl2 O12 P6 S12 -","- C36 H84 Ag8 Cl2 O12 P6 S12 -","- C36 H84 Ag8 Cl2 O12 P6 S12 -","1","0.5","","Yousefshahi, Mohammad Reza; Neshat, Abdollah; Tahmasebi, Elham; Eigner, Vaclav; Dusek, Michal; Osanlou, Farzaneh","Generation of high nuclearity silver(i) and gold(i) species using simple N-heterocyclic carbene complexes","New Journal of Chemistry","2025","49","8","3328","3333","10.1039/D4NJ05260A","","x-ray","0.71073","MoKα","","0.0405","0.0319","","","0.0885","0.0927","","","","1.5417","1.5417","1.4786","","","","has coordinates,has disorder","298998","2025-04-05","03:41:14",""
"7063625","16.3739","0.0004","16.3739","0.0004","16.3739","0.0004","90","","90","","90","","4389.92","0.19","95","0.2","95","","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C96 H192 Ag16 Cl11.83 F25 P4.17 S48 -","- C96 H192 Ag16 Cl11.832 F25.008 P4.168 S48 -","- C96 H192 Ag16 Cl11.832 F25.008 P4.168 S48 -","1","0.0416667","","Yousefshahi, Mohammad Reza; Neshat, Abdollah; Tahmasebi, Elham; Eigner, Vaclav; Dusek, Michal; Osanlou, Farzaneh","Generation of high nuclearity silver(i) and gold(i) species using simple N-heterocyclic carbene complexes","New Journal of Chemistry","2025","49","8","3328","3333","10.1039/D4NJ05260A","","x-ray","1.54184","CuKα","","0.0231","0.0223","","","0.0713","0.0722","","","","1.4579","1.4579","1.4574","","","","has coordinates,has disorder","298998","2025-04-05","03:41:14",""
"7063626","12.6419","0.0002","19.2428","0.0005","29.9587","0.0006","82.759","0.0019","88.688","0.0015","82.328","0.0018","7164.9","0.3","134.97","0.13","135","","","","","","","","","8","P -1","-P 1","2","","","","- C252 H372 Au10 F24 N16 O12 P10 S12 -","- C252 H372 Au10 F24 N16 O12 P10 S12 -","- C252 H372 Au10 F24 N16 O12 P10 S12 -","1","0.5","","Yousefshahi, Mohammad Reza; Neshat, Abdollah; Tahmasebi, Elham; Eigner, Vaclav; Dusek, Michal; Osanlou, Farzaneh","Generation of high nuclearity silver(i) and gold(i) species using simple N-heterocyclic carbene complexes","New Journal of Chemistry","2025","49","8","3328","3333","10.1039/D4NJ05260A","","x-ray","1.54184","CuKα","","0.0914","0.0418","","","0.0803","0.1035","","","","1.0697","1.0697","1.044","","","","has coordinates","298998","2025-04-05","03:41:14",""
"7063627","19.7798","0.0008","6.9614","0.0003","20.1643","0.0008","90","","90","","90","","2776.5","0.2","300","","300","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C24 H24 B2 F4 N4 O9 -","- C24 H24 B2 F4 N4 O9 -","- C96 H96 B8 F16 N16 O36 -","4","1","","Shenoy, Ankitha M.; Fernandes, Premie P.; Lakshmi, Vellanki","Functionalized 1,3-dipyrrolyl-1,3-diketone difluoroboron complexes","New Journal of Chemistry","2025","49","10","3987","3996","10.1039/D4NJ04611K","","","0.71073","MoKα","","0.1171","0.0442","","","0.0983","0.1391","","","","","","1.072","","","","has coordinates,has disorder","298982","2025-04-05","03:35:41",""
"7063628","7.2469","0.0003","7.8596","0.0004","11.2611","0.0006","92.953","0.003","90.58","0.002","108.407","0.002","607.55","0.05","300","2","300","","","","","","","","","6","P -1","-P 1","2","","","","- C11 H8 B F2 N3 O4 -","- C11 H8 B F2 N3 O4 -","- C22 H16 B2 F4 N6 O8 -","2","1","","Shenoy, Ankitha M.; Fernandes, Premie P.; Lakshmi, Vellanki","Functionalized 1,3-dipyrrolyl-1,3-diketone difluoroboron complexes","New Journal of Chemistry","2025","49","10","3987","3996","10.1039/D4NJ04611K","","","0.71073","MoKα","","0.1343","0.0551","","","0.1258","0.1629","","","","","","1.017","","","","has coordinates","298982","2025-04-05","03:35:42",""
"7063629","6.2914","0.0017","28.492","0.007","7.258","0.002","90","","114.975","0.016","90","","1179.4","0.6","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C10 H2 F5 N7 O -","- C10 H2 F5 N7 O -","- C40 H8 F20 N28 O4 -","4","1","","Efanov, Daniil E.; Tolstikov, Svyatoslav E.; Romanenko, Galina V.; Letyagin, Gleb A.; Smirnova, Kristina A.; Chernavin, Platon A.; Veber, Sergey L.; Romashev, Nikolay F.; Osik, Natalya A.; Bogomyakov, Artem S.","Stable anion radicals based on a triazole-fused furazano[3,4-b]pyrazine scaffold","New Journal of Chemistry","2025","49","10","3869","3876","10.1039/D4NJ05188B","","","0.71073","MoKα","","0.131","0.037","","","0.0383","0.0514","","","","","","0.738","","","","has coordinates","298990","2025-04-05","03:39:15",""
"7063630","8.5924","0.0004","17.869","0.0007","18.4283","0.0008","90","","92.076","0.003","90","","2827.6","0.2","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H41 N8 O -","- C26 H41 N8 O -","- C104 H164 N32 O4 -","4","1","","Efanov, Daniil E.; Tolstikov, Svyatoslav E.; Romanenko, Galina V.; Letyagin, Gleb A.; Smirnova, Kristina A.; Chernavin, Platon A.; Veber, Sergey L.; Romashev, Nikolay F.; Osik, Natalya A.; Bogomyakov, Artem S.","Stable anion radicals based on a triazole-fused furazano[3,4-b]pyrazine scaffold","New Journal of Chemistry","2025","49","10","3869","3876","10.1039/D4NJ05188B","","","0.71073","MoKα","","0.1514","0.0548","","","0.1654","0.2326","","","","","","0.948","","","","has coordinates,has disorder","298990","2025-04-05","03:39:17",""
"7063631","10.4306","0.0006","20.1188","0.0012","14.4748","0.0009","90","","99.556","0.004","90","","2995.4","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8.67 H12 F1.67 N2.67 O0.33 -","- C8.66667 H12 F1.66667 N2.66667 O0.333333 -","- C104 H144 F20 N32 O4 -","12","3","","Efanov, Daniil E.; Tolstikov, Svyatoslav E.; Romanenko, Galina V.; Letyagin, Gleb A.; Smirnova, Kristina A.; Chernavin, Platon A.; Veber, Sergey L.; Romashev, Nikolay F.; Osik, Natalya A.; Bogomyakov, Artem S.","Stable anion radicals based on a triazole-fused furazano[3,4-b]pyrazine scaffold","New Journal of Chemistry","2025","49","10","3869","3876","10.1039/D4NJ05188B","","","0.71073","MoKα","","0.2075","0.0773","","","0.2248","0.3094","","","","","","0.999","","","","has coordinates,has disorder","298990","2025-04-05","03:39:17",""
"7063632","11.899","0.004","12.929","0.004","13.569","0.005","63.285","0.01","70.822","0.011","70.907","0.01","1720.9","1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H41 Br N4 O3 -","- C38 H41 Br N4 O3 -","- C76 H82 Br2 N8 O6 -","2","1","","Das, Susmita; Das, Manik; Biswas, Raju; Das, Uttam Kumar; Laha, Soumik; Samanta, Bidhan Chandra; Choudhuri, Indranil; Bhattacharya, Nandan; Maity, Tithi","Fabrication of a novel AIE active chemosensor for selective detection of Pd(ii) and picric acid: extended detection in the HeLa cancer cell line","New Journal of Chemistry","2025","49","10","4021","4034","10.1039/D4NJ04935G","","","0.71073","MoKα","","0.1475","0.0922","","","0.2307","0.2625","","","","","","1.084","","","","has coordinates","298985","2025-04-05","03:36:11",""
"7063633","7.7139","0.0005","15.7197","0.0009","26.6782","0.0016","90","","90","","90","","3235","0.3","110","","110","","","","","","","","","3","I b c a","-I 2b 2c","73","","","","- C22 H18 S -","- C22 H18 S -","- C176 H144 S8 -","8","0.5","","K., Gaatha; Kumar, Sunil; Sharma, Ashutosh; Bhuvanesh, Nattamai; Roy, Partha; Joshi, Hemant","A trans-palladium dichloride complex with a bulky organosulfur ligand: syntheses, structure, and applications in catalytic alkylation of acetophenone and secondary alcohols using alcohols","New Journal of Chemistry","2025","49","10","3956","3968","10.1039/D4NJ04901B","","","0.71073","MoKα","","0.0608","0.0445","","","0.1107","0.1202","","","","","","1.03","","","","has coordinates","298983","2025-04-05","03:35:55",""
"7063634","21.9194","0.0007","6.1161","0.0002","26.6465","0.0009","90","","90.928","0.002","90","","3571.8","0.2","110","","110","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H36 Cl2 Pd S2 -","- C44 H36 Cl2 Pd S2 -","- C176 H144 Cl8 Pd4 S8 -","4","0.5","","K., Gaatha; Kumar, Sunil; Sharma, Ashutosh; Bhuvanesh, Nattamai; Roy, Partha; Joshi, Hemant","A trans-palladium dichloride complex with a bulky organosulfur ligand: syntheses, structure, and applications in catalytic alkylation of acetophenone and secondary alcohols using alcohols","New Journal of Chemistry","2025","49","10","3956","3968","10.1039/D4NJ04901B","","","1.54178","CuKα","","0.0251","0.0247","","","0.0672","0.0676","","","","","","1.065","","","","has coordinates","298983","2025-04-05","03:35:55",""
"7063635","9.876","0.0004","18.7017","0.0006","24.035","0.0007","90","","90","","90","","4439.2","0.3","293","2","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","mi401","","- C24 H25 Cu N3 O6 -","- C24 H25 Cu N3 O6 -","- C192 H200 Cu8 N24 O48 -","8","1","","Mantoo, Imtiyaz Ahmad; Prasad, Chandra Prakash; Yousuf, Imtiyaz","Evaluation of biomolecular interactions and in vitro cytotoxic activity of mononuclear and polymeric copper(ii)-based complexes against triple-negative breast cancer cells","New Journal of Chemistry","2025","49","8","3351","3364","10.1039/D4NJ04052J","","x-ray","0.71073","MoKα","","0.0546","0.0362","","","0.0847","0.0933","","","","","","1.015","","","","has coordinates","299001","2025-04-05","03:41:55",""
"7063636","9.7609","0.0002","11.0239","0.0002","11.6286","0.0002","85.11","0.001","71.355","0.001","87.375","0.001","1181.06","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H25 Cu N3 O7 -","- C25 H25 Cu N3 O7 -","- C50 H50 Cu2 N6 O14 -","2","1","","Mantoo, Imtiyaz Ahmad; Prasad, Chandra Prakash; Yousuf, Imtiyaz","Evaluation of biomolecular interactions and in vitro cytotoxic activity of mononuclear and polymeric copper(ii)-based complexes against triple-negative breast cancer cells","New Journal of Chemistry","2025","49","8","3351","3364","10.1039/D4NJ04052J","","x-ray","0.71073","MoKα","","0.0408","0.0344","","","0.0914","0.0945","","","","","","1.067","","","","has coordinates","299001","2025-04-05","03:41:56",""
"7063637","14.504","0.0007","17.0753","0.0009","19.3494","0.0013","94.638","0.005","99.617","0.005","97.997","0.004","4652.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H44 N4 O4 -","- C60 H44 N4 O4 -","- C240 H176 N16 O16 -","4","2","","Singh, Gurjaspreet; Markan, Pallavi; Kaur, Navneet; Gupta, Sofia; Tamana,; Malik, Pooja; Sahoo, Subash Chandra; Gill, Baljinder Singh; Baliyan, Deepanjali","Absorption and anti-bacterial studies of an acetylene-functionalized Schiff base for detection of Sn(ii) and inhibition of E. coli","New Journal of Chemistry","2025","49","10","4256","4267","10.1039/D4NJ04322G","","x-ray","0.71073","MoKα","","0.2835","0.0781","","","0.2932","0.4904","","","","","","0.873","","","","has coordinates","298988","2025-04-05","03:38:54",""
"7063638","10.2771","0.0004","10.795","0.0003","13.1138","0.0004","103.771","0.003","109.047","0.003","102.951","0.003","1261.45","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H23.73 Cl2 N4 O2.87 Zn -","- C26 H23.728 Cl2 N4 O2.864 Zn -","- C52 H47.456 Cl4 N8 O5.728 Zn2 -","2","1","","Hasić, Rušid; Serezlić, Majda Kolenović; Caković, Angelina; Bogojeski, Jovana; Nikodijević, Danijela; Milutinović, Milena; Stanojević, Aleksandra; Čavić, Milena; Egorov, Andrei V.; Komolkin, Andrei V.; Kornyakov, Ilya V.; Scheurer, Andreas; Puchta, Ralph; Soldatović, Tanja V.","New bis-pyrazolate zinc(ii) complexes as potential anticancer drugs: from structure to anticancer activity","New Journal of Chemistry","2025","49","9","3617","3632","10.1039/D5NJ00043B","","x-ray","1.54184","CuKα","","0.0489","0.0398","","","0.1049","0.1117","","","","","","1.106","","","","has coordinates,has disorder","299034","2025-04-05","03:50:26",""
"7063639","10.0761","0.0004","11.1556","0.0005","11.5131","0.0004","67.436","0.003","84.168","0.003","75.427","0.004","1156.6","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H29.92 Cl2 N5 O2.46 Zn -","- C19 H29.918 Cl2 N5 O2.459 Zn -","- C38 H59.836 Cl4 N10 O4.918 Zn2 -","2","1","","Hasić, Rušid; Serezlić, Majda Kolenović; Caković, Angelina; Bogojeski, Jovana; Nikodijević, Danijela; Milutinović, Milena; Stanojević, Aleksandra; Čavić, Milena; Egorov, Andrei V.; Komolkin, Andrei V.; Kornyakov, Ilya V.; Scheurer, Andreas; Puchta, Ralph; Soldatović, Tanja V.","New bis-pyrazolate zinc(ii) complexes as potential anticancer drugs: from structure to anticancer activity","New Journal of Chemistry","2025","49","9","3617","3632","10.1039/D5NJ00043B","","x-ray","1.54184","CuKα","","0.037","0.0317","","","0.0767","0.0792","","","","","","1.068","","","","has coordinates,has disorder","299034","2025-04-05","03:50:26",""
"7063640","8.759","0.0005","20.1534","0.0014","12.8678","0.0006","90","","108.467","0.006","90","","2154.5","0.2","100.01","0.1","100.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H27 Ga N5 O9.5 -","- C18 H24 Ga N5 O8 -","- C72 H96 Ga4 N20 O32 -","4","1","","O’Callaghan, Charley; Greenacre, Victoria K.; Reid, Gillian","Di- and tri-valent metal complexes with tris-amide-functionalised 1,4,7-triazacyclononane chelators","New Journal of Chemistry","2025","49","10","4061","4071","10.1039/D4NJ05327C","","x-ray","0.71073","MoKα","","0.0856","0.0564","","","0.1462","0.1595","","","","","","1.0413","","","","has coordinates","298987","2025-04-05","03:38:36",""
"7063641","10.8001","0.0002","17.3514","0.0003","19.5643","0.0003","90","","96.185","0.002","90","","3644.95","0.11","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H43 Co N8 O11 -","- C32 H43 Co N8 O11 -","- C128 H172 Co4 N32 O44 -","4","1","","O’Callaghan, Charley; Greenacre, Victoria K.; Reid, Gillian","Di- and tri-valent metal complexes with tris-amide-functionalised 1,4,7-triazacyclononane chelators","New Journal of Chemistry","2025","49","10","4061","4071","10.1039/D4NJ05327C","","","0.71073","MoKα","","0.0642","0.0567","","","0.1634","0.1682","","","","","","1.071","","","","has coordinates,has disorder","298987","2025-04-05","03:38:37",""
"7063642","16.2195","0.0005","19.5074","0.0008","11.0872","0.0003","90","","95.999","0.003","90","","3488.8","0.2","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H42 N8 Ni O10.5 -","- C30 H36 N8 Ni O9 -","- C120 H144 N32 Ni4 O36 -","4","1","","O’Callaghan, Charley; Greenacre, Victoria K.; Reid, Gillian","Di- and tri-valent metal complexes with tris-amide-functionalised 1,4,7-triazacyclononane chelators","New Journal of Chemistry","2025","49","10","4061","4071","10.1039/D4NJ05327C","","","0.71073","MoKα","","0.0879","0.0549","","","0.1302","0.1439","","","","","","1.02","","","","has coordinates,has disorder","298987","2025-04-05","03:38:38",""
"7063643","17.7391","0.0007","11.523","0.0004","18.2239","0.0007","90","","119.134","0.005","90","","3253.8","0.3","99.9","0.2","100.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H48.498 N8 Ni O9.249 -","- C24 H48.498 N8 Ni O9.249 -","- C96 H193.992 N32 Ni4 O36.996 -","4","1","","O’Callaghan, Charley; Greenacre, Victoria K.; Reid, Gillian","Di- and tri-valent metal complexes with tris-amide-functionalised 1,4,7-triazacyclononane chelators","New Journal of Chemistry","2025","49","10","4061","4071","10.1039/D4NJ05327C","","","0.71073","MoKα","","0.0827","0.0556","","","0.1245","0.1368","","","","","","1.0326","","","","has coordinates,has disorder","298987","2025-04-05","03:38:38",""
"7063644","16.4229","0.0003","10.9307","0.0002","17.9733","0.0003","90","","103.813","0.002","90","","3133.15","0.1","100","0.1","100.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Cu(1,4,7-tris-isopropylacrylamide-1,4,7-triazacyclononane)][NO3]2","","- C24 H48 Cu N8 O9 -","- C24 H48 Cu N8 O9 -","- C96 H192 Cu4 N32 O36 -","4","1","","O’Callaghan, Charley; Greenacre, Victoria K.; Reid, Gillian","Di- and tri-valent metal complexes with tris-amide-functionalised 1,4,7-triazacyclononane chelators","New Journal of Chemistry","2025","49","10","4061","4071","10.1039/D4NJ05327C","","","0.71073","MoKα","","0.0362","0.0244","","","0.0512","0.0559","","","","","","1.063","","","","has coordinates","298987","2025-04-05","03:38:38",""
"7063645","17.6146","0.0003","17.63","0.0003","20.0301","0.0003","85.355","0.001","80.554","0.001","60.327","0.002","5331.28","0.19","100","0.1","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C96 H124.5 Cu3 N24 O29.25 -","- C94 H118 Cu3 N24 O28 -","- C188 H236 Cu6 N48 O56 -","2","1","","O’Callaghan, Charley; Greenacre, Victoria K.; Reid, Gillian","Di- and tri-valent metal complexes with tris-amide-functionalised 1,4,7-triazacyclononane chelators","New Journal of Chemistry","2025","49","10","4061","4071","10.1039/D4NJ05327C","","","0.71073","MoKα","","0.0955","0.0578","","","0.1362","0.1537","","","","","","1.0385","","","","has coordinates,has disorder","298987","2025-04-05","03:38:38",""
"7063646","11.7259","0.0006","22.3057","0.0012","23.4333","0.0013","94.292","0.005","96.418","0.005","98.299","0.005","6001","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C144 H108 Cu9.98 N24 O166 P4 W44.02 -","- C144 H108 Cu9.984 N24 O166 P4 W44.016 -","- C144 H108 Cu9.984 N24 O166 P4 W44.016 -","1","0.5","","Zhang, Yixuan; Zhu, Maochun; Liu, Yifei; Bai, Xue; Zhang, Ange; Yang, Yanli; Li, Bin; Liu, Shuxia","Synthesis and sulfide oxidation catalytic activity of a copper monosubstituted Keggin-type polyoxometalate-based supramolecular compound","New Journal of Chemistry","2025","49","10","4191","4197","10.1039/D4NJ05286B","","x-ray","0.71073","MoKα","","0.1075","0.0551","","","0.0794","0.1011","","","","","","0.9","","","","has coordinates,has disorder","298989","2025-04-05","03:39:05",""
"7063647","11.5686","0.0002","9.5602","0.0002","29.2255","0.0005","90","","96.48","0.001","90","","3211.64","0.1","180","","180","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16.5 H11.5 Cl2.5 N2 O3 -","- C16 H11 Cl N2 O3 -","- C128 H88 Cl8 N16 O24 -","8","2","","Xu, Jianxiong; Gong, Xue; Wu, Zhirui; Huang, Weimin; Li, Jizhen","Direct access to acylated quinoxalin-2(1H)-one N-oxides enabled by the Cu(i)/TBHP system","New Journal of Chemistry","2025","49","10","3843","3848","10.1039/D4NJ04823G","","","1.54178","CuKα","","0.0748","0.0546","","","0.1401","0.1527","","","","","","1.036","","","","has coordinates","298992","2025-04-05","03:39:52",""
"7063648","3.7946","0.0001","23.1642","0.0004","22.7365","0.0004","90","","94.721","0.001","90","","1991.73","0.07","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H36 N10 O19 -","- C42 H36 N10 O19 -","- C84 H72 N20 O38 -","2","0.5","","Maheswari, Ganesan; Elancheziyan, Mari; Harathi, Jonnagaddala; Raji, Atchudan; Ashamary, Francis; Mahaan, Ramalingam; Kalambate, Pramod K.; Lee, Hon Man; Rosenkranz, Andreas; Manoj, Devaraj","Self-assembled single-crystalline hydrogen-bonded frameworks: a potential metal-free molecule towards proton conductivity and electrochemical detection of organic and inorganic pollutants","New Journal of Chemistry","2025","49","10","4205","4217","10.1039/D4NJ05382F","","x-ray","1.54184","CuKα","","0.044","0.0386","","","0.1036","0.1072","","","","","","1.05","","","","has coordinates,has disorder","298984","2025-04-05","03:36:03",""
"7063649","10.9365","0.0005","7.9877","0.0003","19.0534","0.0009","90","","90.804","0.002","90","","1664.29","0.13","299","","299","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 N O3 S -","- C18 H19 N O3 S -","- C72 H76 N4 O12 S4 -","4","1","","Behera, Pradyota Kumar; Pradhan, Amit Kumar; Rout, Laxmidhar","Practical synthesis of thio-cotarnine analogues","New Journal of Chemistry","2025","49","10","4119","4123","10.1039/D5NJ00005J","","","0.71073","MoKα","","0.084","0.0739","","","0.173","0.1827","","","","","","1.251","","","","has coordinates","298991","2025-04-05","03:39:43",""
"7063650","12.9596","0.0005","7.6809","0.0003","24.4062","0.001","90","","103.416","0.002","90","","2363.13","0.16","258","","258","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H25 Br N2 O5 -","- C25 H25 Br N2 O5 -","- C100 H100 Br4 N8 O20 -","4","2","","Wang, Xin-Ru; Zhang, Yingying","Asymmetric synthesis of axially chiral N,N′-carbazolepyrrole via copper-catalyzed Friedel–Crafts reaction","New Journal of Chemistry","2025","49","10","3849","3854","10.1039/D5NJ00200A","","","1.34139","GaKα","","0.088","0.0767","","","0.2132","0.2269","","","","","","1.063","","","","has coordinates","298993","2025-04-05","03:40:00",""
"7063651","10.6165","0.0005","17.4365","0.0009","7.7037","0.0004","90","","90.31","0.001","90","","1426.05","0.12","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 Cu F6 N2 O6 -","- C30 H26 Cu F6 N2 O6 -","- C60 H52 Cu2 F12 N4 O12 -","2","0.5","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","0.71073","MoKα","","0.0284","0.025","","","0.065","0.0668","","","","","","1.097","","","","has coordinates","299024","2025-04-05","03:47:09",""
"7063652","8.0842","0.0003","9.5538","0.0004","10.0498","0.0004","95.329","0.002","103.084","0.001","106.109","0.001","716.24","0.05","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H26 Cu F6 N2 O6 -","- C30 H26 Cu F6 N2 O6 -","- C30 H26 Cu F6 N2 O6 -","1","0.5","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","0.71073","MoKα","","0.0716","0.0546","","","0.0819","0.0879","","","","","","1.177","","","","has coordinates","299024","2025-04-05","03:47:09",""
"7063653","5.0357","0.0002","13.5619","0.0006","8.9397","0.0005","90","","92.914","0.004","90","","609.74","0.05","298","2","298","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C14 H10 F3 N O2 -","- C14 H10 F3 N O2 -","- C28 H20 F6 N2 O4 -","2","1","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","1.54178","CuKα","","0.1462","0.1068","","","0.1706","0.1958","","","","","","1.156","","","","has coordinates,has disorder","299024","2025-04-05","03:47:09",""
"7063654","10.3191","0.0002","11.0834","0.0002","13.8263","0.0003","90.854","0.001","97.384","0.001","94.296","0.001","1563.32","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H30 Cu F6 N2 O7 -","- C31 H30 Cu F6 N2 O7 -","- C62 H60 Cu2 F12 N4 O14 -","2","1","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","0.71073","MoKα","","0.0336","0.0316","","","0.0822","0.0837","","","","","","1.046","","","","has coordinates","299024","2025-04-05","03:47:09",""
"7063655","22.6984","0.0009","18.0698","0.0006","8.4984","0.0003","90","","90","","90","","3485.7","0.2","200","2","200","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C32 H30 F6 N2 O6 Pd S2 -","- C32 H30 F6 N2 O6 Pd S2 -","- C128 H120 F24 N8 O24 Pd4 S8 -","4","0.5","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","0.71073","MoKα","","0.0942","0.0506","","","0.0801","0.0952","","","","","","1.07","","","","has coordinates","299024","2025-04-05","03:47:09",""
"7063656","8.5108","0.0001","13.3009","0.0002","22.1012","0.0003","90","","90","","90","","2501.88","0.06","297","2","297","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H10 F3 N O2 -","- C14 H10 F3 N O2 -","- C112 H80 F24 N8 O16 -","8","1","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","1.54178","CuKα","","0.1054","0.0778","","","0.1255","0.1397","","","","","","1.225","","","","has coordinates","299024","2025-04-05","03:47:09",""
"7063657","11.887","0.009","13.769","0.012","10.301","0.008","90","","95.23","0.03","90","","1679","2","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 F6 N2 O6 Pd -","- C34 H30 F6 N2 O6 Pd -","- C68 H60 F12 N4 O12 Pd2 -","2","0.5","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","0.71073","MoKα","","0.1186","0.0793","","","0.1399","0.1666","","","","","","1.145","","","","has coordinates","299024","2025-04-05","03:47:09",""
"7063658","17.7063","0.0005","11.4094","0.0003","8.6419","0.0002","90","","99.939","0.001","90","","1719.62","0.08","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 F6 N2 O6 Pd S2 -","- C32 H30 F6 N2 O6 Pd S2 -","- C64 H60 F12 N4 O12 Pd2 S4 -","2","0.5","","Moreno-Narváez, María Esther; Arenaza-Corona, Antonino; González-Sebastián, Lucero; Ramírez, Teresa Apan; Ortega, Simón Hernández; Cruz-Navarro, J. Antonio; Alí-Torres, Jorge; Orjuela, Adrián L.; Reyes-Marquez, Viviana; Lomas-Romero, Leticia; Morales-Morales, David","Glycoconjugate Pd(ii) and Cu(ii) complexes of fluorinated N,O Schiff base ligands for targeted cancer therapy: synthesis, characterization and in vitro cytotoxic activity evaluation","New Journal of Chemistry","2025","49","13","5187","5199","10.1039/D4NJ05181E","","","0.71073","MoKα","","0.0482","0.0337","","","0.0723","0.08","","","","","","1.045","","","","has coordinates,has disorder","299024","2025-04-05","03:47:09",""
"7063659","6.129","0.002","15.814","0.006","11.441","0.004","90","","102.8","0.014","90","","1081.4","0.7","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 N10 Ni -","- C24 H20 N10 Ni -","- C48 H40 N20 Ni2 -","2","0.5","","Dolai, Malay; Saha, Urmila; Goswami, Juli Nanda; Bhattacharya, Biswajit; Emmerling, Franziska; Ifseisi, Ahmad A.; Biswas, Surajit","Nickel(ii)-mediated in situ complex formation with unexpected ligand transformations: crystal structures, DFT calculations, and catalytic activity in CO2 fixation reactions","New Journal of Chemistry","2025","49","11","4451","4463","10.1039/D4NJ01801J","","","0.71073","MoKα","","0.0403","0.0295","","","0.0632","0.0695","","","","","","1.07","","","","has coordinates","299040","2025-04-05","03:51:52",""
"7063660","21.354","0.003","10.5144","0.0013","21.722","0.003","90","","103.013","0.005","90","","4751.9","1.1","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33.44 H46.88 Cl4 N18 Ni2 O11 -","- C33.438 H46.876 Cl4 N18 Ni2 O11 -","- C133.752 H187.504 Cl16 N72 Ni8 O44 -","4","0.5","","Dolai, Malay; Saha, Urmila; Goswami, Juli Nanda; Bhattacharya, Biswajit; Emmerling, Franziska; Ifseisi, Ahmad A.; Biswas, Surajit","Nickel(ii)-mediated in situ complex formation with unexpected ligand transformations: crystal structures, DFT calculations, and catalytic activity in CO2 fixation reactions","New Journal of Chemistry","2025","49","11","4451","4463","10.1039/D4NJ01801J","","","0.71073","MoKα","","0.051","0.0408","","","0.1121","0.12","","","","","","1.059","","","","has coordinates,has disorder","299040","2025-04-05","03:51:53",""
"7063661","8.7072","0.0003","9.4954","0.0004","22.8387","0.001","84.987","0.002","80.985","0.002","67.538","0.002","1722.67","0.12","297","2","297","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H28 Cl N Ni O5 P2 -","- C39 H28 Cl N Ni O5 P2 -","- C78 H56 Cl2 N2 Ni2 O10 P4 -","2","1","","Amaya-Flórez, Andrés; Serrano-García, Juan S.; Ruiz-Galindo, Jordi; Arenaza-Corona, Antonino; Hernández-Ortega, Simón; Orjuela, Adrián L.; Alí-Torres, Jorge; Flores-Alamo, Marcos; Reyes-Márquez, Viviana; Morales-Morales, David","N-(Methyl)phthalimide para functionalized Ni(ii)–POCOP pincer complexes. Synthesis, characterization and biological activity","New Journal of Chemistry","2025","49","13","5173","5186","10.1039/D4NJ05183A","","","0.71073","MoKα","","0.0642","0.0459","","","0.0905","0.0982","","","","","","1.088","","","","has coordinates","299020","2025-04-05","03:45:56",""
"7063662","8.2574","0.0004","11.528","0.0008","15.9268","0.0008","89.739","0.005","76.201","0.005","76.225","0.005","1427.79","0.15","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H36 Cl N Ni O5 P2 -","- C27 H36 Cl N Ni O5 P2 -","- C54 H72 Cl2 N2 Ni2 O10 P4 -","2","1","","Amaya-Flórez, Andrés; Serrano-García, Juan S.; Ruiz-Galindo, Jordi; Arenaza-Corona, Antonino; Hernández-Ortega, Simón; Orjuela, Adrián L.; Alí-Torres, Jorge; Flores-Alamo, Marcos; Reyes-Márquez, Viviana; Morales-Morales, David","N-(Methyl)phthalimide para functionalized Ni(ii)–POCOP pincer complexes. Synthesis, characterization and biological activity","New Journal of Chemistry","2025","49","13","5173","5186","10.1039/D4NJ05183A","","","0.71073","MoKα","","0.0539","0.0368","","","0.0792","0.0905","","","","","","1.083","","","","has coordinates","299020","2025-04-05","03:45:57",""
"7063663","8.0054","0.0004","27.8419","0.0012","14.9413","0.0007","90","","103.937","0.005","90","","3232.2","0.3","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H44 Cl N Ni O5 P2 -","- C31 H44 Cl N Ni O5 P2 -","- C124 H176 Cl4 N4 Ni4 O20 P8 -","4","1","","Amaya-Flórez, Andrés; Serrano-García, Juan S.; Ruiz-Galindo, Jordi; Arenaza-Corona, Antonino; Hernández-Ortega, Simón; Orjuela, Adrián L.; Alí-Torres, Jorge; Flores-Alamo, Marcos; Reyes-Márquez, Viviana; Morales-Morales, David","N-(Methyl)phthalimide para functionalized Ni(ii)–POCOP pincer complexes. Synthesis, characterization and biological activity","New Journal of Chemistry","2025","49","13","5173","5186","10.1039/D4NJ05183A","","","0.71073","MoKα","","0.0532","0.0389","","","0.0799","0.088","","","","","","1.054","","","","has coordinates","299020","2025-04-05","03:45:57",""
"7063664","16.087","0.002","11.8579","0.0014","9.183","0.0011","90","","94.929","0.004","90","","1745.3","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 F N O4 S2 -","- C18 H14 F N O4 S2 -","- C72 H56 F4 N4 O16 S8 -","4","1","","Santhosh, Chikkappaiahnayaka; Singh, Krishna Ravi; Mane, Manoj V.; Sheela, Kalleshappa; Sharath, Kalleshappa; Sadashiva, Maralinganadoddi P.","Base-promoted regioselective synthesis of alkyl (2-tosyl/4-ethylcarbonyl) thiazole-5-carboxylates employing dithioates and active methylene isocyanides","New Journal of Chemistry","2025","49","11","4604","4614","10.1039/D4NJ04515G","","","0.71073","MoKα","","0.106","0.0899","","","0.1854","0.1921","","","","","","1.233","","","","has coordinates","299037","2025-04-05","03:51:01",""
"7063665","13.765","0.0007","7.5431","0.0004","15.3707","0.0009","90","","104.898","0.002","90","","1542.3","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Cl N O4 S -","- C14 H12 Cl N O4 S -","- C56 H48 Cl4 N4 O16 S4 -","4","1","","Santhosh, Chikkappaiahnayaka; Singh, Krishna Ravi; Mane, Manoj V.; Sheela, Kalleshappa; Sharath, Kalleshappa; Sadashiva, Maralinganadoddi P.","Base-promoted regioselective synthesis of alkyl (2-tosyl/4-ethylcarbonyl) thiazole-5-carboxylates employing dithioates and active methylene isocyanides","New Journal of Chemistry","2025","49","11","4604","4614","10.1039/D4NJ04515G","","","0.71073","MoKα","","0.084","0.0634","","","0.1764","0.2114","","","","","","1.129","","","","has coordinates","299037","2025-04-05","03:51:01",""
"7063666","13.9644","0.0012","7.8387","0.0004","19.9931","0.0014","90","","94.284","0.004","90","","2182.4","0.3","150","2","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 N2 Ni O5 -","- C24 H30 N2 Ni O5 -","- C96 H120 N8 Ni4 O20 -","4","1","","Jana, Narayan Ch.; Das, Mainak; Brandão, Paula; Ortega-Castro, Joaquín; Frontera, Antonio; Ray, Partha Pratim; Panja, Anangamohan","Impact of isomeric ligands on molecular stacking and semiconducting behavior in square planar Ni(ii) complexes","New Journal of Chemistry","2025","49","11","4557","4570","10.1039/D5NJ00020C","","","0.71073","MoKα","","0.0395","0.032","","","0.0779","0.0816","","","","","","1.047","","","","has coordinates","299039","2025-04-05","03:51:23",""
"7063667","11.3463","0.0007","16.1675","0.0009","24.1553","0.0015","90","","91.281","0.002","90","","4430","0.5","150","2","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H30 N2 Ni O5 -","- C24 H30 N2 Ni O5 -","- C192 H240 N16 Ni8 O40 -","8","2","","Jana, Narayan Ch.; Das, Mainak; Brandão, Paula; Ortega-Castro, Joaquín; Frontera, Antonio; Ray, Partha Pratim; Panja, Anangamohan","Impact of isomeric ligands on molecular stacking and semiconducting behavior in square planar Ni(ii) complexes","New Journal of Chemistry","2025","49","11","4557","4570","10.1039/D5NJ00020C","","","0.71073","MoKα","","0.0555","0.0394","","","0.0937","0.102","","","","","","1.067","","","","has coordinates","299039","2025-04-05","03:51:24",""
"7063668","6.2488","0.0009","8.9759","0.0012","14.662","0.002","72.625","0.005","79.192","0.005","71.413","0.004","740.02","0.18","170","","170","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H36 B2 F4 N4 -","- C34 H36 B2 F4 N4 -","- C34 H36 B2 F4 N4 -","1","0.5","","Zhao, Tingting; A., Suru; Ma, Yurong; Wang, Nan; Su, Zhongmin; Liu, Fangbin","Organoboron emitters with narrowband thermally activated delayed fluorescence for doped organic light emitting diodes","New Journal of Chemistry","2025","49","10","4035","4041","10.1039/D4NJ05279J","","","1.34139","GaKα","","0.0865","0.0695","","","0.1878","0.2013","","","","","","1.092","","","","has coordinates","298986","2025-04-05","03:36:19",""
"7063669","9.78624","0.00014","14.74804","0.00017","10.33498","0.00015","90","","114.746","0.0018","90","","1354.65","0.04","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 O6 -","- C14 H14 O6 -","- C56 H56 O24 -","4","1","","Kumari, Sanju; Saini, Vaishali; Chakrabarty, Sanheeta; Kumar, Sanjay; Jha, Hem Chandra; Ronickom, Jac Fredo Agastinose; Kumar, Sanjeev; Jain, Shreyans K.","Combined prioritization and dereplication-based rapid identification of new 8-alkylated coumarins: podurins A and B from the leaves of Murraya paniculata and cytotoxic evaluation","New Journal of Chemistry","2025","49","12","4842","4848","10.1039/D4NJ05468G","","x-ray","1.54184","CuKα","","0.0649","0.0599","","","0.1786","0.1851","","","","","","1.082","","","","has coordinates","299044","2025-04-05","03:52:28",""
"7063670","6.7946","0.0001","9.8825","0.0001","22.9394","0.0003","90","","90","","90","","1540.33","0.03","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 O5 -","- C17 H22 O5 -","- C68 H88 O20 -","4","1","","Kumari, Sanju; Saini, Vaishali; Chakrabarty, Sanheeta; Kumar, Sanjay; Jha, Hem Chandra; Ronickom, Jac Fredo Agastinose; Kumar, Sanjeev; Jain, Shreyans K.","Combined prioritization and dereplication-based rapid identification of new 8-alkylated coumarins: podurins A and B from the leaves of Murraya paniculata and cytotoxic evaluation","New Journal of Chemistry","2025","49","12","4842","4848","10.1039/D4NJ05468G","","x-ray","1.54184","CuKα","","0.0611","0.0566","","","0.1909","0.1984","","","","","","1.084","","","","has coordinates","299044","2025-04-05","03:52:28",""
"7063671","21.051","0.006","10.1465","0.0009","13.0494","0.0009","90","","111.09","0.009","90","","2600.6","0.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H30 In2 N4 O2 -","- C28 H30 In2 N4 O2 -","- C112 H120 In8 N16 O8 -","4","0.5","","Ershova, Irina V.; Baryshnikova, Svetlana V.; Arsenyev, Maxim V.; Belikov, Alexey A.; Yakushev, Ilya A.; Dorovatovskii, Pavel V.; Ilichev, Vasily A.; Ketkov, Sergey Yu.; Piskunov, Alexandr V.","Luminescent indium complexes with ONN-donor Schiff bases: syntheses, structures, and DFT investigations","New Journal of Chemistry","2025","49","12","4933","4942","10.1039/D4NJ04755A","","","0.75268","synchrotron","","0.0566","0.0503","","","0.1394","0.144","","","","","","1.096","","","","has coordinates","299041","2025-04-05","03:52:03",""
"7063672","7.9004","0.0019","8.4003","0.0017","11.382","0.003","77.261","0.005","82.036","0.018","89.638","0.019","729.4","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H28 In2 N6 O6 -","- C28 H28 In2 N6 O6 -","- C28 H28 In2 N6 O6 -","1","0.5","","Ershova, Irina V.; Baryshnikova, Svetlana V.; Arsenyev, Maxim V.; Belikov, Alexey A.; Yakushev, Ilya A.; Dorovatovskii, Pavel V.; Ilichev, Vasily A.; Ketkov, Sergey Yu.; Piskunov, Alexandr V.","Luminescent indium complexes with ONN-donor Schiff bases: syntheses, structures, and DFT investigations","New Journal of Chemistry","2025","49","12","4933","4942","10.1039/D4NJ04755A","","","0.75268","synchrotron","","0.0458","0.0378","","","0.0888","0.0924","","","","","","1.045","","","","has coordinates","299041","2025-04-05","03:52:04",""
"7063673","8.6219","0.0005","17.4483","0.0011","9.7888","0.0006","90","","102.362","0.002","90","","1438.46","0.15","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 In2 N4 O2 -","- C30 H34 In2 N4 O2 -","- C60 H68 In4 N8 O4 -","2","0.5","","Ershova, Irina V.; Baryshnikova, Svetlana V.; Arsenyev, Maxim V.; Belikov, Alexey A.; Yakushev, Ilya A.; Dorovatovskii, Pavel V.; Ilichev, Vasily A.; Ketkov, Sergey Yu.; Piskunov, Alexandr V.","Luminescent indium complexes with ONN-donor Schiff bases: syntheses, structures, and DFT investigations","New Journal of Chemistry","2025","49","12","4933","4942","10.1039/D4NJ04755A","","","0.71073","MoKα","","0.0515","0.0332","","","0.0571","0.0635","","","","","","1.038","","","","has coordinates","299041","2025-04-05","03:52:04",""
"7063674","8.5866","0.0002","17.1574","0.0005","9.9567","0.0003","90","","102.387","0.001","90","","1432.71","0.07","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Cl2 In2 N4 O2 -","- C28 H28 Cl2 In2 N4 O2 -","- C56 H56 Cl4 In4 N8 O4 -","2","0.5","","Ershova, Irina V.; Baryshnikova, Svetlana V.; Arsenyev, Maxim V.; Belikov, Alexey A.; Yakushev, Ilya A.; Dorovatovskii, Pavel V.; Ilichev, Vasily A.; Ketkov, Sergey Yu.; Piskunov, Alexandr V.","Luminescent indium complexes with ONN-donor Schiff bases: syntheses, structures, and DFT investigations","New Journal of Chemistry","2025","49","12","4933","4942","10.1039/D4NJ04755A","","","0.71073","MoKα","","0.0256","0.02","","","0.0467","0.0484","","","","","","1.066","","","","has coordinates","299041","2025-04-05","03:52:04",""
"7063675","13.302","0.004","5.6532","0.0015","21.875","0.007","90","","103.777","0.009","90","","1597.6","0.8","296","2","296","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C19 H18 N2 O -","- C19 H18 N2 O -","- C76 H72 N8 O4 -","4","1","","Sharma, Sachin; Kanwar, Nikita; Khan, Akram Gulam Hussain; Easwar, Srinivasan","Access to isolable cyclic dienamines and N-aryl-2-aminobenzophenones from Morita–Baylis–Hillman ketones","New Journal of Chemistry","2025","49","11","4639","4646","10.1039/D5NJ00182J","","","0.71073","MoKα","","0.0915","0.0702","","","0.1719","0.1887","","","","","","1.117","","","","has coordinates","299038","2025-04-05","03:51:10",""
"7063676","7.6821","0.0005","7.3014","0.0006","16.2751","0.0003","90","","98.736","0.001","90","","902.28","0.1","296","1","296","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H14 Fe N6 O2 Pd -","- C16 H14 Fe N6 O2 Pd -","- C32 H28 Fe2 N12 O4 Pd2 -","2","1","","Vázquez, M. C.; Avila, Y.; Sánchez, L.; Ortiz, A.; Piedra, O.; González, M.; Ávila, M.; Reguera, E.","Spin crossover in the Fe(3PyMe)2[M(CN)4] series with M = Ni, Pd, Pt, and 3PyMe = 3-pyridinemethanol. The role of the intermolecular OH⋯OH interaction","New Journal of Chemistry","2025","49","12","4943","4949","10.1039/D5NJ00335K","powder diffraction","","1.5418","CuKα","","","","","","","","","2.9452","1.736","","","","","","","has coordinates","299043","2025-04-05","03:52:20",""
"7063677","7.6869","0.0004","7.2881","0.0001","16.2866","0.0003","90","","99.433","0.005","90","","900.08","0.05","296","1","296","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H14 Fe N6 O2 Pt -","- C16 H14 Fe N6 O2 Pt -","- C32 H28 Fe2 N12 O4 Pt2 -","2","1","","Vázquez, M. C.; Avila, Y.; Sánchez, L.; Ortiz, A.; Piedra, O.; González, M.; Ávila, M.; Reguera, E.","Spin crossover in the Fe(3PyMe)2[M(CN)4] series with M = Ni, Pd, Pt, and 3PyMe = 3-pyridinemethanol. The role of the intermolecular OH⋯OH interaction","New Journal of Chemistry","2025","49","12","4943","4949","10.1039/D5NJ00335K","powder diffraction","","1.5418","CuKα","","","","","","","","","2.7923","1.723","","","","","","","has coordinates","299043","2025-04-05","03:52:20",""
"7063678","7.2527","0.0005","7.2809","0.0001","16.1197","0.0004","90","","91.53","0.006","90","","850.92","0.06","296","1","296","1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H14 Fe N6 Ni O2 -","- C16 H14 Fe N6 Ni O2 -","- C32 H28 Fe2 N12 Ni2 O4 -","2","1","","Vázquez, M. C.; Avila, Y.; Sánchez, L.; Ortiz, A.; Piedra, O.; González, M.; Ávila, M.; Reguera, E.","Spin crossover in the Fe(3PyMe)2[M(CN)4] series with M = Ni, Pd, Pt, and 3PyMe = 3-pyridinemethanol. The role of the intermolecular OH⋯OH interaction","New Journal of Chemistry","2025","49","12","4943","4949","10.1039/D5NJ00335K","powder diffraction","","1.5418","CuKα","","","","","","","","","4.159","1.714","","","","","","","has coordinates","299043","2025-04-05","03:52:20",""
"7063679","33.974","0.008","5.0398","0.001","38.358","0.009","90","","104.711","0.005","90","","6352","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H41 N5 O3 S2 -","- C33 H41 N5 O3 S2 -","- C264 H328 N40 O24 S16 -","8","1","","Pan, Cheng-Yen; Grinalds, Nathan J.; Ghiviriga, Ion; Abboud, Khalil A.; Xue, Jiangeng; Castellano, Ronald K.","Diagnosing the role of hydrogen bonding in the organization, aggregation, and optical properties of phthalhydrazide-functionalized molecules in solution and solid state","New Journal of Chemistry","2025","49","13","5330","5345","10.1039/D4NJ05529B","","","0.71073","MoKα","","0.0604","0.0561","","","0.1473","0.1552","","","","","","1.057","","","","has coordinates,has disorder","299021","2025-04-05","03:46:08",""
"7063680","7.6216","0.0003","8.5476","0.0003","10.8555","0.0003","90","","100.2","0.003","90","","696.02","0.04","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H12 N4 O6 -","- C12 H12 N4 O6 -","- C24 H24 N8 O12 -","2","1","","Naaz, Farha; Khan, Ishaat M.; Shakya, Sonam; Islam, Maidul; Alam, Nisat; Alarifi, Abdullah; Li, Xiang","Spectrophotometric and computational insights into the 2-ethylimidazole–3,5-dinitrobenzoic acid complex: BSA interaction and antimicrobial activity","New Journal of Chemistry","2025","49","13","5402","5419","10.1039/D5NJ00346F","","","0.71073","MoKα","","0.0497","0.0371","","","0.0665","0.0731","","","","","","1.0862","","","","has coordinates","299023","2025-04-05","03:46:43",""
"7063681","15.229","0.005","5.3345","0.0015","23.556","0.006","90","","90","","90","","1913.7","1","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","3-((3,4-dinitro-1H-pyrazol-1-yl)methyl)-1,2,4-oxadiazole","","- C6 H4 N6 O5 -","- C6 H4 N6 O5 -","- C48 H32 N48 O40 -","8","2","","Zhang, Tongwei; Yuan, Xiaofeng; Xu, Ze; Lu, Ming; Xu, Yuangang","Derivatives of 2-(3,4-dinitro-1H-pyrazol-1-yl) acetonitrile: design strategy, syntheses, and properties of a series of new melt-cast explosives","New Journal of Chemistry","2025","49","12","5031","5040","10.1039/D4NJ05467A","","","0.71073","MoKα","","0.1356","0.0651","","","0.1354","0.1572","","","","","","1.034","","","","has coordinates","299042","2025-04-05","03:52:12",""
"7063682","6.7014","0.0003","7.475","0.0004","11.2966","0.0005","97.876","0.002","104.754","0.002","107.211","0.002","508.71","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","5-((3,4-dinitro-1H-pyrazol-1-yl)methyl)-2-methyl-2H-tetrazole","","- C6 H6 N8 O4 -","- C6 H6 N8 O4 -","- C12 H12 N16 O8 -","2","1","","Zhang, Tongwei; Yuan, Xiaofeng; Xu, Ze; Lu, Ming; Xu, Yuangang","Derivatives of 2-(3,4-dinitro-1H-pyrazol-1-yl) acetonitrile: design strategy, syntheses, and properties of a series of new melt-cast explosives","New Journal of Chemistry","2025","49","12","5031","5040","10.1039/D4NJ05467A","","","0.71073","MoKα","","0.057","0.0423","","","0.102","0.1104","","","","","","1.033","","","","has coordinates","299042","2025-04-05","03:52:13",""
"7063683","8.8436","0.0005","8.0309","0.0005","15.9838","0.001","90","","95.681","0.002","90","","1129.63","0.12","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-((3,4-dinitro-1H-pyrazol-1-yl)methyl)-5-(trifluoromethyl)-1,2,4-oxadiazole","","- C7 H3 F3 N6 O5 -","- C7 H3 F3 N6 O5 -","- C28 H12 F12 N24 O20 -","4","1","","Zhang, Tongwei; Yuan, Xiaofeng; Xu, Ze; Lu, Ming; Xu, Yuangang","Derivatives of 2-(3,4-dinitro-1H-pyrazol-1-yl) acetonitrile: design strategy, syntheses, and properties of a series of new melt-cast explosives","New Journal of Chemistry","2025","49","12","5031","5040","10.1039/D4NJ05467A","","","0.71073","MoKα","","0.0824","0.0531","","","0.1401","0.1567","","","","","","1.03","","","","has coordinates","299042","2025-04-05","03:52:13",""
"7063684","7.117","0.0003","16.0841","0.0007","16.6316","0.0007","90","","90","","90","","1903.83","0.14","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N3 O3 -","- C21 H25 N3 O3 -","- C84 H100 N12 O12 -","4","1","","Yang, Lan-Lan; Pan, Di-Cheng; Zhu, Xian-Qiao; Liu, De-Wu; Tang, Xing-Zhou; Cen, Hong-Xing; Peng, Li-Jun; Liu, Xiong-Li","Mantis-shaped chiral pyridine-N-oxides: a new class of ligands in asymmetric palladium(ii)-catalysed Friedel–Crafts alkylation","New Journal of Chemistry","2025","49","13","5346","5351","10.1039/D5NJ00294J","","","1.54178","CuKα","","0.051","0.0477","","","0.1211","0.1232","","","","","","1.151","","","","has coordinates","299025","2025-04-05","03:47:18",""
"7063685","24.46","0.002","11.1429","0.0008","11.7925","0.0009","90","","117.362","0.004","90","","2854.5","0.4","296.15","","296.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H32 Cu2 F2 N4 O13 -","- C24 H32 Cu2 F2 N4 O13 -","- C96 H128 Cu8 F8 N16 O52 -","4","0.5","","Manurkar, Nagesh; Ilyas, Mubashar; Arshad, Faiza; Patil, Prasanna; Shah, Haroon; Khan, Maroof Ahmad; Hussain, Wajid; Li, Hui","Exploring the first and second hyperpolarizabilities of l-glutamine-based Schiff base ligands and their Cu(ii) coordination complexes","New Journal of Chemistry","2025","49","13","5200","5212","10.1039/D5NJ00477B","","","0.71073","MoKα","","0.0879","0.0446","","","0.093","0.1078","","","","","","0.987","","","","has coordinates","299022","2025-04-05","03:46:30",""
"7063686","24.1267","0.0013","11.1271","0.0005","11.7481","0.0006","90","","117.052","0.002","90","","2808.8","0.2","297.61","","297.61","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","nagash","","- C12 H17 Cu N2 O6.5 -","- C12 H17 Cu N2 O6.5 -","- C96 H136 Cu8 N16 O52 -","8","1","","Manurkar, Nagesh; Ilyas, Mubashar; Arshad, Faiza; Patil, Prasanna; Shah, Haroon; Khan, Maroof Ahmad; Hussain, Wajid; Li, Hui","Exploring the first and second hyperpolarizabilities of l-glutamine-based Schiff base ligands and their Cu(ii) coordination complexes","New Journal of Chemistry","2025","49","13","5200","5212","10.1039/D5NJ00477B","","","0.71073","MoKα","","0.0263","0.0224","","","0.0607","0.0625","","","","","","1.063","","","","has coordinates","299022","2025-04-05","03:46:31",""
"7063687","10.2238","0.0003","10.1572","0.0003","21.0271","0.0008","90","","104.016","0.004","90","","2118.55","0.13","249.99","0.1","249.99","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H20 O Se -","- C27 H20 O Se -","- C108 H80 O4 Se4 -","4","1","","Guo, Le; Liu, Anjia; Qi, Hongbo; Gu, Lei; Yuan, Xingyu; Chi, Dongmei; Chen, Shufeng","Divergent synthesis of selenide-containing spirocarbocycles and phenanthrenes through Cu(OTf)2-promoted selenylation of alkyne-containing phenol-based biaryls","New Journal of Chemistry","2025","49","14","5989","5994","10.1039/D5NJ00253B","","x-ray","1.54184","CuKα","","0.034","0.0308","","","0.0811","0.0838","","","","","","1.065","","","","has coordinates","299030","2025-04-05","03:49:04",""
"7063688","26.615","0.003","9.7502","0.001","35.915","0.006","90","","112.221","0.016","90","","8628","2","219.99","0.1","219.99","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 O Se -","- C26 H18 O Se -","- C416 H288 O16 Se16 -","16","2","","Guo, Le; Liu, Anjia; Qi, Hongbo; Gu, Lei; Yuan, Xingyu; Chi, Dongmei; Chen, Shufeng","Divergent synthesis of selenide-containing spirocarbocycles and phenanthrenes through Cu(OTf)2-promoted selenylation of alkyne-containing phenol-based biaryls","New Journal of Chemistry","2025","49","14","5989","5994","10.1039/D5NJ00253B","","x-ray","0.71073","MoKα","","0.1488","0.0634","","","0.1106","0.1417","","","","","","1","","","","has coordinates","299030","2025-04-05","03:49:04",""
"7063689","8.8588","0.0001","9.4608","0.0001","16.0032","0.0002","97.07","0.001","94.069","0.001","94.939","0.001","1321.59","0.03","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","SNSTPE","","- C65.6 H47.2 Cl3.2 N2 S2 -","- C65.6 H47.2 Cl3.2 N2 S2 -","- C65.6 H47.2 Cl3.2 N2 S2 -","1","0.5","","Guo, Wenxiu; Ding, Huanda; Li, Aomei; Zhou, Shiyuan; Wang, Danfeng; Gu, Peiyang; Liu, Jie; Sun, Hua; Liu, Guangfeng","Tuning the optical properties of pyrimidine-thiophene derivatives via molecular engineering","New Journal of Chemistry","2025","49","13","5362","5368","10.1039/D5NJ00472A","","","1.54184","CuKα","","0.0506","0.0478","","","0.1154","0.1171","","","","","","1.062","","","","has coordinates,has disorder","299026","2025-04-05","03:47:40",""
"7063690","18.9371","0.0017","8.657","0.0007","42.94","0.02","90","","90","","90","","7040","3","100.04","0.1","100.04","0.1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","SNSCZ","","- C48 H30 N4 S2 -","- C48 H30 N4 S2 -","- C384 H240 N32 S16 -","8","1","","Guo, Wenxiu; Ding, Huanda; Li, Aomei; Zhou, Shiyuan; Wang, Danfeng; Gu, Peiyang; Liu, Jie; Sun, Hua; Liu, Guangfeng","Tuning the optical properties of pyrimidine-thiophene derivatives via molecular engineering","New Journal of Chemistry","2025","49","13","5362","5368","10.1039/D5NJ00472A","","x-ray","1.54184","CuKα","","0.0732","0.0701","","","0.2046","0.2075","","","","","","1.158","","","","has coordinates,has disorder","299026","2025-04-05","03:47:52",""
"7063691","9.948","0.0005","11.6335","0.0005","16.453","0.0006","86.111","0.003","73.614","0.004","77.125","0.004","1780.81","0.14","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","SNSTPA","","- C48 H34 N4 S2 -","- C48 H34 N4 S2 -","- C96 H68 N8 S4 -","2","1","","Guo, Wenxiu; Ding, Huanda; Li, Aomei; Zhou, Shiyuan; Wang, Danfeng; Gu, Peiyang; Liu, Jie; Sun, Hua; Liu, Guangfeng","Tuning the optical properties of pyrimidine-thiophene derivatives via molecular engineering","New Journal of Chemistry","2025","49","13","5362","5368","10.1039/D5NJ00472A","","x-ray","0.71073","MoKα","","0.0663","0.0447","","","0.1094","0.1196","","","","","","1.048","","","","has coordinates,has disorder","299026","2025-04-05","03:48:03",""
"7063692","11.604","0.0011","24.366","0.002","8.4503","0.0007","90","","90","","90","","2389.3","0.4","296.3","0.5","296.3","0.5","","","","","","","","4","P n n a","-P 2a 2bc","52","","","","- I9 K2 Na O24 -","- I9 K2 Na O24 -","- I36 K8 Na4 O96 -","4","0.5","","Lin, Min-Quan; Duan, Meng-Fan; Mao, Jiang-Gao; Yang, Bing-Ping","K2Na(I3O8)3: a promising mid-infrared birefringent material with two different structures of octaoxotriiodate(v) polyanions","New Journal of Chemistry","2025","49","15","6103","6108","10.1039/D5NJ00763A","","x-ray","0.71073","MoKα","","0.0501","0.0349","","","0.0716","0.0811","","","","","","1.049","","","","has coordinates","301066","2025-07-06","17:36:01",""
"7063693","8.933","0.001","17.321","0.002","13.139","0.002","90","","104.667","0.005","90","","1966.7","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H26 Cl2 Mo N4 O3 -","- C14 H26 Cl2 Mo N4 O3 -","- C56 H104 Cl8 Mo4 N16 O12 -","4","1","","Teles, Tamara; Fernandes, Auguste; Ferreira, Maria João; Côrte-Real, Leonor; Marques, Fernanda; Correia, João D. G.; Alves, Luis G.","Cyclam-based molybdenum carbonyl complexes as a novel class of cytotoxic agents","New Journal of Chemistry","2025","49","14","5766","5772","10.1039/D4NJ05233A","","","0.71073","MoKα","","0.0511","0.0378","","","0.0781","0.0821","","","","","","1.086","","","","has coordinates","299028","2025-04-05","03:48:31",""
"7063694","17.128","0.005","21.25","0.006","12.14","0.003","90","","133.535","0.003","90","","3203.3","1.5","173.15","","173.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H44 I2 N4 O Si2 -","- C24 H44 I2 N4 O Si2 -","- C96 H176 I8 N16 O4 Si8 -","4","0.5","","Puerta Lombardi, Braulio M.; McCallum, Katia A.; Harrison, Alexander; Louwe, Devon S.; Espejo, Jayar; Bouzidi, Karima; Roesler, Roland","Bis(N-heterocyclic carbene)s incorporating silicon in the ligand backbone","New Journal of Chemistry","2025","49","16","6554","6560","10.1039/D4NJ04276J","","","0.71073","MoKα","","0.0474","0.0358","","","0.0849","0.0918","","","","","","1.022","","","","has coordinates","301054","2025-07-06","17:33:43",""
"7063695","9.0436","0.0015","22.182","0.004","11.772","0.002","90","","102.171","0.003","90","","2308.4","0.7","173.15","","173.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H30 I2 N4 Si -","- C16 H30 I2.0004 N4 Si -","- C64 H120 I8.0016 N16 Si4 -","4","1","","Puerta Lombardi, Braulio M.; McCallum, Katia A.; Harrison, Alexander; Louwe, Devon S.; Espejo, Jayar; Bouzidi, Karima; Roesler, Roland","Bis(N-heterocyclic carbene)s incorporating silicon in the ligand backbone","New Journal of Chemistry","2025","49","16","6554","6560","10.1039/D4NJ04276J","","","0.71073","MoKα","","0.0835","0.0756","","","0.1879","0.1955","","","","","","1.049","","","","has coordinates,has disorder","301054","2025-07-06","17:33:44",""
"7063696","12.276","0.002","15.4","0.003","15.149","0.002","90","","100.478","0.002","90","","2816.2","0.8","173.15","","173.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H40 I2 N4 O Si -","- C22 H40 I2 N4 O Si -","- C88 H160 I8 N16 O4 Si4 -","4","1","","Puerta Lombardi, Braulio M.; McCallum, Katia A.; Harrison, Alexander; Louwe, Devon S.; Espejo, Jayar; Bouzidi, Karima; Roesler, Roland","Bis(N-heterocyclic carbene)s incorporating silicon in the ligand backbone","New Journal of Chemistry","2025","49","16","6554","6560","10.1039/D4NJ04276J","","","0.71073","MoKα","","0.0619","0.0456","","","0.13","0.1429","","","","","","1.038","","","","has coordinates","301054","2025-07-06","17:33:44",""
"7063697","17.5721","0.0003","17.3121","0.0002","35.253","0.0005","90","","100.215","0.001","90","","10554.3","0.3","100","0.1","100.15","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C109 H105 Cl3 F12 Fe3 N7 P8 Ru -","- C109 H105 Cl3 F12 Fe3 N7 P8 Ru -","- C436 H420 Cl12 F48 Fe12 N28 P32 Ru4 -","4","1","","Wang, Hao; Liu, Xiao-Lin; Liu, Han; Wu, Xin-Tao; Sheng, Tian-Lu","A T-shaped cyanidometal-bridged tetranuclear Fe3Ru complex with oxidation-driven intramolecular charge transfer between metal centres","New Journal of Chemistry","2025","49","16","6595","6602","10.1039/D5NJ00751H","","","1.54184","CuKα","","0.064","0.054","","","0.1414","0.1477","","","","","","1.012","","","","has coordinates,has disorder","301057","2025-07-06","17:34:26",""
"7063698","12.683","0.0005","7.2768","0.0003","35.8591","0.0013","90","","90.636","0.003","90","","3309.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 Cl N O3 -","- C18 H16 Cl N O3 -","- C144 H128 Cl8 N8 O24 -","8","2","","Singh, Gurjaspreet; Sharma, Devina; Sharma, Samiksha; Stanzin, Jigmat; Kaur, Harshbir; Dalal, Anurag; Vikas,; Batish, Daizy Rani; Pal, Amrit; Alpaslan, Medine Karadağ","Elucidating the plant growth potential of triazole conjoined silatrane on Cajanus cajan and its in silico approach","New Journal of Chemistry","2025","49","14","5871","5882","10.1039/D4NJ05561F","","x-ray","0.71073","MoKα","","0.1085","0.0491","","","0.1107","0.1344","","","","","","1.018","","","","has coordinates","299027","2025-04-05","03:48:15",""
"7063699","7.4934","0.0011","26.809","0.004","14.499","0.002","90","","92.652","0.005","90","","2909.6","0.7","300","","300","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 Cl3 N3 Ni O4 S -","- C28 H22 Cl3 N3 Ni O4 S -","- C112 H88 Cl12 N12 Ni4 O16 S4 -","4","1","","Panicker, Rakesh R.; John, Martin Luther; N., Daphne Morrison; Yogendra Varma, Pralayakaveri; S., Dharani; Pandya, Chayan; Anand, A. S. Vijai; Mondal, Joydip; Sivaramakrishna, Akella","Square planar mononuclear Ni(ii) complexes of functionalized 2,2′:6′,2′′-terpyridines: BSA/DNA binding and anticancer activity","New Journal of Chemistry","2025","49","14","5883","5900","10.1039/D4NJ03874F","","","0.71073","MoKα","","0.0912","0.0551","","","0.1193","0.1393","","","","","","1.036","","","","has coordinates","299031","2025-04-05","03:49:21",""
"7063700","8.238","0.002","10.517","0.003","13.479","0.004","96.239","0.01","102.378","0.01","99.049","0.01","1114.1","0.5","300","","300","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H16 Cl N3 O2 S -","- C26 H16 Cl N3 O2 S -","- C52 H32 Cl2 N6 O4 S2 -","2","1","","Panicker, Rakesh R.; John, Martin Luther; N., Daphne Morrison; Yogendra Varma, Pralayakaveri; S., Dharani; Pandya, Chayan; Anand, A. S. Vijai; Mondal, Joydip; Sivaramakrishna, Akella","Square planar mononuclear Ni(ii) complexes of functionalized 2,2′:6′,2′′-terpyridines: BSA/DNA binding and anticancer activity","New Journal of Chemistry","2025","49","14","5883","5900","10.1039/D4NJ03874F","","","0.71073","MoKα","","0.0808","0.0453","","","0.0867","0.103","","","","","","1.058","","","","has coordinates","299031","2025-04-05","03:49:21",""
"7063701","7.6641","0.001","13.0835","0.0017","18.1949","0.0019","90","","94.763","0.01","90","","1818.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 Cl3 N4 O2 Pt -","- C16 H15 Cl3 N4 O2 Pt -","- C64 H60 Cl12 N16 O8 Pt4 -","4","1","","Wu, Run-Chun; Zhang, Ju-Mei; Huang, Xiao-Qiong; Li, Qiu-Ming; Zhou, Zhen; Liang, Hong; Tan, Ming-Xiong; Qin, Qi-Pin","Synthesis and antitumor mechanisms of two new 8-hydroxyquinoline platinum(ii) derivatives","New Journal of Chemistry","2025","49","16","6561","6567","10.1039/D4NJ04292A","","x-ray","0.71073","MoKα","","0.0947","0.0507","","","0.1137","0.1601","","","","","","1.072","","","","has coordinates","301051","2025-07-06","17:32:49",""
"7063702","7.5155","0.0003","13.2815","0.0005","18.2223","0.0006","90","","94.577","0.002","90","","1813.1","0.12","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H15 Br Cl2 N4 O2 Pt -","- C16 H15 Br Cl2 N4 O2 Pt -","- C64 H60 Br4 Cl8 N16 O8 Pt4 -","4","2","","Wu, Run-Chun; Zhang, Ju-Mei; Huang, Xiao-Qiong; Li, Qiu-Ming; Zhou, Zhen; Liang, Hong; Tan, Ming-Xiong; Qin, Qi-Pin","Synthesis and antitumor mechanisms of two new 8-hydroxyquinoline platinum(ii) derivatives","New Journal of Chemistry","2025","49","16","6561","6567","10.1039/D4NJ04292A","","","0.71073","MoKα","","0.0432","0.0347","","","0.095","0.1068","","","","","","1.076","","","","has coordinates","301051","2025-07-06","17:32:49",""
"7063703","8.6372","0.0003","11.4481","0.0004","24.7299","0.0009","90","","94.21","0.003","90","","2438.68","0.15","291","2","291.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 N2 O7 -","- C28 H24 N2 O7 -","- C112 H96 N8 O28 -","4","1","","Nowak, Patryk; Sikorski, Artur","Synthesis, structural characterization, in silico ADMET and molecular docking studies of a Schiff base derived from 4-hydroxybenzaldehyde and 4-aminobenzoic acid","New Journal of Chemistry","2025","49","14","5940","5949","10.1039/D4NJ02791D","","","0.71073","MoKα","","0.0763","0.0496","","","0.1113","0.1235","","","","","","1.0948","","","","has coordinates,has disorder","299029","2025-04-05","03:48:53",""
"7063704","16.576","0.001","13.958","0.0009","18.4436","0.001","90","","90.964","0.005","90","","4266.7","0.4","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H66 B N5 O2 -","- C48 H66 B N5 O2 -","- C192 H264 B4 N20 O8 -","4","1","","Rajput, Sagrika; M. T., Nithya; Dhala, Sasmita; Venkatasubbaiah, Krishnan; Nembenna, Sharanappa","Exploring tetra-coordinate bis-guanidinate-supported boron complexes: synthesis, characterization, and photophysical properties","New Journal of Chemistry","2025","49","16","6731","6740","10.1039/D5NJ00446B","","x-ray","0.71073","MoKα","","0.097","0.0513","","","0.103","0.1183","","","","","","1.01","","","","has coordinates","301052","2025-07-06","17:33:12",""
"7063705","10.9789","0.0004","11.8113","0.0002","17.3241","0.0003","81.404","0.002","74.068","0.002","78.624","0.002","2106.92","0.1","100.01","0.1","100.01","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C40 H50 B N5 O2 -","- C40 H50 B N5 O2 -","- C80 H100 B2 N10 O4 -","2","1","","Rajput, Sagrika; M. T., Nithya; Dhala, Sasmita; Venkatasubbaiah, Krishnan; Nembenna, Sharanappa","Exploring tetra-coordinate bis-guanidinate-supported boron complexes: synthesis, characterization, and photophysical properties","New Journal of Chemistry","2025","49","16","6731","6740","10.1039/D5NJ00446B","","","1.54184","CuKα","","0.0622","0.0601","","","0.1587","0.161","","","","","","1.035","","","","has coordinates","301052","2025-07-06","17:33:13",""
"7063706","15.6239","0.0002","17.405","0.0003","29.4625","0.0004","90","","90","","90","","8011.9","0.2","99.99","0.13","99.99","0.13","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C44 H58 B N5 O2 -","- C44 H58 B N5 O2 -","- C352 H464 B8 N40 O16 -","8","1","","Rajput, Sagrika; M. T., Nithya; Dhala, Sasmita; Venkatasubbaiah, Krishnan; Nembenna, Sharanappa","Exploring tetra-coordinate bis-guanidinate-supported boron complexes: synthesis, characterization, and photophysical properties","New Journal of Chemistry","2025","49","16","6731","6740","10.1039/D5NJ00446B","","x-ray","1.54184","CuKα","","0.0597","0.0495","","","0.1183","0.1243","","","","","","1.032","","","","has coordinates","301052","2025-07-06","17:33:13",""
"7063707","14.4681","0.0003","16.5069","0.0004","17.7735","0.0004","90","","103.435","0.002","90","","4128.57","0.16","100","0.11","100","0.11","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H58 B N5 O2 -","- C48 H58 B N5 O2 -","- C192 H232 B4 N20 O8 -","4","1","","Rajput, Sagrika; M. T., Nithya; Dhala, Sasmita; Venkatasubbaiah, Krishnan; Nembenna, Sharanappa","Exploring tetra-coordinate bis-guanidinate-supported boron complexes: synthesis, characterization, and photophysical properties","New Journal of Chemistry","2025","49","16","6731","6740","10.1039/D5NJ00446B","","","1.54184","CuKα","","0.0591","0.0521","","","0.1385","0.1448","","","","","","1.049","","","","has coordinates","301052","2025-07-06","17:33:13",""
"7063708","20.7642","0.0006","17.1299","0.0003","21.1867","0.0006","90","","115.055","0.003","90","","6826.8","0.3","99.99","0.11","99.99","0.11","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C148 H160 B3 N15 O10 -","- C148 H160 B3 N15 O10 -","- C296 H320 B6 N30 O20 -","2","0.5","","Rajput, Sagrika; M. T., Nithya; Dhala, Sasmita; Venkatasubbaiah, Krishnan; Nembenna, Sharanappa","Exploring tetra-coordinate bis-guanidinate-supported boron complexes: synthesis, characterization, and photophysical properties","New Journal of Chemistry","2025","49","16","6731","6740","10.1039/D5NJ00446B","","","1.54184","CuKα","","0.0718","0.0664","","","0.1843","0.1921","","","","","","1.034","","","","has coordinates,has disorder","301052","2025-07-06","17:33:13",""
"7063709","15.439","0.0003","16.2615","0.0003","21.087","0.0003","90","","90.257","0.001","90","","5294.08","0.16","100.01","0.11","100.01","0.11","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H72 B N5 O4 -","- C60 H72 B N5 O4 -","- C240 H288 B4 N20 O16 -","4","1","","Rajput, Sagrika; M. T., Nithya; Dhala, Sasmita; Venkatasubbaiah, Krishnan; Nembenna, Sharanappa","Exploring tetra-coordinate bis-guanidinate-supported boron complexes: synthesis, characterization, and photophysical properties","New Journal of Chemistry","2025","49","16","6731","6740","10.1039/D5NJ00446B","","","1.54184","CuKα","","0.0861","0.081","","","0.21","0.2143","","","","","","1.037","","","","has coordinates,has disorder","301052","2025-07-06","17:33:13",""
"7063710","14.8209","0.0003","16.0372","0.0004","20.9525","0.0005","104.236","0.002","109.15","0.002","95.378","0.0018","4476.6","0.2","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C54 H62 B N5 O2 -","- C54 H62 B N5 O2 -","- C216 H248 B4 N20 O8 -","4","2","","Rajput, Sagrika; M. T., Nithya; Dhala, Sasmita; Venkatasubbaiah, Krishnan; Nembenna, Sharanappa","Exploring tetra-coordinate bis-guanidinate-supported boron complexes: synthesis, characterization, and photophysical properties","New Journal of Chemistry","2025","49","16","6731","6740","10.1039/D5NJ00446B","","x-ray","1.54184","CuKα","","0.1137","0.0913","","","0.2314","0.2486","","","","","","1.09","","","","has coordinates","301052","2025-07-06","17:33:13",""
"7063711","10.5223","0.0008","10.927","0.001","19.7925","0.0012","84.75","0.006","89.913","0.006","83.45","0.007","2251.3","0.3","298","2","298.15","","","","","","","","","6","P -1","-P 1","2","","","","- C47.5 H52.12 Cl2 Co N6 O9.56 -","- C46 H43.122 Cl2 Co N6 O6.561 -","- C92 H86.244 Cl4 Co2 N12 O13.122 -","2","1","","Khan, Md. Adnan; Khan, Sahanwaj; Sengupta, Swaraj; Naskar, Subhendu","Electrocatalytic water oxidation by molecular cobalt-terpyridine complexes in alkaline medium: experimental and theoretical study","New Journal of Chemistry","2025","49","17","6963","6974","10.1039/D4NJ05517A","","","0.71073","MoKα","","0.0844","0.0572","","","0.1313","0.149","","","","","","1.053","","","","has coordinates,has disorder","301047","2025-07-06","17:32:09",""
"7063712","9.3891","0.0002","12.847","0.0003","20.7104","0.0005","91.549","0.002","100.772","0.002","105.942","0.002","2351.59","0.1","100","0.1","100.15","","","","","","","","","6","P -1","-P 1","2","","","","- C48.5 H43.5 Cl3 Co N6 O14.25 -","- C48 H42.5 Cl2 Co N6 O14.25 -","- C96 H85 Cl4 Co2 N12 O28.5 -","2","1","","Khan, Md. Adnan; Khan, Sahanwaj; Sengupta, Swaraj; Naskar, Subhendu","Electrocatalytic water oxidation by molecular cobalt-terpyridine complexes in alkaline medium: experimental and theoretical study","New Journal of Chemistry","2025","49","17","6963","6974","10.1039/D4NJ05517A","","","0.71073","MoKα","","0.0375","0.0332","","","0.0867","0.0895","","","","","","1.041","","","","has coordinates,has disorder","301047","2025-07-06","17:32:09",""
"7063713","8.932","0.0007","10.3376","0.0008","21.3919","0.0016","85.981","0.006","78.249","0.006","74.246","0.007","1861","0.3","298","2","298.15","","","","","","","","","7","P -1","-P 1","2","","","","- C42 H30 Cl2 Co F2 N6 O5 -","- C42 H30 Cl2 Co F2 N6 O5 -","- C84 H60 Cl4 Co2 F4 N12 O10 -","2","1","","Khan, Md. Adnan; Khan, Sahanwaj; Sengupta, Swaraj; Naskar, Subhendu","Electrocatalytic water oxidation by molecular cobalt-terpyridine complexes in alkaline medium: experimental and theoretical study","New Journal of Chemistry","2025","49","17","6963","6974","10.1039/D4NJ05517A","","","0.71073","MoKα","","0.0722","0.0494","","","0.101","0.113","","","","","","1.031","","","","has coordinates,has disorder","301047","2025-07-06","17:32:09",""
"7063714","8.0616","0.0002","11.5704","0.0002","21.4599","0.0004","84.622","0.001","80.819","0.001","76.323","0.001","1916.74","0.07","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C60 H52 Co5 N4 O42 -","- C60 H52 Co5 N4 O42 -","- C60 H52 Co5 N4 O42 -","1","0.5","","Mao, Yu-Ling; Yu, Jia; Shan, Bo-Yu; Liu, Xin-Xin; Chu, Jing-Ying; Ma, Xin-Yue; Li, Miao; Zheng, Yi-Meng; Zhu, Bai-Li; Zuo, Ming-Hui; Cui, Shu-Xin","A novel naphthalene diimide cobalt coordination polymer: synthesis, photo/electric/dehydration discoloration, amine sensing, and magnetism","New Journal of Chemistry","2025","49","17","7126","7133","10.1039/D5NJ00024F","","","1.54184","CuKα","","0.0605","0.0507","","","0.1511","0.1611","","","","","","1.087","","","","has coordinates","301045","2025-07-06","17:31:47",""
"7063715","8.0626","0.0001","11.5694","0.0002","21.4689","0.0004","84.525","0.001","80.973","0.001","76.353","0.001","1918.41","0.06","297","","297","","","","","","","","","5","P -1","-P 1","2","","","","- C60 H56 Co5 N4 O44 -","- C60 H56 Co5 N4 O44 -","- C60 H56 Co5 N4 O44 -","1","0.5","","Mao, Yu-Ling; Yu, Jia; Shan, Bo-Yu; Liu, Xin-Xin; Chu, Jing-Ying; Ma, Xin-Yue; Li, Miao; Zheng, Yi-Meng; Zhu, Bai-Li; Zuo, Ming-Hui; Cui, Shu-Xin","A novel naphthalene diimide cobalt coordination polymer: synthesis, photo/electric/dehydration discoloration, amine sensing, and magnetism","New Journal of Chemistry","2025","49","17","7126","7133","10.1039/D5NJ00024F","","","1.54184","CuKα","","0.0761","0.0698","","","0.2137","0.2179","","","","","","1.096","","","","has coordinates","301045","2025-07-06","17:31:48",""
"7063716","9.71","0.005","10.172","0.005","11.173","0.005","89.007","0.012","82.504","0.013","76.151","0.014","1062.2","0.9","273","2","273.15","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H50 Cl2 Cu2 N8 O18 -","- C34 H50 Cl2 Cu2 N8 O18 -","- C34 H50 Cl2 Cu2 N8 O18 -","1","0.5","","Basak, Swati; Das, Pranjal; Kuilya, Hemrupa; Choudhury, Diganta; Kalita, Apurba","Electrocatalytic water oxidation activity of phenolate-bridged dinuclear copper(ii) complexes in alkaline phosphate buffer","New Journal of Chemistry","2025","49","17","7134","7139","10.1039/D5NJ00742A","","","0.71073","MoKα","","0.1318","0.0597","","","0.1186","0.1526","","","","","","1.007","","","","has coordinates","301044","2025-07-06","17:31:39",""
"7063717","10.1663","0.0005","11.4731","0.0005","14.2943","0.0006","88.941","0.002","80.613","0.002","72.078","0.002","1564.23","0.12","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H64 Cl4 Cu4 N8 O22 -","- C56 H64 Cl4 Cu4 N8 O22 -","- C56 H64 Cl4 Cu4 N8 O22 -","1","0.5","","Basak, Swati; Das, Pranjal; Kuilya, Hemrupa; Choudhury, Diganta; Kalita, Apurba","Electrocatalytic water oxidation activity of phenolate-bridged dinuclear copper(ii) complexes in alkaline phosphate buffer","New Journal of Chemistry","2025","49","17","7134","7139","10.1039/D5NJ00742A","","","0.71073","MoKα","","0.0513","0.0386","","","0.0993","0.107","","","","","","1.055","","","","has coordinates","301044","2025-07-06","17:31:39",""
"7063718","45.899","0.006","17.4621","0.0017","33.535","0.004","90","","132.477","0.005","90","","19824","4","273.15","","273.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C102 H98 Cd3 N20 O12 S6 -","- C78 H42 Cd3 N12 O12 S6 -","- C624 H336 Cd24 N96 O96 S48 -","8","1","","Li, Jun-Fei; Xu, Jing-Wen; Feng, Hui-Jun; Liu, Qiao-Yun; Wang, Jun-Wen","Thiazolothiazole-based metal–organic frameworks for photocatalytic coupling of benzylamine and degradation of organic dyes","New Journal of Chemistry","2025","49","16","6838","6845","10.1039/D5NJ00340G","","","0.71073","MoKα","","0.1503","0.0797","","","0.1851","0.2102","","","","","","1.079","","","","has coordinates","301053","2025-07-06","17:33:28",""
"7063719","12.8769","0.0005","14.4049","0.0006","14.4244","0.0006","90","","100.355","0.002","90","","2632.01","0.19","273.15","","273.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H19 Cd N5 O5 S2 -","- C22 H12 Cd N4 O4 S2 -","- C88 H48 Cd4 N16 O16 S8 -","4","1","","Li, Jun-Fei; Xu, Jing-Wen; Feng, Hui-Jun; Liu, Qiao-Yun; Wang, Jun-Wen","Thiazolothiazole-based metal–organic frameworks for photocatalytic coupling of benzylamine and degradation of organic dyes","New Journal of Chemistry","2025","49","16","6838","6845","10.1039/D5NJ00340G","","","1.54178","CuKα","","0.044","0.0339","","","0.0865","0.0912","","","","","","1.016","","","","has coordinates","301053","2025-07-06","17:33:28",""
"7063720","17.2315","0.0009","24.0207","0.0013","17.5271","0.0009","90","","108.105","0.003","90","","6895.5","0.6","273.15","","273.15","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C127 H99 Cd4 N21 O16 S8 -","- C112 H64 Cd4 N16 O16 S8 -","- C224 H128 Cd8 N32 O32 S16 -","2","1","","Li, Jun-Fei; Xu, Jing-Wen; Feng, Hui-Jun; Liu, Qiao-Yun; Wang, Jun-Wen","Thiazolothiazole-based metal–organic frameworks for photocatalytic coupling of benzylamine and degradation of organic dyes","New Journal of Chemistry","2025","49","16","6838","6845","10.1039/D5NJ00340G","","","1.54178","CuKα","","0.1289","0.0885","","","0.1959","0.2267","","","","","","0.889","","","","has coordinates,has disorder","301053","2025-07-06","17:33:28",""
"7063721","9.6923","0.0002","25.6469","0.0005","10.1345","0.0002","90","","105.072","0.002","90","","2432.55","0.09","99.99","0.1","99.99","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H26 O4 S -","- C31 H26 O4 S -","- C124 H104 O16 S4 -","4","1","","Sun, Lidan; Xu, Mengze; Feng, Yurou; Lin, Quanjie; Xie, Xiaolan; Shen, Jinhai; Chen, Zhichao","Photoredox-catalyzed synthesis of sulfonated dihydrofurans from olefinic carbonyls through the insertion of sulfur dioxide","New Journal of Chemistry","2025","49","17","7268","7272","10.1039/D5NJ00238A","","x-ray","1.54184","CuKα","","0.0428","0.0376","","","0.0981","0.1014","","","","","","1.06","","","","has coordinates","301046","2025-07-06","17:31:55",""
"7063722","16.609","0.002","16.609","0.002","14.325","0.003","90","","90","","120","","3422.3","0.9","","","","","","","","","","","","5","P 63/m c m","-P 6c 2","193","","","","- C45 H54 N6 Ni3 O24 -","- C423 H621 N36 Ni21 O168 -","- C846 H1242 N72 Ni42 O336 -","2","0.0833333","","Yang, Tinghai; Xiao, Rengui; Lu, Fenglian; Ke, Xiang; Wang, Mengxia; Wang, Keliang","Conductivity enhancement mechanism and application of NiCo-MOF hollow sphere electrode materials in lithium-ion batteries","New Journal of Chemistry","2025","49","16","6674","6683","10.1039/D5NJ00121H","","","","","","","","","","","","","","","","","","","","","has coordinates","301056","2025-07-06","17:34:15",""
"7063723","7.9402","0.0003","10.2062","0.0003","12.5527","0.0004","93.564","0.001","94.678","0.001","111.087","0.001","941.39","0.05","120","","120","","","","","","","","","4","P -1","-P 1","2","","Lenalidomide melamine methanol hemihydrate","","- C17 H24 N9 O4.5 -","- C17 H24 N9 O4.5 -","- C34 H48 N18 O9 -","2","1","","Screen, Martin A.; Tomkinson, Gary; McCabe, James F.; Askin, Sean; Mahon, Clare S.; Wilson, Mark R.; Steed, Jonathan W.","Designing lenalidomide cocrystals with an extended-release profile for improved pulmonary drug delivery","New Journal of Chemistry","2025","49","16","6535","6543","10.1039/D5NJ00425J","","x-ray","0.71073","MoKα","","0.0943","0.08","","","0.1738","0.1816","","","","","","1.128","","","","has coordinates,has disorder","301055","2025-07-06","17:33:59",""
"7063724","26.529","0.0004","26.529","0.0004","26.529","0.0004","90","","90","","90","","18670.8","0.5","143","2","143","2","","","","","","","","6","I -4 3 d","I -4bd 2c 3","220","","","","- C78 H88.2 Dy2 N6 O35.1 P6 -","- C78 H72 Dy2 N6 O35.1 P6 -","- C624 H576 Dy16 N48 O280.8 P48 -","8","0.166667","","Slobodskaia, Serafima S.; Efimov, Nikolay N.; Galkina, Alina S.; Tsebrikova, Galina S.; Ilyukhin, Andrey B.; Ivanova, Irina S.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Magnetic properties of 3D lanthanide complexes with 1,3-bis(diphenylphosphoryl)-2-oxapropane: the slow magnetic relaxation of Yb3+ compounds","New Journal of Chemistry","2025","49","18","7451","7458","10.1039/D5NJ00123D","","","0.71073","MoKα","","0.0195","0.0167","","","0.0437","0.0452","","","","","","0.99","","","","has coordinates,has disorder","301068","2025-07-06","17:37:48",""
"7063725","26.525","0.0016","26.525","0.0016","26.525","0.0016","90","","90","","90","","18662.3","1.9","100","2","100","2","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C78 H87.24 N6 O34.62 P6 Y1.68 Yb0.32 -","- C78 H72 N6 O34.62 P6 Y1.68 Yb0.32 -","- C624 H576 N48 O276.96 P48 Y13.44 Yb2.56 -","8","0.166667","","Slobodskaia, Serafima S.; Efimov, Nikolay N.; Galkina, Alina S.; Tsebrikova, Galina S.; Ilyukhin, Andrey B.; Ivanova, Irina S.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Magnetic properties of 3D lanthanide complexes with 1,3-bis(diphenylphosphoryl)-2-oxapropane: the slow magnetic relaxation of Yb3+ compounds","New Journal of Chemistry","2025","49","18","7451","7458","10.1039/D5NJ00123D","","","0.71073","MoKα","","0.0359","0.0332","","","0.0819","0.083","","","","","","1.121","","","","has coordinates,has disorder","301068","2025-07-06","17:37:48",""
"7063726","26.5165","0.0011","26.5165","0.0011","26.5165","0.0011","90","","90","","90","","18644.4","1.3","100","2","100","2","","","","","","","","6","I -4 3 d","I -4bd 2c 3","220","","","","- C78 H89.28 N6 O35.64 P6 Y2 -","- C78 H72 N6 O35.64 P6 Y2 -","- C624 H576 N48 O285.12 P48 Y16 -","8","0.166667","","Slobodskaia, Serafima S.; Efimov, Nikolay N.; Galkina, Alina S.; Tsebrikova, Galina S.; Ilyukhin, Andrey B.; Ivanova, Irina S.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Magnetic properties of 3D lanthanide complexes with 1,3-bis(diphenylphosphoryl)-2-oxapropane: the slow magnetic relaxation of Yb3+ compounds","New Journal of Chemistry","2025","49","18","7451","7458","10.1039/D5NJ00123D","","","0.71073","MoKα","","0.0249","0.0234","","","0.0725","0.0734","","","","","","0.996","","","","has coordinates,has disorder","301068","2025-07-06","17:37:48",""
"7063727","26.2926","0.001","26.2926","0.001","26.2926","0.001","90","","90","","90","","18176.1","1.2","100","2","100","2","","","","","","","","6","I -4 3 d","I -4bd 2c 3","220","","","","- C78 H84 N6 O33 P6 Yb2 -","- C78 H72 N6 O33 P6 Yb2 -","- C624 H576 N48 O264 P48 Yb16 -","8","0.166667","","Slobodskaia, Serafima S.; Efimov, Nikolay N.; Galkina, Alina S.; Tsebrikova, Galina S.; Ilyukhin, Andrey B.; Ivanova, Irina S.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Magnetic properties of 3D lanthanide complexes with 1,3-bis(diphenylphosphoryl)-2-oxapropane: the slow magnetic relaxation of Yb3+ compounds","New Journal of Chemistry","2025","49","18","7451","7458","10.1039/D5NJ00123D","","","0.71073","MoKα","","0.0183","0.0158","","","0.0453","0.0468","","","","","","0.9","","","","has coordinates,has disorder","301068","2025-07-06","17:37:48",""
"7063728","26.65","0.005","26.65","0.005","26.65","0.005","90","","90","","90","","18927","6","250","2","250","2","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C78 H85.36 Dy0.06 N6 O34.68 P6 Y1.94 -","- C78 H72 Dy0.056 N6 O34.68 P6 Y1.944 -","- C624 H576 Dy0.448 N48 O277.44 P48 Y15.552 -","8","0.166667","","Slobodskaia, Serafima S.; Efimov, Nikolay N.; Galkina, Alina S.; Tsebrikova, Galina S.; Ilyukhin, Andrey B.; Ivanova, Irina S.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Magnetic properties of 3D lanthanide complexes with 1,3-bis(diphenylphosphoryl)-2-oxapropane: the slow magnetic relaxation of Yb3+ compounds","New Journal of Chemistry","2025","49","18","7451","7458","10.1039/D5NJ00123D","","","0.71073","MoKα","","0.0304","0.0261","","","0.0607","0.0626","","","","","","1.102","","","","has coordinates,has disorder","301068","2025-07-06","17:37:48",""
"7063729","26.2405","0.0013","26.2405","0.0013","26.2405","0.0013","90","","90","","90","","18068.3","1.6","100","2","100","2","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C78 H78.96 Dy0.14 Lu1.86 N6 O30.48 P6 -","- C78 H72 Dy0.14 Lu1.86 N6 O30.48 P6 -","- C624 H576 Dy1.12 Lu14.88 N48 O243.84 P48 -","8","0.166667","","Slobodskaia, Serafima S.; Efimov, Nikolay N.; Galkina, Alina S.; Tsebrikova, Galina S.; Ilyukhin, Andrey B.; Ivanova, Irina S.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Magnetic properties of 3D lanthanide complexes with 1,3-bis(diphenylphosphoryl)-2-oxapropane: the slow magnetic relaxation of Yb3+ compounds","New Journal of Chemistry","2025","49","18","7451","7458","10.1039/D5NJ00123D","","","0.71073","MoKα","","0.0246","0.0198","","","0.0544","0.0599","","","","","","1.082","","","","has coordinates,has disorder","301068","2025-07-06","17:37:48",""
"7063730","26.4345","0.0011","26.4345","0.0011","26.4345","0.0011","90","","90","","90","","18472","1.3","100","2","100","2","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C78 H85.36 Dy0.06 N6 O34.68 P6 Y1.94 -","- C78 H72 Dy0.056 N6 O34.68 P6 Y1.944 -","- C624 H576 Dy0.448 N48 O277.44 P48 Y15.552 -","8","0.166667","","Slobodskaia, Serafima S.; Efimov, Nikolay N.; Galkina, Alina S.; Tsebrikova, Galina S.; Ilyukhin, Andrey B.; Ivanova, Irina S.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Magnetic properties of 3D lanthanide complexes with 1,3-bis(diphenylphosphoryl)-2-oxapropane: the slow magnetic relaxation of Yb3+ compounds","New Journal of Chemistry","2025","49","18","7451","7458","10.1039/D5NJ00123D","","","0.71073","MoKα","","0.0283","0.0259","","","0.0599","0.0608","","","","","","1.132","","","","has coordinates,has disorder","301068","2025-07-06","17:37:48",""
"7063731","9.5116","0.0003","5.7815","0.0002","21.912","0.0007","90","","97.532","0.003","90","","1194.57","0.07","150.01","0.1","150.01","0.1","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C12 H17 N O4 -","- C12 H17 N O4 -","- C48 H68 N4 O16 -","4","1","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Nandy, Rakhi; Aravena, Daniel","Impact of anionic co-ligands on nuclearity and single-molecule magnetism in a {CoIII2DyIII} trimeric and two {CoIII2DyIII2} tetrameric complexes","New Journal of Chemistry","2025","49","18","7576","7588","10.1039/D5NJ00766F","","","1.54184","CuKα","","0.0616","0.0547","","","0.1565","0.1634","","","","","","1.057","","","","has coordinates","301067","2025-07-06","17:36:20",""
"7063732","14.003","0.0005","14.0934","0.0004","15.8785","0.0005","90","","109.288","0.004","90","","2957.73","0.18","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H68 Co2 Dy2 N8 O22 -","- C48 H68 Co2 Dy2 N8 O22 -","- C96 H136 Co4 Dy4 N16 O44 -","2","0.5","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Nandy, Rakhi; Aravena, Daniel","Impact of anionic co-ligands on nuclearity and single-molecule magnetism in a {CoIII2DyIII} trimeric and two {CoIII2DyIII2} tetrameric complexes","New Journal of Chemistry","2025","49","18","7576","7588","10.1039/D5NJ00766F","","","0.71073","MoKα","","0.0412","0.0325","","","0.0734","0.0779","","","","","","1.03","","","","has coordinates","301067","2025-07-06","17:36:20",""
"7063733","27.9723","0.0009","10.8697","0.0003","24.8686","0.0006","90","","90.025","0.002","90","","7561.3","0.4","199.99","0.1","200.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C66 H56 Co2 Dy2 N8 O36 -","- C66 H56 Co2 Dy2 N8 O36 -","- C264 H224 Co8 Dy8 N32 O144 -","4","0.5","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Nandy, Rakhi; Aravena, Daniel","Impact of anionic co-ligands on nuclearity and single-molecule magnetism in a {CoIII2DyIII} trimeric and two {CoIII2DyIII2} tetrameric complexes","New Journal of Chemistry","2025","49","18","7576","7588","10.1039/D5NJ00766F","","","0.71073","MoKα","","0.0395","0.0319","","","0.0854","0.0893","","","","","","1.039","","","","has coordinates,has disorder","301067","2025-07-06","17:36:20",""
"7063734","12.9113","0.0003","13.2394","0.0003","19.7653","0.0004","102.619","0.002","101.993","0.002","97.689","0.002","3167.72","0.13","100.04","0.1","100.15","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H83 Co2 Dy N6 O25 -","- C54 H83 Co2 Dy N6 O25 -","- C108 H166 Co4 Dy2 N12 O50 -","2","1","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Nandy, Rakhi; Aravena, Daniel","Impact of anionic co-ligands on nuclearity and single-molecule magnetism in a {CoIII2DyIII} trimeric and two {CoIII2DyIII2} tetrameric complexes","New Journal of Chemistry","2025","49","18","7576","7588","10.1039/D5NJ00766F","","","0.71073","MoKα","","0.0753","0.0474","","","0.1105","0.1264","","","","","","1.026","","","","has coordinates,has disorder","301067","2025-07-06","17:36:20",""
"7063735","10.2412","0.00014","15.3376","0.0002","20.8758","0.0003","90","","90.2665","0.0012","90","","3279.04","0.08","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H40 N2 O3 -","- C38 H40 N2 O3 -","- C152 H160 N8 O12 -","4","1","","Xiang, Min; Lu, Lin-Mu; Feng, Guang-Yuan; Zhu, Shen-Xin; Luo, Si-Si; Wang, Guang-Wei; Jia, Yun-Qing; Shen, Li-Wen","Solvent- and temperature-controlled diastereodivergent [4+2] cyclization of p-QMs and 4-benzylidene-pyrazolones","New Journal of Chemistry","2025","49","18","7293","7296","10.1039/D5NJ00814J","","x-ray","1.54184","CuKα","","0.0596","0.0514","","","0.1462","0.156","","","","","","1.033","","","","has coordinates","301070","2025-07-06","17:38:16",""
"7063736","12.1444","0.0005","12.4946","0.0005","12.6801","0.0006","116.752","0.004","93.454","0.004","108.491","0.004","1581.91","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H40 N2 O3 -","- C38 H40 N2 O3 -","- C76 H80 N4 O6 -","2","1","","Xiang, Min; Lu, Lin-Mu; Feng, Guang-Yuan; Zhu, Shen-Xin; Luo, Si-Si; Wang, Guang-Wei; Jia, Yun-Qing; Shen, Li-Wen","Solvent- and temperature-controlled diastereodivergent [4+2] cyclization of p-QMs and 4-benzylidene-pyrazolones","New Journal of Chemistry","2025","49","18","7293","7296","10.1039/D5NJ00814J","","x-ray","1.54184","CuKα","","0.0631","0.054","","","0.1498","0.1614","","","","","","1.051","","","","has coordinates","301070","2025-07-06","17:38:16",""
"7063737","16.96514","0.00019","10.31317","0.0001","19.1239","0.0002","90","","106.771","0.0013","90","","3203.69","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H40 N2 O3 -","- C38 H40 N2 O3 -","- C152 H160 N8 O12 -","4","1","","Xiang, Min; Lu, Lin-Mu; Feng, Guang-Yuan; Zhu, Shen-Xin; Luo, Si-Si; Wang, Guang-Wei; Jia, Yun-Qing; Shen, Li-Wen","Solvent- and temperature-controlled diastereodivergent [4+2] cyclization of p-QMs and 4-benzylidene-pyrazolones","New Journal of Chemistry","2025","49","18","7293","7296","10.1039/D5NJ00814J","","x-ray","1.54184","CuKα","","0.0606","0.0506","","","0.1398","0.1511","","","","","","1.024","","","","has coordinates","301070","2025-07-06","17:38:16",""
"7063738","6.9084","0.0013","19.068","0.003","10.7534","0.0018","90","","94.741","0.017","90","","1411.7","0.4","393.15","","393.15","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C16 H10 B F2 N3 -","- C16 H10 B F2 N3 -","- C64 H40 B4 F8 N12 -","4","0.5","","Lin, Ming-Sui; Nie, Qing-Bin; Chen, Jia-Nan; Liu, Ze-Yu; Wu, Qiao-Yu; Liu, Xiao-Feng; Liu, Chao; Pan, Zhong-Hua; Xiao, Wang-Chuan; Luo, Geng-Geng","Synthesis, photophysics and photosensitizing hydrogen evolution of a near-infrared heavy-atom-free sensitizer","New Journal of Chemistry","2025","49","18","7647","7654","10.1039/D5NJ00537J","","","0.71073","MoKα","","0.0951","0.0548","","","0.1275","0.1466","","","","","","1.054","","","","has coordinates,has disorder","301071","2025-07-06","17:38:31",""
"7063739","19.6846","0.0002","18.4122","0.0001","29.7761","0.0002","90","","104.507","0.001","90","","10447.9","0.15","100.01","0.1","100","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","C56H28B2F4N6S8","","- C28 H14 B F2 N3 S4 -","- C28 H14 B F2 N3 S4 -","- C448 H224 B16 F32 N48 S64 -","16","2","","Lin, Ming-Sui; Nie, Qing-Bin; Chen, Jia-Nan; Liu, Ze-Yu; Wu, Qiao-Yu; Liu, Xiao-Feng; Liu, Chao; Pan, Zhong-Hua; Xiao, Wang-Chuan; Luo, Geng-Geng","Synthesis, photophysics and photosensitizing hydrogen evolution of a near-infrared heavy-atom-free sensitizer","New Journal of Chemistry","2025","49","18","7647","7654","10.1039/D5NJ00537J","","","1.54184","CuKα","","0.0447","0.0419","","","0.1","0.1018","","","","","","1.036","","","","has coordinates,has disorder","301071","2025-07-06","17:38:33",""
"7063740","12.6918","0.0003","12.885","0.0003","20.6351","0.0004","90","","90","","90","","3374.54","0.13","150","2","149.9","0.5","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C37 H33 N Ni O2 P2 S2 -","- C37 H33 N Ni O2 P2 S2 -","- C148 H132 N4 Ni4 O8 P8 S8 -","4","1","","Omoding, Daniel; Kushwaha, Aparna; Kociok-Köhn, Gabriele; Imran, Ahamad; Kumar, Abhinav","New heteroleptic tertiary phosphane-based Ni(ii) 3,4-dimethoxyphenylacetonitriledithiolates: bifunctional electrocatalysts for homogeneous HER and heterogeneous OER","New Journal of Chemistry","2025","49","18","7617","7629","10.1039/D5NJ01319D","","x-ray","0.71073","MoKα","","0.0541","0.043","","","0.0975","0.1057","","","","","","1.079","","","","has coordinates","301069","2025-07-06","17:38:03",""
"7063741","10.0461","0.0013","10.2685","0.0014","16.065","0.002","81.418","0.004","72.104","0.004","88.928","0.005","1558.7","0.4","273","2","273","2","","","","","","","","6","P -1","-P 1","2","Yttrium-Strontium-Organic Compound","","","- C24 H14 N5 O19 Sr Y -","- C24 H14 N5 O19 Sr Y -","- C48 H28 N10 O38 Sr2 Y2 -","2","1","","Majee, Prakash; Bid, Arpita; Singha, Debal Kanti; Das, Chhatan; Mahata, Partha; Panja, Sujit Sankar; Mondal, Sudip Kumar","Terbium doped heterometallic metal–organic compound with carboxylate and imidazole-containing ligands for naked-eye detection of nitro containing antibiotics","New Journal of Chemistry","2025","49","19","7852","7860","10.1039/D5NJ00640F","","","0.71073","MoKα","","0.0807","0.0694","","","0.1774","0.1832","","","","","","1.091","","","","has coordinates","301050","2025-07-06","17:32:39",""
"7063742","4.5746","0.0004","12.0177","0.0011","16.8741","0.0017","109.531","0.006","90.485","0.006","93.749","0.005","871.97","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H10 Hg I2 N4 O3 -","- C13 H10 Hg I2 N4 O3 -","- C26 H20 Hg2 I4 N8 O6 -","2","1","","Sheikh, Afzal Hussain; Choudhury, Rizwana Begum; Deb, Vishal Kumar; Shahnowaz, Toufique; Mukherjee, Souryadeep; Pramanick, Kousik; Kaminsky, Werner; Choudhury, Nurul Alam; Roy, Subhadip; Shukla, Rahul; Gurbanov, Atash V.; Mahmoudi, Ghodrat; Adhikari, Suman","Insights into the spodium bonding characteristics of a bactericidal Hg(ii) complex","New Journal of Chemistry","2025","49","19","7900","7909","10.1039/D5NJ00983A","","x-ray","0.71073","MoKα","","0.0515","0.0363","","","0.0797","0.0869","","","","","","1.041","","","","has coordinates","301048","2025-07-06","17:32:19",""
"7063743","10.0367","0.0003","18.6568","0.0005","13.0581","0.0005","90","","107.754","0.004","90","","2328.71","0.14","150","0.1","150.15","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C58 H49 Cl Cu N P2 -","- C58 H49 Cl Cu N P2 -","- C116 H98 Cl2 Cu2 N2 P4 -","2","1","","Gourkhede, Rani; Balakrishna, Maravanji S.","Iminophosphorano–phosphine based CuI complexes: utility in 1,3-dipolar azide–alkyne cycloaddition and A3-coupling reaction","New Journal of Chemistry","2025","49","19","7749","7757","10.1039/D5NJ00379B","","","0.71073","MoKα","","0.0477","0.0393","","","0.0839","0.0894","","","","","","1.044","","","","has coordinates","301049","2025-07-06","17:32:30",""
"7063744","10.4126","0.0003","19.2175","0.0005","13.0188","0.0005","90","","108.95","0.004","90","","2463.92","0.15","150","0.1","150","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C58 H49 Cu I N P2 -","- C58 H49 Cu I N P2 -","- C116 H98 Cu2 I2 N2 P4 -","2","1","","Gourkhede, Rani; Balakrishna, Maravanji S.","Iminophosphorano–phosphine based CuI complexes: utility in 1,3-dipolar azide–alkyne cycloaddition and A3-coupling reaction","New Journal of Chemistry","2025","49","19","7749","7757","10.1039/D5NJ00379B","","x-ray","0.71073","MoKα","","0.046","0.0353","","","0.0694","0.0752","","","","","","1.038","","","","has coordinates","301049","2025-07-06","17:32:31",""
"7063745","19.9265","0.0003","12.6727","0.0003","19.4682","0.0004","90","","90","","90","","4916.16","0.17","109","0.1","109","0.1","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C59 H51 Br Cl2 Cu N P2 -","- C59 H51 Br Cl2 Cu N P2 -","- C236 H204 Br4 Cl8 Cu4 N4 P8 -","4","1","","Gourkhede, Rani; Balakrishna, Maravanji S.","Iminophosphorano–phosphine based CuI complexes: utility in 1,3-dipolar azide–alkyne cycloaddition and A3-coupling reaction","New Journal of Chemistry","2025","49","19","7749","7757","10.1039/D5NJ00379B","","x-ray","0.71073","MoKα","","0.0555","0.0417","","","0.0966","0.1043","","","","","","1.032","","","","has coordinates","301049","2025-07-06","17:32:31",""
"7063746","13.5702","0.0007","9.8185","0.0004","10.5082","0.0006","90","","109.874","0.006","90","","1316.72","0.13","290","4","290","4","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 N O -","- C16 H16 N O -","- C64 H64 N4 O4 -","4","1","","Gourkhede, Rani; Balakrishna, Maravanji S.","Iminophosphorano–phosphine based CuI complexes: utility in 1,3-dipolar azide–alkyne cycloaddition and A3-coupling reaction","New Journal of Chemistry","2025","49","19","7749","7757","10.1039/D5NJ00379B","","x-ray","0.71073","MoKα","","0.0615","0.0513","","","0.1281","0.1373","","","","","","1.06","","","","has coordinates","301049","2025-07-06","17:32:31",""
"7063747","9.665","0.006","7.192","0.004","7.917","0.004","90","","97.76","0.02","90","","545.3","0.5","100","","100","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C10 H4 Cl2 Co N2 O4 -","- C10 H4 Cl2 Co N2 O4 -","- C20 H8 Cl4 Co2 N4 O8 -","2","0.25","","Gupta, Arindam; Bhatt, Pramod; Konar, Sanjit","An infinite 2D sheet of tetragonal CoII framework exhibiting metamagnetism","New Journal of Chemistry","2025","49","20","8225","8231","10.1039/D5NJ00157A","","","0.71073","MoKα","","0.125","0.0701","","","0.1584","0.182","","","","","","1.088","","","","has coordinates","301064","2025-07-06","17:35:40",""
"7063748","8.6518","0.0018","9.8559","0.002","12.7821","0.0026","98.475","0.007","96.516","0.007","100.753","0.007","1047.9","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H44 Cu2 N8 P2 -","- C44 H44 Cu2 N8 P2 -","- C44 H44 Cu2 N8 P2 -","1","0.5","","Ferraro, Valentina; Gan, Xuemin; Rehak, Florian R.; Ralle, Philipp; Nieger, Martin; Steffen, Andreas; Klopper, Wim; Bräse, Stefan","Blue to yellow-emitting neutral Cu(i) complexes with μ-bridging 1,2,4-triazole: synthesis, photophysical characterization and DFT calculations","New Journal of Chemistry","2025","49","29","12468","12475","10.1039/D5NJ01056J","","","1.54178","CuKα","","0.0407","0.037","","","0.1015","0.1072","","","","","","1.045","","","","has coordinates","301614","2025-08-05","22:20:10",""
"7063749","13.076","0.0007","18.0781","0.001","24.0237","0.0013","90","","103.115","0.002","90","","5530.8","0.5","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C53 H64 Cl2 Cu2 N8 O P2 -","- C53 H64 Cl2 Cu2 N8 O P2 -","- C212 H256 Cl8 Cu8 N32 O4 P8 -","4","1","","Ferraro, Valentina; Gan, Xuemin; Rehak, Florian R.; Ralle, Philipp; Nieger, Martin; Steffen, Andreas; Klopper, Wim; Bräse, Stefan","Blue to yellow-emitting neutral Cu(i) complexes with μ-bridging 1,2,4-triazole: synthesis, photophysical characterization and DFT calculations","New Journal of Chemistry","2025","49","29","12468","12475","10.1039/D5NJ01056J","","","1.54178","CuKα","","0.0411","0.0394","","","0.1139","0.1163","","","","","","1.025","","","","has coordinates","301614","2025-08-05","22:20:14",""
"7063750","8.6661","0.0014","10.8999","0.0017","12.625","0.002","94.687","0.007","109.046","0.007","90.99","0.007","1122.3","0.3","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H42 Cu2 F4 N8 O P2 -","- C44 H40 Cu2 F4 N8 P2 -","- C44 H40 Cu2 F4 N8 P2 -","1","0.5","","Ferraro, Valentina; Gan, Xuemin; Rehak, Florian R.; Ralle, Philipp; Nieger, Martin; Steffen, Andreas; Klopper, Wim; Bräse, Stefan","Blue to yellow-emitting neutral Cu(i) complexes with μ-bridging 1,2,4-triazole: synthesis, photophysical characterization and DFT calculations","New Journal of Chemistry","2025","49","29","12468","12475","10.1039/D5NJ01056J","","","1.54178","CuKα","","0.0644","0.0559","","","0.1463","0.1544","","","","","","1.053","","","","has coordinates","301614","2025-08-05","22:20:14",""
"7063751","10.0042","0.0002","16.6493","0.0003","13.2435","0.0002","90","","100.156","0.001","90","","2171.31","0.07","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H48 Cu2 N8 P2 -","- C48 H48 Cu2 N8 P2 -","- C96 H96 Cu4 N16 P4 -","2","0.5","","Ferraro, Valentina; Gan, Xuemin; Rehak, Florian R.; Ralle, Philipp; Nieger, Martin; Steffen, Andreas; Klopper, Wim; Bräse, Stefan","Blue to yellow-emitting neutral Cu(i) complexes with μ-bridging 1,2,4-triazole: synthesis, photophysical characterization and DFT calculations","New Journal of Chemistry","2025","49","29","12468","12475","10.1039/D5NJ01056J","","","1.54178","CuKα","","0.0354","0.0347","","","0.095","0.0957","","","","","","1.105","","","","has coordinates","301614","2025-08-05","22:20:14",""
"7063752","11.9021","0.0006","13.9102","0.0007","12.7558","0.0006","90","","96.78","0.002","90","","2097.09","0.18","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H42 Cu2 N10 P2 -","- C42 H42 Cu2 N10 P2 -","- C84 H84 Cu4 N20 P4 -","2","0.5","","Ferraro, Valentina; Gan, Xuemin; Rehak, Florian R.; Ralle, Philipp; Nieger, Martin; Steffen, Andreas; Klopper, Wim; Bräse, Stefan","Blue to yellow-emitting neutral Cu(i) complexes with μ-bridging 1,2,4-triazole: synthesis, photophysical characterization and DFT calculations","New Journal of Chemistry","2025","49","29","12468","12475","10.1039/D5NJ01056J","","","1.54178","CuKα","","0.0285","0.0278","","","0.0779","0.0786","","","","","","1.051","","","","has coordinates","301614","2025-08-05","22:20:14",""
"7063753","14.2166","0.0006","18.8967","0.0007","11.7669","0.0005","90","","101.305","0.002","90","","3099.8","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 Cu F12 N3 O7 -","- C24 H22 Cu F12 N3 O7 -","- C96 H88 Cu4 F48 N12 O28 -","4","1","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.1256","0.0423","","","0.0764","0.0927","","","","","","0.799","","","","has coordinates,has disorder","301072","2025-07-06","17:39:19",""
"7063754","10.6583","0.0003","11.4385","0.0004","14.7135","0.0004","101.619","0.0014","91.641","0.0015","117.015","0.0014","1550.43","0.08","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H44 Cu2 F24 N6 O14 -","- C48 H44 Cu2 F24 N6 O14 -","- C48 H44 Cu2 F24 N6 O14 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.0506","0.0425","","","0.1156","0.1249","","","","","","1.021","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063755","9.9004","0.0006","11.1739","0.0007","15.218","0.0009","94.67","0.003","105.3","0.003","113.986","0.003","1449.21","0.16","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H17 Br Cu F12 N3 O6 -","- C22 H17 Br Cu F12 N3 O6 -","- C44 H34 Br2 Cu2 F24 N6 O12 -","2","1","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.06","0.0556","","","0.1673","0.1701","","","","","","1.074","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063756","10.0433","0.0007","11.4576","0.0008","15.501","0.0011","70.884","0.003","83.932","0.003","67.474","0.003","1556.39","0.19","240","2","240","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H24 Cu F12 N3 O6 -","- C25 H24 Cu F12 N3 O6 -","- C50 H48 Cu2 F24 N6 O12 -","2","1","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.0405","0.0379","","","0.1048","0.1078","","","","","","1.027","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063757","9.8746","0.0003","11.1848","0.0003","15.1435","0.0004","94.536","0.002","105.712","0.002","113.245","0.001","1446.28","0.07","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H34 Cl2 Cu2 F24 N6 O12 -","- C44 H34 Cl2 Cu2 F24 N6 O12 -","- C44 H34 Cl2 Cu2 F24 N6 O12 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.071","0.041","","","0.0977","0.1074","","","","","","0.932","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063758","12.9249","0.0011","15.5532","0.0013","19.602","0.0017","97.26","0.004","108.948","0.005","113.736","0.004","3257.8","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H24 Cu F12 N3 O6 -","- C25 H24 Cu F12 N3 O6 -","- C100 H96 Cu4 F48 N12 O24 -","4","2","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.0968","0.0486","","","0.1305","0.1547","","","","","","1.039","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063759","10.126","0.0002","11.9623","0.0004","15.7188","0.0004","93.6043","0.0016","108.714","0.0011","115.597","0.0011","1580.48","0.08","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.0538","0.0484","","","0.1246","0.1293","","","","","","1.046","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063760","14.4037","0.0009","14.0717","0.0009","16.2483","0.001","90","","115.139","0.004","90","","2981.3","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H40 Cu2 F24 N6 O14 -","- C46 H40 Cu2 F24 N6 O14 -","- C92 H80 Cu4 F48 N12 O28 -","2","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.0799","0.0362","","","0.0747","0.0837","","","","","","0.857","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063761","10.1299","0.0003","11.8398","0.0003","15.6339","0.0004","93.9306","0.0013","108.441","0.0012","115.341","0.0012","1561.48","0.08","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.0498","0.0465","","","0.1227","0.1256","","","","","","1.063","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063762","10.1333","0.0003","11.757","0.0004","15.5832","0.0005","94.2706","0.0015","108.246","0.0015","115.187","0.0014","1548.26","0.09","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.0476","0.044","","","0.1145","0.1175","","","","","","1.031","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063763","10.3312","0.0005","11.2769","0.0006","15.3209","0.0007","72.939","0.003","72.059","0.003","64.992","0.003","1511.14","0.14","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.0896","0.0503","","","0.1134","0.1331","","","","","","1.005","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063764","13.56","0.004","13.632","0.004","15.472","0.005","108.589","0.006","95.635","0.006","108.934","0.005","2498.4","1.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H30 Cu2 F24 N3 O10 -","- C38 H30 Cu2 F24 N3 O10 -","- C76 H60 Cu4 F48 N6 O20 -","2","1","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.094","0.0398","","","0.0859","0.1003","","","","","","0.822","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063765","10.3236","0.0008","11.3283","0.0009","15.4538","0.0012","72.418","0.005","71.96","0.005","65.621","0.004","1533.2","0.2","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.0912","0.0544","","","0.1322","0.1472","","","","","","1.048","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063766","10.1211","0.0005","11.8936","0.0007","15.7645","0.0008","94.128","0.004","108.514","0.004","114.163","0.004","1596.44","0.17","240","2","240","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.1032","0.0618","","","0.1556","0.1812","","","","","","1.022","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063767","12.8787","0.0004","15.4515","0.0005","19.9472","0.0007","69.652","0.002","71.759","0.002","66.608","0.002","3344.5","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C108 H104 Cu4 F48 N12 O24 -","- C108 H104 Cu4 F48 N12 O24 -","- C108 H104 Cu4 F48 N12 O24 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.1822","0.0537","","","0.1113","0.1505","","","","","","0.955","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063768","10.3383","0.0009","11.3546","0.001","15.5573","0.0014","72.304","0.005","71.704","0.005","66.374","0.005","1554.9","0.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.0852","0.0504","","","0.1301","0.1508","","","","","","1.036","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063769","10.129","0.0006","11.3259","0.0007","15.4203","0.0009","97.324","0.003","103.008","0.004","116.335","0.003","1491.47","0.17","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H34 Cu2 F30 N6 O12 -","- C46 H34 Cu2 F30 N6 O12 -","- C46 H34 Cu2 F30 N6 O12 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.1296","0.046","","","0.0957","0.1141","","","","","","0.84","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063770","10.3562","0.0006","11.3841","0.0007","15.6769","0.0009","72.469","0.003","71.725","0.003","67.095","0.003","1582.36","0.17","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","- C52 H40 Cu2 F24 N6 O12 S2 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","0.71073","MoKα","","0.0972","0.0459","","","0.116","0.1324","","","","","","0.935","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063771","10.1383","0.0004","11.9217","0.0005","15.8104","0.0006","94.3542","0.0018","108.319","0.0016","113.697","0.0018","1615.55","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","- C56 H44 Cu2 F24 N6 O12 -","1","0.5","","Tolstikov, Svyatoslav E.; Kolesnikov, Andrey E.; Smirnova, Kristina A.; Letyagin, Gleb A.; Bogomyakov, Artem S.; Romanenko, Galina V.; Ovcharenko, Victor I.","Heterospin molecular complexes of Cu(hfac)2 with pyridyl-substituted nitronyl nitroxides: peculiarities of structure and magnetic properties","New Journal of Chemistry","2025","49","18","7655","7660","10.1039/D5NJ00967G","","","1.54178","CuKα","","0.0578","0.051","","","0.1451","0.1514","","","","","","1.046","","","","has coordinates,has disorder","301072","2025-07-06","17:39:21",""
"7063772","6.229","0.0007","8.9609","0.0011","17.0384","0.0019","103.426","0.003","94.535","0.003","100.782","0.003","901.22","0.18","273.15","","273.15","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H16 O -","- C27 H16 O -","- C54 H32 O2 -","2","1","","Ji, Yao; Meng, Xin; Han, Jia’ao; Liu, Yanchen; Tang, Jian; He, Yuanchun; Zhang, Ensheng; Zhang, Xiaoxiang; Cao, Ziping","Dual space-conjugated pyrene-based ketone exhibits dual state-tuned emission wavelengths and enhanced circularly polarized luminescence","New Journal of Chemistry","2025","49","20","8428","8436","10.1039/D4NJ05310A","","","0.71073","MoKα","","0.0968","0.0465","","","0.1107","0.1367","","","","","","1.019","","","","has coordinates","301065","2025-07-06","17:35:50",""
"7063773","8.1952","0.0009","8.1952","0.0009","52.758","0.008","90","","90","","90","","3543.3","0.8","273.15","","273.15","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- C54 H30 O2 -","- C54 H30 O2 -","- C216 H120 O8 -","4","0.5","","Ji, Yao; Meng, Xin; Han, Jia’ao; Liu, Yanchen; Tang, Jian; He, Yuanchun; Zhang, Ensheng; Zhang, Xiaoxiang; Cao, Ziping","Dual space-conjugated pyrene-based ketone exhibits dual state-tuned emission wavelengths and enhanced circularly polarized luminescence","New Journal of Chemistry","2025","49","20","8428","8436","10.1039/D4NJ05310A","","","0.71073","MoKα","","0.0793","0.0537","","","0.1328","0.147","","","","","","1.063","","","","has coordinates","301065","2025-07-06","17:35:50",""
"7063774","5.053","0.002","10.6","0.005","14.685","0.006","106.032","0.015","95.71","0.015","91.249","0.016","751.2","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H12 F3 N O2 -","- C18 H12 F3 N O2 -","- C36 H24 F6 N2 O4 -","2","1","","Chávez-Vega, Tomás; Galdámez, Antonio; Lühr, Susan; Vilches-Herrera, Marcelo","Photocatalytic Heck–Matsuda reaction: selective arylation of N-vinyl- and N-allyl-lactams using Pd2(dba)3","New Journal of Chemistry","2025","49","22","9416","9420","10.1039/D4NJ05413J","","","0.71073","MoKα","","0.1391","0.096","","","0.2706","0.3154","","","","","","1.071","","","","has coordinates","301031","2025-07-06","17:28:46",""
"7063775","7.3502","0.0019","14.305","0.004","17.919","0.005","89.373","0.01","86.466","0.01","79.435","0.01","1848.6","0.9","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H12 Cl2 N8 O2 Zn -","- C14 H12 Cl2 N8 O2 Zn -","- C56 H48 Cl8 N32 O8 Zn4 -","4","2","","Gnanadeepam, Yakkobu; Shankar, Bhaskaran; Tamilselvi, Arunachalam","Anticancer activity: synthesis, characterization and DNA binding of a 1,2,4-triazole-based Zn(ii) complex","New Journal of Chemistry","2025","49","20","8215","8224","10.1039/D4NJ05463F","","","0.71073","MoKα","","0.0314","0.029","","","0.076","0.0772","","","","","","1.088","","","","has coordinates","301062","2025-07-06","17:35:26",""
"7063776","5.4928","0.0001","9.4925","0.0003","14.3453","0.0005","90","","98.819","0.003","90","","739.13","0.04","298.69","0.18","298.69","0.18","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 N4 O -","- C7 H6 N4 O -","- C28 H24 N16 O4 -","4","1","","Gnanadeepam, Yakkobu; Shankar, Bhaskaran; Tamilselvi, Arunachalam","Anticancer activity: synthesis, characterization and DNA binding of a 1,2,4-triazole-based Zn(ii) complex","New Journal of Chemistry","2025","49","20","8215","8224","10.1039/D4NJ05463F","","x-ray","0.71073","MoKα","","0.0471","0.0419","","","0.1107","0.1163","","","","","","1.104","","","","has coordinates","301062","2025-07-06","17:35:26",""
"7063777","10.9568","0.0003","11.8761","0.0003","22.773","0.0007","80.457","0.001","76.703","0.001","70.941","0.001","2712.51","0.13","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H42 F9 O11 P2 Tb -","- C60 H42 F9 O11 P2 Tb -","- C120 H84 F18 O22 P4 Tb2 -","2","1","","Polikovskiy, Trofim A.; Gontcharenko, Victoria E.; Ivanova, Anna A.; Metlina, Darya A.; Kiskin, Mikhail A.; Taydakov, Ilya V.; Belousov, Yury A.","Real world luminescence thermometry through a novel mixed-metal Eu/Tb complex with furan-containing 1,3-diketone","New Journal of Chemistry","2025","49","22","9214","9225","10.1039/D5NJ00914F","","","0.71073","MoKα","","0.0638","0.0455","","","0.0899","0.0958","","","","","","1.028","","","","has coordinates","301032","2025-07-06","17:28:57",""
"7063778","10.9872","0.0006","11.9498","0.0007","22.8307","0.0013","80.381","0.002","76.839","0.002","70.971","0.002","2745.2","0.3","296.15","","296.15","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H42 Eu F9 O11 P2 -","- C60 H42 Eu F9 O11 P2 -","- C120 H84 Eu2 F18 O22 P4 -","2","1","","Polikovskiy, Trofim A.; Gontcharenko, Victoria E.; Ivanova, Anna A.; Metlina, Darya A.; Kiskin, Mikhail A.; Taydakov, Ilya V.; Belousov, Yury A.","Real world luminescence thermometry through a novel mixed-metal Eu/Tb complex with furan-containing 1,3-diketone","New Journal of Chemistry","2025","49","22","9214","9225","10.1039/D5NJ00914F","","","0.71073","MoKα","","0.0635","0.0443","","","0.0738","0.0843","","","","","","1.09","","","","has coordinates","301032","2025-07-06","17:29:06",""
"7063779","11.0181","0.0006","11.9586","0.0006","22.8961","0.0012","80.485","0.002","76.757","0.002","70.868","0.002","2761","0.3","296.15","","296.15","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H42 F9 Gd O11 P2 -","- C60 H42 F9 Gd O11 P2 -","- C120 H84 F18 Gd2 O22 P4 -","2","1","","Polikovskiy, Trofim A.; Gontcharenko, Victoria E.; Ivanova, Anna A.; Metlina, Darya A.; Kiskin, Mikhail A.; Taydakov, Ilya V.; Belousov, Yury A.","Real world luminescence thermometry through a novel mixed-metal Eu/Tb complex with furan-containing 1,3-diketone","New Journal of Chemistry","2025","49","22","9214","9225","10.1039/D5NJ00914F","","","0.71073","MoKα","","0.0665","0.0435","","","0.0712","0.0825","","","","","","1.054","","","","has coordinates","301032","2025-07-06","17:29:07",""
"7063780","16.768","0.0009","7.8383","0.0003","17.1786","0.001","90","","109.761","0.006","90","","2124.9","0.2","296.15","0.1","296.15","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 S2 -","- C28 H22 S2 -","- C112 H88 S8 -","4","1","","Shen, Shan-Shan; Xiao, Ya-Ting; Bai, Zhe-Hao; Gan, Zi-Yang; Ding, Ye-Hao; Yan, Jian-Feng; Li, Yuan-Ming; Geng, Yan-Hou; Yuan, Yao-Feng","Synthesis, structure and electronic transport properties of phenanthrenone derivatives","New Journal of Chemistry","2025","49","22","9177","9184","10.1039/D5NJ00857C","","x-ray","0.71073","MoKα","","0.0806","0.0483","","","0.1077","0.1208","","","","","","1.063","","","","has coordinates","301028","2025-07-06","17:28:03",""
"7063781","10.2762","0.0005","11.0227","0.0004","11.6637","0.0006","65.358","0.004","84.73","0.004","63.792","0.004","1070.47","0.1","296.15","0.1","296.15","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C29 H22 S2 -","- C29 H22 S2 -","- C58 H44 S4 -","2","1","","Shen, Shan-Shan; Xiao, Ya-Ting; Bai, Zhe-Hao; Gan, Zi-Yang; Ding, Ye-Hao; Yan, Jian-Feng; Li, Yuan-Ming; Geng, Yan-Hou; Yuan, Yao-Feng","Synthesis, structure and electronic transport properties of phenanthrenone derivatives","New Journal of Chemistry","2025","49","22","9177","9184","10.1039/D5NJ00857C","","x-ray","0.71073","MoKα","","0.1294","0.0635","","","0.1246","0.1568","","","","","","1.038","","","","has coordinates","301028","2025-07-06","17:28:04",""
"7063782","10.1764","0.0006","11.0252","0.0009","11.7176","0.0008","66.231","0.007","86.74","0.005","63.175","0.007","1061.04","0.17","296.15","0.1","296.15","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C29 H20 O S2 -","- C29 H20 O S2 -","- C58 H40 O2 S4 -","2","1","","Shen, Shan-Shan; Xiao, Ya-Ting; Bai, Zhe-Hao; Gan, Zi-Yang; Ding, Ye-Hao; Yan, Jian-Feng; Li, Yuan-Ming; Geng, Yan-Hou; Yuan, Yao-Feng","Synthesis, structure and electronic transport properties of phenanthrenone derivatives","New Journal of Chemistry","2025","49","22","9177","9184","10.1039/D5NJ00857C","","x-ray","0.71073","MoKα","","0.1354","0.06","","","0.1107","0.1376","","","","","","1.037","","","","has coordinates","301028","2025-07-06","17:28:04",""
"7063783","10.2519","0.0008","10.7695","0.0006","12.0148","0.0006","66.426","0.005","85.195","0.005","64.595","0.007","1092.05","0.15","296.15","0.1","296.15","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C29 H22 O S2 -","- C29 H21.7 O S2 -","- C58 H43.4 O2 S4 -","2","1","","Shen, Shan-Shan; Xiao, Ya-Ting; Bai, Zhe-Hao; Gan, Zi-Yang; Ding, Ye-Hao; Yan, Jian-Feng; Li, Yuan-Ming; Geng, Yan-Hou; Yuan, Yao-Feng","Synthesis, structure and electronic transport properties of phenanthrenone derivatives","New Journal of Chemistry","2025","49","22","9177","9184","10.1039/D5NJ00857C","","x-ray","0.71073","MoKα","","0.1424","0.0631","","","0.1272","0.1558","","","","","","1.037","","","","has coordinates,has disorder","301028","2025-07-06","17:28:04",""
"7063784","6.7257","0.0001","20.8422","0.0004","20.1942","0.0004","90","","99.507","0.001","90","","2791.91","0.09","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 Ca3 O24 -","- C18 H30 Ca3 O24 -","- C72 H120 Ca12 O96 -","4","0.5","","Jin, Xiaoqi; Li, Zongqun; Ge, Jinlong; Zhu, Linlin; Liu, Caiyan; Li, Qiu; Liu, Jing; Yin, Chenlin; Su, Gaoyu","Rapid synthesis of MOF CaBTC using an ultrasonic irradiation method and its derivative materials for CO2 capture","New Journal of Chemistry","2025","49","22","9395","9407","10.1039/D5NJ00301F","","","0.71073","MoKα","","0.0625","0.0408","","","0.1029","0.1162","","","","","","0.947","","","","has coordinates","301034","2025-07-06","17:29:31",""
"7063785","9.2493","0.0005","23.7341","0.0013","10.6004","0.0005","90","","90","","90","","2327","0.2","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C6 H24 Cu I5 Mn N6 Pb -","- C6 H24 Cu I5 Mn N6 Pb -","- C24 H96 Cu4 I20 Mn4 N24 Pb4 -","4","1","","Ren, Taohong; Zhu, Hongjin; Yang, Xiao; Jia, Dingxian","Heterometallic lead-iodocuprate hybrids with transition-metal complexes: syntheses, structures, photoelectricity and photocatalysis","New Journal of Chemistry","2025","49","23","9669","9677","10.1039/D5NJ00483G","","","0.71073","MoKα","","0.05","0.0366","","","0.0645","0.0709","","","","","","0.956","","","","has coordinates","301073","2025-07-06","17:39:35",""
"7063786","9.2145","0.0018","23.643","0.005","10.589","0.002","90","","90","","90","","2306.9","0.8","223","2","223","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C6 H24 Cu Fe I5 N6 Pb -","- C6 H24 Cu Fe I5 N6 Pb -","- C24 H96 Cu4 Fe4 I20 N24 Pb4 -","4","1","","Ren, Taohong; Zhu, Hongjin; Yang, Xiao; Jia, Dingxian","Heterometallic lead-iodocuprate hybrids with transition-metal complexes: syntheses, structures, photoelectricity and photocatalysis","New Journal of Chemistry","2025","49","23","9669","9677","10.1039/D5NJ00483G","","","0.71073","MoKα","","0.0473","0.0385","","","0.0668","0.0693","","","","","","1.114","","","","has coordinates","301073","2025-07-06","17:39:35",""
"7063787","9.1008","0.0018","23.247","0.005","10.511","0.002","90","","90","","90","","2223.8","0.8","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C6 H24 Cu I5 N6 Ni Pb -","- C6 H24 Cu I5 N6 Ni Pb -","- C24 H96 Cu4 I20 N24 Ni4 Pb4 -","4","1","","Ren, Taohong; Zhu, Hongjin; Yang, Xiao; Jia, Dingxian","Heterometallic lead-iodocuprate hybrids with transition-metal complexes: syntheses, structures, photoelectricity and photocatalysis","New Journal of Chemistry","2025","49","23","9669","9677","10.1039/D5NJ00483G","","","0.71073","MoKα","","0.0285","0.0256","","","0.0581","0.0594","","","","","","1.04","","","","has coordinates","301073","2025-07-06","17:39:35",""
"7063788","16.877","0.005","23.183","0.007","4.0775","0.0012","90","","90","","90","","1595.4","0.8","296","2","296","2","","","","","","","","3","F d d 2","F 2 -2d","43","","","","- C6 H8 N6 -","- C6 H8 N6 -","- C48 H64 N48 -","8","0.5","","Li, Hao; Zhang, Guang-yuan; Du, Ning-ning; Zhan, Le-wu; Hou, Jing; Li, Bin-dong","4,4′-Dimethyl-1,1′-bi(1,2,3-triazole): exploring new insensitive energy source materials","New Journal of Chemistry","2025","49","20","8437","8441","10.1039/D5NJ00679A","","","0.71073","MoKα","","0.0504","0.0376","","","0.0917","0.0982","","","","","","1.045","","","","has coordinates","301063","2025-07-06","17:35:34",""
"7063789","7.6557","0.0016","9.109","0.002","10.049","0.002","80.505","0.008","69.6","0.007","78.742","0.007","640.6","0.2","161.6","","161.6","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H10 N2 O3 S2 -","- C11 H10 N2 O3 S2 -","- C22 H20 N4 O6 S4 -","2","1","","Sarkar, Prabhat; Paul, Shuba; Das, Supratim; Chowdhury, Tania; Mandal, Subham; Goswami, Sanchita; Bhaumik, Asim; Mukhopadhyay, Chhanda","tert-Butylnitrite promoted one-component based direct synthesis of 2-cyano substituted maleimide probes and their fluorescence turn-off sensing towards Fe3+","New Journal of Chemistry","2025","49","22","9484","9490","10.1039/D4NJ05011H","","x-ray","0.71073","MoKα","","0.0788","0.0751","","","0.2096","0.2177","","","","","","1.066","","","","has coordinates","301033","2025-07-06","17:29:16",""
"7063790","7.1679","0.0004","7.7218","0.0004","10.2127","0.0005","96.893","0.002","90.608","0.002","107.975","0.002","533.11","0.05","273.15","","273.15","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H8 N2 O3 -","- C12 H8 N2 O3 -","- C24 H16 N4 O6 -","2","1","","Sarkar, Prabhat; Paul, Shuba; Das, Supratim; Chowdhury, Tania; Mandal, Subham; Goswami, Sanchita; Bhaumik, Asim; Mukhopadhyay, Chhanda","tert-Butylnitrite promoted one-component based direct synthesis of 2-cyano substituted maleimide probes and their fluorescence turn-off sensing towards Fe3+","New Journal of Chemistry","2025","49","22","9484","9490","10.1039/D4NJ05011H","","x-ray","1.54178","CuKα","","0.064","0.0608","","","0.1907","0.1951","","","","","","1.034","","","","has coordinates","301033","2025-07-06","17:29:16",""
"7063791","7.644","0.002","9.249","0.003","11.944","0.003","99.468","0.012","105.94","0.011","91.566","0.013","798.6","0.4","298","","298","","","","","","","","","4","P -1","-P 1","2","","","","- B10 H14 N2 O19 -","- B10 H14 N2 O19 -","- B20 H28 N4 O38 -","2","1","","Jiang, Yansheng; Jia, Hangwei; Wang, Wenhu; Arif, Muhammad; Yan, Xiuling; Hou, Xueling","Cation tuning in anionic framework hydroborates: tailored deep-ultraviolet optical crystals with large birefringence","New Journal of Chemistry","2025","49","21","8908","8913","10.1039/D5NJ01198A","","","0.71073","MoKα","","0.0488","0.0404","","","0.1041","0.1125","","","","","","1.052","","","","has coordinates,has disorder","301079","2025-07-06","17:41:26",""
"7063792","5.5381","0.0017","9.068","0.002","13.559","0.004","90","","91.605","0.009","90","","680.7","0.3","110","2","110","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- B5 H2 Li O9 -","- B5 H2 Li O9 -","- B20 H8 Li4 O36 -","4","1","","Jiang, Yansheng; Jia, Hangwei; Wang, Wenhu; Arif, Muhammad; Yan, Xiuling; Hou, Xueling","Cation tuning in anionic framework hydroborates: tailored deep-ultraviolet optical crystals with large birefringence","New Journal of Chemistry","2025","49","21","8908","8913","10.1039/D5NJ01198A","","","0.71073","MoKα","","0.0846","0.0511","","","0.1107","0.1305","","","","","","1.051","","","","has coordinates","301079","2025-07-06","17:41:26",""
"7063793","7.601","0.004","9.211","0.004","11.809","0.006","98.805","0.018","106.617","0.019","91.53","0.02","780.7","0.7","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- B10 H8 K1.5 N0.5 O19 -","- B10 H8 K1.5 N0.5 O19 -","- B20 H16 K3 N O38 -","2","1","","Jiang, Yansheng; Jia, Hangwei; Wang, Wenhu; Arif, Muhammad; Yan, Xiuling; Hou, Xueling","Cation tuning in anionic framework hydroborates: tailored deep-ultraviolet optical crystals with large birefringence","New Journal of Chemistry","2025","49","21","8908","8913","10.1039/D5NJ01198A","","","0.71073","MoKα","","0.0625","0.0495","","","0.1311","0.1495","","","","","","1.068","","","","has coordinates","301079","2025-07-06","17:41:26",""
"7063794","7.7386","0.0013","9.1876","0.0017","12.178","0.002","98.919","0.007","106.626","0.006","91.351","0.007","817.5","0.2","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- B10 Cs1.3 H8.8 N0.7 O19 -","- B10 Cs1.3 H8.8 N0.7 O19 -","- B20 Cs2.6 H17.6 N1.4 O38 -","2","1","","Jiang, Yansheng; Jia, Hangwei; Wang, Wenhu; Arif, Muhammad; Yan, Xiuling; Hou, Xueling","Cation tuning in anionic framework hydroborates: tailored deep-ultraviolet optical crystals with large birefringence","New Journal of Chemistry","2025","49","21","8908","8913","10.1039/D5NJ01198A","","","0.71073","MoKα","","0.0418","0.0385","","","0.1109","0.1141","","","","","","1.123","","","","has coordinates,has disorder","301079","2025-07-06","17:41:26",""
"7063795","11.2894","0.0006","30.7788","0.0017","14.4437","0.0008","90","","103.097","0.002","90","","4888.3","0.5","120","","120","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H36 B21 Cl2 F10 N3 S2 -","- C37 H36 B21 Cl2 F10 N3 S2 -","- C148 H144 B84 Cl8 F40 N12 S8 -","4","1","","Zaitsev, Andrei V.; Smol’yakov, Alexander F.; Kononova, Elena G.; Ol'shevskaya, Valentina A.","Novel aza-BODIPY-carborane conjugates: synthesis and characterization","New Journal of Chemistry","2025","49","21","9035","9042","10.1039/D5NJ01231G","","","0.71073","MoKα","","0.0785","0.0666","","","0.2096","0.2195","","","","","","1.126","","","","has coordinates","301078","2025-07-06","17:41:03",""
"7063796","9.9919","0.001","29.834","0.003","23.1038","0.0019","90","","91.643","0.004","90","","6884.4","1.1","120","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H54 B41 F10 N3 S4 -","- C40 H54 B41 F10 N3 S4 -","- C160 H216 B164 F40 N12 S16 -","4","1","","Zaitsev, Andrei V.; Smol’yakov, Alexander F.; Kononova, Elena G.; Ol'shevskaya, Valentina A.","Novel aza-BODIPY-carborane conjugates: synthesis and characterization","New Journal of Chemistry","2025","49","21","9035","9042","10.1039/D5NJ01231G","","","0.71073","MoKα","","0.1024","0.0683","","","0.1697","0.1877","","","","","","1.027","","","","has coordinates","301078","2025-07-06","17:41:03",""
"7063797","14.4795","0.0018","7.2223","0.0008","25.558","0.003","90","","91.254","0.006","90","","2672.1","0.5","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H12 B F12 N3 -","- C32 H12 B F12 N3 -","- C128 H48 B4 F48 N12 -","4","1","","Zaitsev, Andrei V.; Smol’yakov, Alexander F.; Kononova, Elena G.; Ol'shevskaya, Valentina A.","Novel aza-BODIPY-carborane conjugates: synthesis and characterization","New Journal of Chemistry","2025","49","21","9035","9042","10.1039/D5NJ01231G","","","0.71073","MoKα","","0.1662","0.0579","","","0.1091","0.1344","","","","","","0.891","","","","has coordinates","301078","2025-07-06","17:41:03",""
"7063798","20.233","0.0006","10.6778","0.0003","22.994","0.0007","90","","94.519","0.001","90","","4952.3","0.3","120","","120","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H44 B21 Cl2 F2 N3 S2 -","- C37 H44 B21 Cl2 F2 N3 S2 -","- C148 H176 B84 Cl8 F8 N12 S8 -","4","1","","Zaitsev, Andrei V.; Smol’yakov, Alexander F.; Kononova, Elena G.; Ol'shevskaya, Valentina A.","Novel aza-BODIPY-carborane conjugates: synthesis and characterization","New Journal of Chemistry","2025","49","21","9035","9042","10.1039/D5NJ01231G","","","0.71073","MoKα","","0.0765","0.0635","","","0.181","0.1892","","","","","","1.022","","","","has coordinates","301078","2025-07-06","17:41:03",""
"7063799","21.5516","0.0005","4.8384","0.0001","28.6806","0.0007","90","","93.393","0.002","90","","2985.43","0.12","150","0.1","150","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 Cl2 N6 O10 S2 Zn -","- C24 H26 Cl2 N6 O10 S2 Zn -","- C96 H104 Cl8 N24 O40 S8 Zn4 -","4","0.5","","Podjed, Nina; Uranjek, Zarja; Cerc Korošec, Romana; Hrast Rambaher, Martina; Golob, Majda; Modec, Barbara","On zinc(ii) coordination chemistry with furosemide: a journey from a mononuclear complex to a coordination polymer","New Journal of Chemistry","2025","49","22","9113","9122","10.1039/D5NJ01438G","","x-ray","1.54184","CuKα","","0.044","0.0358","","","0.0883","0.0956","","","","","","1.059","","","","has coordinates","301030","2025-07-06","17:28:37",""
"7063800","8.18826","0.00007","4.75496","0.00004","36.8598","0.0003","90","","91.2793","0.0008","90","","1434.77","0.02","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 Cl N3 O5 S -","- C12 H14 Cl N3 O5 S -","- C48 H56 Cl4 N12 O20 S4 -","4","1","","Podjed, Nina; Uranjek, Zarja; Cerc Korošec, Romana; Hrast Rambaher, Martina; Golob, Majda; Modec, Barbara","On zinc(ii) coordination chemistry with furosemide: a journey from a mononuclear complex to a coordination polymer","New Journal of Chemistry","2025","49","22","9113","9122","10.1039/D5NJ01438G","","x-ray","1.54184","CuKα","","0.0412","0.0407","","","0.1138","0.1143","","","","","","1.1","","","","has coordinates","301030","2025-07-06","17:28:38",""
"7063801","21.0265","0.0002","9.3017","0.0001","34.366","0.0003","90","","93.7","0.001","90","","6707.37","0.11","150","0.1","150","0.1","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C66 H52 Cl2 N8 O20 S2 Zn3 -","- C66 H52 Cl2 N8 O20 S2 Zn3 -","- C264 H208 Cl8 N32 O80 S8 Zn12 -","4","0.5","","Podjed, Nina; Uranjek, Zarja; Cerc Korošec, Romana; Hrast Rambaher, Martina; Golob, Majda; Modec, Barbara","On zinc(ii) coordination chemistry with furosemide: a journey from a mononuclear complex to a coordination polymer","New Journal of Chemistry","2025","49","22","9113","9122","10.1039/D5NJ01438G","","x-ray","1.54184","CuKα","","0.0332","0.0318","","","0.0823","0.0836","","","","","","1.071","","","","has coordinates","301030","2025-07-06","17:28:38",""
"7063802","19.322","0.002","6.6317","0.0007","26.859","0.003","90","","106.8","0.005","90","","3294.8","0.6","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C34 H28 B10 -","- C34 H28 B10 -","- C136 H112 B40 -","4","1","","Li, Na; Wu, Xueyan; Lv, Yan; Chi, Jinxia; Guo, Jixi","Fluoranthene–o-carborane dyads: exploring thermochromism and mechanochromism in crystalline systems","New Journal of Chemistry","2025","49","25","10530","10537","10.1039/D5NJ01482D","","","1.54178","CuKα","","0.118","0.0991","","","0.2916","0.3128","","","","","","1.255","","","","has coordinates","301061","2025-07-06","17:35:14",""
"7063803","10.4697","0.0008","24.564","0.002","7.2361","0.0006","90","","92.489","0.003","90","","1859.2","0.3","301","","301","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C18 H20 B10 -","- C18 H20 B10 -","- C72 H80 B40 -","4","1","","Li, Na; Wu, Xueyan; Lv, Yan; Chi, Jinxia; Guo, Jixi","Fluoranthene–o-carborane dyads: exploring thermochromism and mechanochromism in crystalline systems","New Journal of Chemistry","2025","49","25","10530","10537","10.1039/D5NJ01482D","","x-ray","0.71073","MoKα","","0.0777","0.05","","","0.1282","0.1464","","","","","","1.044","","","","has coordinates","301061","2025-07-06","17:35:14",""
"7063804","6.7798","0.0003","10.5381","0.0005","24.4272","0.001","91.963","0.003","96.868","0.003","93.117","0.004","1728.68","0.13","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 N6 O S -","- C18 H16 N6 O S -","- C72 H64 N24 O4 S4 -","4","2","","Aminov, Semen V.; Fedotov, Victor V.; Savateev, Konstantin V.; Neymash, Artyom O.; Ulomsky, Evgeny N.; Slepukhin, Pavel A.; Rusinov, Vladimir L.","ANRORC-type reactions of azolo[1,5-a]pyrimidine-6-carbonitriles with O- and N-nucleophiles","New Journal of Chemistry","2025","49","21","8627","8631","10.1039/D5NJ00255A","","","0.71073","MoKα","","0.0903","0.0553","","","0.1523","0.1848","","","","","","1.025","","","","has coordinates,has disorder","301077","2025-07-06","17:40:46",""
"7063805","6.6736","0.0004","7.4873","0.0004","22.8768","0.0014","90","","90","","90","","1143.09","0.12","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H12 N4 -","- C12 H12 N4 -","- C48 H48 N16 -","4","1","","Aminov, Semen V.; Fedotov, Victor V.; Savateev, Konstantin V.; Neymash, Artyom O.; Ulomsky, Evgeny N.; Slepukhin, Pavel A.; Rusinov, Vladimir L.","ANRORC-type reactions of azolo[1,5-a]pyrimidine-6-carbonitriles with O- and N-nucleophiles","New Journal of Chemistry","2025","49","21","8627","8631","10.1039/D5NJ00255A","","","0.71073","MoKα","","0.095","0.0563","","","0.1285","0.1557","","","","","","0.968","","","","has coordinates","301077","2025-07-06","17:40:46",""
"7063806","9.5201","0.0005","12.7114","0.0006","16.236","0.0008","99.885","0.004","93.772","0.004","106.915","0.004","1837.86","0.17","295","2","295","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H23 N7 -","- C18 H23 N7 -","- C72 H92 N28 -","4","2","","Aminov, Semen V.; Fedotov, Victor V.; Savateev, Konstantin V.; Neymash, Artyom O.; Ulomsky, Evgeny N.; Slepukhin, Pavel A.; Rusinov, Vladimir L.","ANRORC-type reactions of azolo[1,5-a]pyrimidine-6-carbonitriles with O- and N-nucleophiles","New Journal of Chemistry","2025","49","21","8627","8631","10.1039/D5NJ00255A","","","0.71073","MoKα","","0.1412","0.0694","","","0.1711","0.2261","","","","","","1.022","","","","has coordinates,has disorder","301077","2025-07-06","17:40:46",""
"7063807","8.77","0.0005","10.7512","0.0007","10.7578","0.0006","107.668","0.002","104.604","0.002","110.418","0.002","829.78","0.09","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 Cu N10 -","- C16 H14 Cu N10 -","- C32 H28 Cu2 N20 -","2","1","","Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Berezin, A. S.; Lider, E. V.","Copper(ii) complexes based on 5-methyl-1H-tetrazole and 2,2′-bipyridine, 1,10-phenathroline derivatives: synthesis, crystal structures and extended cytotoxicity study","New Journal of Chemistry","2025","49","22","9465","9474","10.1039/D5NJ00875A","","","0.71073","MoKα","","0.0421","0.033","","","0.0732","0.0773","","","","","","1.04","","","","has coordinates","301029","2025-07-06","17:28:25",""
"7063808","11.0916","0.0013","11.1446","0.0012","11.1875","0.001","113.708","0.003","97.123","0.003","118.018","0.003","1030.7","0.2","301","","301","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 Cu2 N20 O2 -","- C36 H40 Cu2 N20 O2 -","- C36 H40 Cu2 N20 O2 -","1","0.5","","Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Berezin, A. S.; Lider, E. V.","Copper(ii) complexes based on 5-methyl-1H-tetrazole and 2,2′-bipyridine, 1,10-phenathroline derivatives: synthesis, crystal structures and extended cytotoxicity study","New Journal of Chemistry","2025","49","22","9465","9474","10.1039/D5NJ00875A","","","0.71073","MoKα","","0.0897","0.0601","","","0.1499","0.1639","","","","","","1.03","","","","has coordinates","301029","2025-07-06","17:28:25",""
"7063809","11.224","0.002","14.614","0.003","14.652","0.003","105.79","0.03","101.79","0.03","112.04","0.03","2013.2","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H76 Cu4 N40 O2 -","- C72 H76 Cu4 N40 O2 -","- C72 H76 Cu4 N40 O2 -","1","0.5","","Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Berezin, A. S.; Lider, E. V.","Copper(ii) complexes based on 5-methyl-1H-tetrazole and 2,2′-bipyridine, 1,10-phenathroline derivatives: synthesis, crystal structures and extended cytotoxicity study","New Journal of Chemistry","2025","49","22","9465","9474","10.1039/D5NJ00875A","","","0.71073","MoKα","","0.1375","0.0791","","","0.2001","0.2443","","","","","","1.025","","","","has coordinates","301029","2025-07-06","17:28:25",""
"7063810","8.6567","0.0007","9.9109","0.0008","10.7222","0.0008","109.317","0.003","110.058","0.003","96.05","0.003","790.23","0.11","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H14 Cu N10 -","- C14 H14 Cu N10 -","- C28 H28 Cu2 N20 -","2","1","","Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Berezin, A. S.; Lider, E. V.","Copper(ii) complexes based on 5-methyl-1H-tetrazole and 2,2′-bipyridine, 1,10-phenathroline derivatives: synthesis, crystal structures and extended cytotoxicity study","New Journal of Chemistry","2025","49","22","9465","9474","10.1039/D5NJ00875A","","","0.71073","MoKα","","0.072","0.0425","","","0.0782","0.0887","","","","","","1.026","","","","has coordinates","301029","2025-07-06","17:28:25",""
"7063811","10.987","0.003","11.354","0.003","11.406","0.003","100.136","0.007","109.237","0.006","118.587","0.006","1079.9","0.5","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 Cu N10 O -","- C20 H24 Cu N10 O -","- C40 H48 Cu2 N20 O2 -","2","1","","Golubeva, Yu. A.; Smirnova, K. S.; Klyushova, L. S.; Berezin, A. S.; Lider, E. V.","Copper(ii) complexes based on 5-methyl-1H-tetrazole and 2,2′-bipyridine, 1,10-phenathroline derivatives: synthesis, crystal structures and extended cytotoxicity study","New Journal of Chemistry","2025","49","22","9465","9474","10.1039/D5NJ00875A","","","0.71073","MoKα","","0.1323","0.0725","","","0.1701","0.1967","","","","","","1.049","","","","has coordinates,has disorder","301029","2025-07-06","17:28:25",""
"7063812","11.379","0.0012","9.6235","0.001","15.5768","0.0016","90","","111.18","0.002","90","","1590.5","0.3","273.15","","273.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H6 Cl4 N5 O P3 -","- C9 H6 Cl4 N5 O P3 -","- C36 H24 Cl16 N20 O4 P12 -","4","1","","Mutlu Balcı, Ceylan; Palabıyık, Duygu; Beşli, Serap","Cyclic phosphazene derivatives combined with two different forms of the phenol-pyrazole group: synthesis, spectroscopic and crystallographic characterization and stereochemical properties","New Journal of Chemistry","2025","49","23","9583","9599","10.1039/D5NJ01321F","","","0.71073","MoKα","","0.0501","0.0344","","","0.085","0.0922","","","","","","1.036","","","","has coordinates","301076","2025-07-06","17:40:27",""
"7063813","7.8","0.0005","14.4899","0.0009","19.0386","0.0012","100.877","0.001","95.251","0.001","90.909","0.001","2103","0.2","172.16","","172.16","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H12 Cl2 N7 O2 P3 -","- C18 H12 Cl2 N7 O2 P3 -","- C72 H48 Cl8 N28 O8 P12 -","4","2","","Mutlu Balcı, Ceylan; Palabıyık, Duygu; Beşli, Serap","Cyclic phosphazene derivatives combined with two different forms of the phenol-pyrazole group: synthesis, spectroscopic and crystallographic characterization and stereochemical properties","New Journal of Chemistry","2025","49","23","9583","9599","10.1039/D5NJ01321F","","","0.71073","MoKα","","0.0437","0.0342","","","0.0834","0.0889","","","","","","1.022","","","","has coordinates","301076","2025-07-06","17:40:27",""
"7063814","8.8942","0.001","24.158","0.003","12.9982","0.0014","90","","93.967","0.002","90","","2786.2","0.6","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H19 Cl N9 O3 P3 -","- C27 H19 Cl N9 O3 P3 -","- C108 H76 Cl4 N36 O12 P12 -","4","1","","Mutlu Balcı, Ceylan; Palabıyık, Duygu; Beşli, Serap","Cyclic phosphazene derivatives combined with two different forms of the phenol-pyrazole group: synthesis, spectroscopic and crystallographic characterization and stereochemical properties","New Journal of Chemistry","2025","49","23","9583","9599","10.1039/D5NJ01321F","","","0.71073","MoKα","","0.0689","0.0457","","","0.1035","0.1137","","","","","","1.028","","","","has coordinates","301076","2025-07-06","17:40:27",""
"7063815","12.413","0.0011","14.0903","0.0012","23.476","0.002","97.72","0.002","104.312","0.002","92.798","0.002","3928.1","0.6","173.01","","173.01","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H26 N11 O4 P3 -","- C36 H26 N11 O4 P3 -","- C144 H104 N44 O16 P12 -","4","2","","Mutlu Balcı, Ceylan; Palabıyık, Duygu; Beşli, Serap","Cyclic phosphazene derivatives combined with two different forms of the phenol-pyrazole group: synthesis, spectroscopic and crystallographic characterization and stereochemical properties","New Journal of Chemistry","2025","49","23","9583","9599","10.1039/D5NJ01321F","","","0.71073","MoKα","","0.1178","0.0734","","","0.171","0.1913","","","","","","1.025","","","","has coordinates","301076","2025-07-06","17:40:27",""
"7063816","13.5271","0.0004","14.2651","0.0004","42.842","0.0011","90","","97.0632","0.0006","90","","8204.3","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H108 Cu11 I3 N6 S13 -","- C54 H108 Cu11 I3 N6 S13 -","- C216 H432 Cu44 I12 N24 S52 -","4","1","","Brocha Silalahi, Rhone P.; Kuo, Yu-Te; Chiu, Tzu-Hao; Pillay, Michael N.; Liu, C. W.","Chalcogenide-centered Cu11 clusters heteroleptically passivated by dichalcogenolates and iodo ligands","New Journal of Chemistry","2025","49","23","9965","9972","10.1039/D5NJ01571E","","","0.71073","MoKα","","0.0582","0.049","","","0.1199","0.1254","","","","","","1.092","","","","has coordinates,has disorder","301075","2025-07-06","17:40:11",""
"7063817","19.4684","0.0011","19.4684","0.0011","42.649","0.003","90","","90","","120","","13999.1","1.5","150","2","150","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","","","- C94 H208 Cu11 I3 N6 O10 Se13 -","- C54 H108 Cu11 I3 N6 Se13 -","- C324 H648 Cu66 I18 N36 Se78 -","6","0.333333","","Brocha Silalahi, Rhone P.; Kuo, Yu-Te; Chiu, Tzu-Hao; Pillay, Michael N.; Liu, C. W.","Chalcogenide-centered Cu11 clusters heteroleptically passivated by dichalcogenolates and iodo ligands","New Journal of Chemistry","2025","49","23","9965","9972","10.1039/D5NJ01571E","","","0.71073","MoKα","","0.0554","0.0411","","","0.1021","0.1138","","","","","","1.075","","","","has coordinates","301075","2025-07-06","17:40:11",""
"7063818","13.6427","0.0007","24.2123","0.0012","24.7855","0.0012","100.98","0.0011","102.459","0.0011","91.9866","0.0012","7823.5","0.7","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C88 H178 Cu22 I6 N12 O Se26 -","- C88 H178 Cu22 I6 N12 O Se26 -","- C176 H356 Cu44 I12 N24 O2 Se52 -","2","1","","Brocha Silalahi, Rhone P.; Kuo, Yu-Te; Chiu, Tzu-Hao; Pillay, Michael N.; Liu, C. W.","Chalcogenide-centered Cu11 clusters heteroleptically passivated by dichalcogenolates and iodo ligands","New Journal of Chemistry","2025","49","23","9965","9972","10.1039/D5NJ01571E","","","0.71073","MoKα","","0.0777","0.0607","","","0.1558","0.1709","","","","","","1.024","","","","has coordinates,has disorder","301075","2025-07-06","17:40:11",""
"7063819","13.3088","0.0003","14.6201","0.0003","14.6236","0.0003","71.154","0.002","76.115","0.002","64.496","0.002","2413.44","0.1","200","0.1","200","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C44 H36 Cl4 N10 O9 S2 Zn -","- C42 H30 Cl2 N10 O8 S2 Zn -","- C84 H60 Cl4 N20 O16 S4 Zn2 -","2","1","","Oleksii, Y.; Cheret, Y.; Allain, M.; Brosseau, A.; Haacke, S.; El-Ghayoury, A.","Unraveling AIE in zinc(ii) coordination complexes: role of ligand structure and mechanistic insights","New Journal of Chemistry","2025","49","24","10089","10101","10.1039/D5NJ01420D","","","1.54184","CuKα","","0.0491","0.0466","","","0.1296","0.1325","","","","","","1.038","","","","has coordinates,has disorder","301027","2025-07-06","17:27:00",""
"7063820","18.4902","0.0011","8.0542","0.0003","28.4759","0.0012","90","","90.379","0.005","90","","4240.6","0.3","200","0.1","200","0.1","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C40 H34 Cl2 N10 O10 S2 Zn -","- C40 H34 Cl2 N10 O10 S2 Zn -","- C160 H136 Cl8 N40 O40 S8 Zn4 -","4","0.5","","Oleksii, Y.; Cheret, Y.; Allain, M.; Brosseau, A.; Haacke, S.; El-Ghayoury, A.","Unraveling AIE in zinc(ii) coordination complexes: role of ligand structure and mechanistic insights","New Journal of Chemistry","2025","49","24","10089","10101","10.1039/D5NJ01420D","","","1.54184","CuKα","","0.0451","0.0425","","","0.1144","0.1162","","","","","","1.014","","","","has coordinates,has disorder","301027","2025-07-06","17:27:01",""
"7063821","9.434","0.003","10.248","0.003","11.733","0.004","71.1","0.009","76.526","0.008","86.091","0.009","1043.6","0.6","294","2","294","2","","","","","","","","6","P 1","P 1","1","","","","- C39.75 H45.51 Fe N4 Na O11 -","- C39.753 H45.506 Fe N4 Na O11 -","- C39.753 H45.506 Fe N4 Na O11 -","1","1","","Paik, Somnath; Ray, Manabendra","Visual detection of Hg2+ without interference by alkali and alkaline earth metal ions using an iron(iii) complex in a hetero-bimetallic environment","New Journal of Chemistry","2025","49","23","9980","9989","10.1039/D5NJ00233H","","","0.71073","MoKα","","0.0807","0.0544","","","0.0981","0.1116","","","","","","1.084","","","","has coordinates,has disorder","301074","2025-07-06","17:39:55",""
"7063822","13.397","0.003","14.023","0.004","25.188","0.006","90","","100.065","0.007","90","","4659","2","294","2","294","2","","","","","","","Laboratory Synthesized","6","P 1 21 1","P 2yb","4","CalciumComplex","Inorganic Complex","","- C83.5 H89.5 Ca Fe2 N10.5 O22.5 -","- C83.5 H89.5 Ca Fe2 N10.5 O22.5 -","- C167 H179 Ca2 Fe4 N21 O45 -","2","1","","Paik, Somnath; Ray, Manabendra","Visual detection of Hg2+ without interference by alkali and alkaline earth metal ions using an iron(iii) complex in a hetero-bimetallic environment","New Journal of Chemistry","2025","49","23","9980","9989","10.1039/D5NJ00233H","","","0.71073","MoKα","","0.0794","0.0569","","","0.1434","0.1668","","","","","","1.32","","","","has coordinates","301074","2025-07-06","17:39:55",""
"7063823","9.383","0.002","10.395","0.003","39.792","0.009","90","","90","","90","","3881.2","1.6","294","2","294","2","","","","","","","Synthesis","6","P 21 21 21","P 2ac 2ab","19","","","","- C38 H36 Fe K N4 O9 -","- C38 H36 Fe K N4 O9 -","- C152 H144 Fe4 K4 N16 O36 -","4","1","","Paik, Somnath; Ray, Manabendra","Visual detection of Hg2+ without interference by alkali and alkaline earth metal ions using an iron(iii) complex in a hetero-bimetallic environment","New Journal of Chemistry","2025","49","23","9980","9989","10.1039/D5NJ00233H","","","0.71073","MoKα","","0.0803","0.0498","","","0.0922","0.1034","","","","","","1.084","","","","has coordinates,has disorder","301074","2025-07-06","17:39:55",""
"7063824","16.36","0.005","16.523","0.005","30.908","0.011","90","","90","","90","","8355","5","294","2","294","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C82 H85 Ba Fe2 N9 O21 -","- C82 H85 Ba Fe2 N9 O21 -","- C328 H340 Ba4 Fe8 N36 O84 -","4","1","","Paik, Somnath; Ray, Manabendra","Visual detection of Hg2+ without interference by alkali and alkaline earth metal ions using an iron(iii) complex in a hetero-bimetallic environment","New Journal of Chemistry","2025","49","23","9980","9989","10.1039/D5NJ00233H","","","0.71073","MoKα","","0.1061","0.0683","","","0.1218","0.1355","","","","","","1.12","","","","has coordinates","301074","2025-07-06","17:39:55",""
"7063825","14.2827","0.0006","8.1384","0.0003","60.234","0.002","90","","95.955","0.001","90","","6963.7","0.5","302","2","302","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H51 O13.5 Sm2 -","- C30 H51 O13.5 Sm2 -","- C240 H408 O108 Sm16 -","8","1","","Jia, Ying-Hao; Liu, Xing; Zhou, Jian; Qin, Qi-Pin; Du, Jia-Yin","Two structural types of lanthanide MOFs based on long-chain flexible sebacic acid: synthesis, luminescence, sensing, and magnetic properties","New Journal of Chemistry","2025","49","26","11227","11240","10.1039/D5NJ02067K","","","0.71073","MoKα","","0.0543","0.0526","","","0.2047","0.2069","","","","","","1.068","","","","has coordinates,has disorder","301037","2025-07-06","17:30:19",""
"7063826","14.248","0.002","8.1274","0.0012","60.072","0.009","90","","96.073","0.004","90","","6917.2","1.8","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H51 Eu2 O13.5 -","- C30 H51 Eu2 O13.5 -","- C240 H408 Eu16 O108 -","8","1","","Jia, Ying-Hao; Liu, Xing; Zhou, Jian; Qin, Qi-Pin; Du, Jia-Yin","Two structural types of lanthanide MOFs based on long-chain flexible sebacic acid: synthesis, luminescence, sensing, and magnetic properties","New Journal of Chemistry","2025","49","26","11227","11240","10.1039/D5NJ02067K","","","0.71073","MoKα","","0.0666","0.065","","","0.2288","0.2303","","","","","","1.175","","","","has coordinates,has disorder","301037","2025-07-06","17:30:20",""
"7063827","14.211","0.0011","8.1027","0.0006","60.154","0.005","90","","96.168","0.002","90","","6886.5","0.9","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H51 Gd2 O13.5 -","- C30 H51 Gd2 O13.5 -","- C240 H408 Gd16 O108 -","8","1","","Jia, Ying-Hao; Liu, Xing; Zhou, Jian; Qin, Qi-Pin; Du, Jia-Yin","Two structural types of lanthanide MOFs based on long-chain flexible sebacic acid: synthesis, luminescence, sensing, and magnetic properties","New Journal of Chemistry","2025","49","26","11227","11240","10.1039/D5NJ02067K","","","0.71073","MoKα","","0.0355","0.0351","","","0.0798","0.0802","","","","","","1.039","","","","has coordinates,has disorder","301037","2025-07-06","17:30:20",""
"7063828","16.2582","0.0008","13.8015","0.0007","8.9584","0.0004","90","","105.057","0.0018","90","","1941.14","0.16","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H28 Dy O8 -","- C15 H28 Dy O8 -","- C60 H112 Dy4 O32 -","4","1","","Jia, Ying-Hao; Liu, Xing; Zhou, Jian; Qin, Qi-Pin; Du, Jia-Yin","Two structural types of lanthanide MOFs based on long-chain flexible sebacic acid: synthesis, luminescence, sensing, and magnetic properties","New Journal of Chemistry","2025","49","26","11227","11240","10.1039/D5NJ02067K","","","0.71073","MoKα","","0.0463","0.03","","","0.0666","0.0741","","","","","","1.051","","","","has coordinates,has disorder","301037","2025-07-06","17:30:20",""
"7063829","14.1736","0.0007","8.0917","0.0004","60.102","0.003","90","","96.308","0.001","90","","6851.3","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H51 O13.5 Tb2 -","- C30 H51 O13.5 Tb2 -","- C240 H408 O108 Tb16 -","8","1","","Jia, Ying-Hao; Liu, Xing; Zhou, Jian; Qin, Qi-Pin; Du, Jia-Yin","Two structural types of lanthanide MOFs based on long-chain flexible sebacic acid: synthesis, luminescence, sensing, and magnetic properties","New Journal of Chemistry","2025","49","26","11227","11240","10.1039/D5NJ02067K","","","0.71073","MoKα","","0.0375","0.0362","","","0.137","0.1383","","","","","","1.106","","","","has coordinates,has disorder","301037","2025-07-06","17:30:20",""
"7063830","8.661","0.0004","12.4336","0.0005","16.031","0.0007","103.57","0.002","90.7","0.002","100.42","0.002","1647.77","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H34 B N3 O4 -","- C41 H34 B N3 O4.001 -","- C82 H68 B2 N6 O8.002 -","2","1","","Ordaz-Romero, Enrique; Díaz-Flores, Angela Y.; Rojas-Montoya, Sandra M.; Blancarte-Carrazco, Luis; Romero-Ávila, Margarita; Labra-Vázquez, Pablo; Santillan, Rosa; Farfán, Norberto","Tuning the electronic structure of BODIPY-coumarin ratiometric fluorescent sensors for accurate microviscosity monitoring applications","New Journal of Chemistry","2025","49","25","10538","10550","10.1039/D5NJ00899A","","","0.71073","MoKα","","0.0625","0.0417","","","0.0967","0.1077","","","","","","1.059","","","","has coordinates,has disorder","301058","2025-07-06","17:34:32",""
"7063831","7.2465","0.0001","20.7755","0.0004","16.9252","0.0003","90","","90.162","0.001","90","","2548.07","0.08","198","","198","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H9 B F2 N2 S -","- C15 H9 B F2 N2 S -","- C120 H72 B8 F16 N16 S8 -","8","2","","Zhang, Yongli; Fu, Xiong; Li, Jie; Guo, Kaiwen; Wen, Hanyu; Guo, Tingting; Li, Xiangguang; Yang, Yanhua; Gao, Shulin","Sulfur-bridged annulated BODIPYs: synthesis, structure and photophysical properties","New Journal of Chemistry","2025","49","26","11326","11333","10.1039/D5NJ01481F","","","1.54178","CuKα","","0.0797","0.0653","","","0.1754","0.189","","","","","","1.052","","","","has coordinates","301041","2025-07-06","17:30:49",""
"7063832","7.1383","0.0002","11.5671","0.0003","19.5512","0.0005","90","","96.209","0.002","90","","1604.86","0.07","193","","193","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 B F2 N2 S -","- C19 H17 B F2 N2 S -","- C76 H68 B4 F8 N8 S4 -","4","1","","Zhang, Yongli; Fu, Xiong; Li, Jie; Guo, Kaiwen; Wen, Hanyu; Guo, Tingting; Li, Xiangguang; Yang, Yanhua; Gao, Shulin","Sulfur-bridged annulated BODIPYs: synthesis, structure and photophysical properties","New Journal of Chemistry","2025","49","26","11326","11333","10.1039/D5NJ01481F","","","1.54178","CuKα","","0.0449","0.0367","","","0.0981","0.1034","","","","","","1.071","","","","has coordinates,has disorder","301041","2025-07-06","17:30:50",""
"7063833","12.354","0.0004","14.1562","0.0005","20.9902","0.0007","90","","99.67","0.001","90","","3618.7","0.2","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H72 Cu6 N4 O26 Si10 -","- C48 H72 Cu6 N4 O26 Si10 -","- C96 H144 Cu12 N8 O52 Si20 -","2","0.5","","Frank, Inga V.; Shakirova, Albina R.; Peregudov, Alexander S.; Dolgushin, Fedor M.; Shchegolikhina, Olga I.; Anisimov, Anton A.","Synthesis and structure of new vinylcoppersiloxanes and stereoregular organocyclosilsesquioxanes based on them","New Journal of Chemistry","2025","49","26","11273","11284","10.1039/D5NJ01899D","","","0.71073","MoKα","","0.0682","0.0521","","","0.1372","0.1483","","","","","","1.064","","","","has coordinates,has disorder","301043","2025-07-06","17:31:09",""
"7063834","10.694","0.0008","15.0909","0.0014","20.5432","0.0016","94.676","0.003","102.91","0.0018","108.385","0.0017","3024.9","0.4","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H61 Cu3 N7 O18 Si8 -","- C42 H54 Cu3 N6 O17 Si8 -","- C84 H108 Cu6 N12 O34 Si16 -","2","1","","Frank, Inga V.; Shakirova, Albina R.; Peregudov, Alexander S.; Dolgushin, Fedor M.; Shchegolikhina, Olga I.; Anisimov, Anton A.","Synthesis and structure of new vinylcoppersiloxanes and stereoregular organocyclosilsesquioxanes based on them","New Journal of Chemistry","2025","49","26","11273","11284","10.1039/D5NJ01899D","","","0.71073","MoKα","","0.1439","0.0608","","","0.1305","0.1698","","","","","","0.984","","","","has coordinates,has disorder","301043","2025-07-06","17:31:09",""
"7063835","10.868","0.0017","10.8763","0.0017","25.978","0.004","92.798","0.002","92.478","0.002","106.886","0.002","2929.5","0.8","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H64 Cu3 N4 O19 Si8 -","- C44 H64 Cu3 N4 O19 Si8 -","- C88 H128 Cu6 N8 O38 Si16 -","2","1","","Frank, Inga V.; Shakirova, Albina R.; Peregudov, Alexander S.; Dolgushin, Fedor M.; Shchegolikhina, Olga I.; Anisimov, Anton A.","Synthesis and structure of new vinylcoppersiloxanes and stereoregular organocyclosilsesquioxanes based on them","New Journal of Chemistry","2025","49","26","11273","11284","10.1039/D5NJ01899D","","","0.71073","MoKα","","0.0668","0.0489","","","0.1024","0.11","","","","","","1.037","","","","has coordinates,has disorder","301043","2025-07-06","17:31:09",""
"7063836","13.8005","0.0006","18.3441","0.0009","13.9302","0.0007","90","","102.94","0.0009","90","","3437","0.3","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H62 Cu6 N6 O24 Si10 -","- C46 H62 Cu6 N6 O24 Si10 -","- C92 H124 Cu12 N12 O48 Si20 -","2","0.5","","Frank, Inga V.; Shakirova, Albina R.; Peregudov, Alexander S.; Dolgushin, Fedor M.; Shchegolikhina, Olga I.; Anisimov, Anton A.","Synthesis and structure of new vinylcoppersiloxanes and stereoregular organocyclosilsesquioxanes based on them","New Journal of Chemistry","2025","49","26","11273","11284","10.1039/D5NJ01899D","","","0.71073","MoKα","","0.0315","0.0277","","","0.0745","0.0769","","","","","","1.053","","","","has coordinates,has disorder","301043","2025-07-06","17:31:09",""
"7063837","9.0752","0.0005","19.2241","0.0011","12.5601","0.0007","90","","106.66","0.002","90","","2099.3","0.2","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H18 Br Cl N2 O -","- C26 H18 Br Cl N2 O -","- C104 H72 Br4 Cl4 N8 O4 -","4","1","","Liang, Demin; Wu, Da; Shen, Jie; Lu, Shanya; Wang, Jiale; Yan, Xiaodong; Li, Jian","Diastereoselective reaction to construct polycyclic spiroindolines from 3-(2-isocyanoethyl)indoles and ynones","New Journal of Chemistry","2025","49","26","11371","11375","10.1039/D5NJ01268F","","","1.54178","CuKα","","0.0358","0.0352","","","0.0917","0.0921","","","","","","1.066","","","","has coordinates","301039","2025-07-06","17:30:32",""
"7063838","7.9044","0.0005","6.516","0.0003","9.6279","0.0005","90","","93.693","0.005","90","","494.86","0.05","173","2","173","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Gadolinium(III) Chloride Hexahydrate","","- Cl3 Gd H12 O6 -","- Cl3 Gd H12 O6 -","- Cl6 Gd2 H24 O12 -","2","0.5","","Krešáková, Lenka; Tarasenko, Róbert; Orendáč, Martin; Titikov, Hryhorii; Čižmár, Erik; Kuchár, Juraj; Černák, Juraj; Jankovič, Ľuboš; Madejová, Jana","Gadolinium chloride hexahydrate and its intercalation into synthetic saponite: structure, characterization and slow magnetic relaxation of the intercalated sample","New Journal of Chemistry","2025","49","26","11520","11530","10.1039/D5NJ01537E","","","0.71073","MoKα","","0.0169","0.0165","","","0.0404","0.0405","","","","","","1.172","","","","has coordinates","301042","2025-07-06","17:30:57",""
"7063839","7.9198","0.0003","6.52","0.0003","9.6421","0.0005","90","","93.65","0.004","90","","496.88","0.04","293","2","293","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Gadolinium(III) Chloride Hexahydrate","","- Cl3 Gd H12 O6 -","- Cl3 Gd H12 O6 -","- Cl6 Gd2 H24 O12 -","2","0.5","","Krešáková, Lenka; Tarasenko, Róbert; Orendáč, Martin; Titikov, Hryhorii; Čižmár, Erik; Kuchár, Juraj; Černák, Juraj; Jankovič, Ľuboš; Madejová, Jana","Gadolinium chloride hexahydrate and its intercalation into synthetic saponite: structure, characterization and slow magnetic relaxation of the intercalated sample","New Journal of Chemistry","2025","49","26","11520","11530","10.1039/D5NJ01537E","","","0.71073","MoKα","","0.0182","0.018","","","0.0441","0.0442","","","","","","1.215","","","","has coordinates","301042","2025-07-06","17:30:57",""
"7063840","5.2291","0.0006","20.848","0.003","7.6487","0.001","90","","90.668","0.004","90","","833.78","0.19","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(MeSe)2(MeS)2TTF","4,5-bis(methylseleno)-4',5'-bis(methylthio)-tetrathiafulvalene","","- C5 H6 S3 Se -","- C5 H6 S3 Se -","- C20 H24 S12 Se4 -","4","1","","Beau, Maxime; Jeon, Ie-Rang; Jeannin, Olivier; Guizouarn, Thierry; Fourmigué, Marc","Activation of chalcogen bonding in tetrathiafulvalene derivatives with Se/S differentiation","New Journal of Chemistry","2025","49","26","11501","11508","10.1039/D5NJ01745A","","x-ray","0.71073","MoKα","","0.0781","0.0464","","","0.0897","0.0974","","","","","","1.139","","","","has coordinates,has disorder","301040","2025-07-06","17:30:42",""
"7063841","8.3729","0.0006","11.2809","0.0008","14.735","0.0011","80.6","0.002","84.314","0.003","83.533","0.002","1359.72","0.17","296","2","296","2","","","","","","","","6","P -1","-P 1","2","[(MeSe)2(MeS)2TTF][TCNQF","","","- C22 H15 F N4 S6 Se2 -","- C22 H14.999 F1.004 N4 S6 Se2 -","- C44 H29.998 F2.008 N8 S12 Se4 -","2","1","","Beau, Maxime; Jeon, Ie-Rang; Jeannin, Olivier; Guizouarn, Thierry; Fourmigué, Marc","Activation of chalcogen bonding in tetrathiafulvalene derivatives with Se/S differentiation","New Journal of Chemistry","2025","49","26","11501","11508","10.1039/D5NJ01745A","","x-ray","0.71073","MoKα","","0.1023","0.0523","","","0.1145","0.1308","","","","","","1.059","","","","has coordinates","301040","2025-07-06","17:30:42",""
"7063842","8.0186","0.0008","9.4175","0.0009","17.3009","0.0016","98.667","0.003","93.154","0.003","91.17","0.004","1289.1","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","[(MeSe)2(MeS)2TTF][TCNQ]","","","- C22 H16 N4 S6 Se2 -","- C22 H16 N4 S6 Se2 -","- C44 H32 N8 S12 Se4 -","2","1","","Beau, Maxime; Jeon, Ie-Rang; Jeannin, Olivier; Guizouarn, Thierry; Fourmigué, Marc","Activation of chalcogen bonding in tetrathiafulvalene derivatives with Se/S differentiation","New Journal of Chemistry","2025","49","26","11501","11508","10.1039/D5NJ01745A","","x-ray","0.71073","MoKα","","0.063","0.0397","","","0.0834","0.0908","","","","","","1.055","","","","has coordinates,has disorder","301040","2025-07-06","17:30:42",""
"7063843","7.617","0.0008","10.9542","0.0012","12.889","0.0014","110.984","0.003","97.116","0.004","101.161","0.003","962.96","0.18","296","2","296","2","","","","","","","","6","P -1","-P 1","2","[(MeSe)2(MeS)2TTF][ClO4]","4,5-bis(methylseleno)-4',5'-bis(methylthio)-tetrathiafulvalenium, perchlorate","","- C10 H12 Cl O4 S6 Se2 -","- C10 H12 Cl O4 S6 Se2 -","- C20 H24 Cl2 O8 S12 Se4 -","2","1","","Beau, Maxime; Jeon, Ie-Rang; Jeannin, Olivier; Guizouarn, Thierry; Fourmigué, Marc","Activation of chalcogen bonding in tetrathiafulvalene derivatives with Se/S differentiation","New Journal of Chemistry","2025","49","26","11501","11508","10.1039/D5NJ01745A","","x-ray","0.71073","MoKα","","0.0761","0.0472","","","0.0998","0.1194","","","","","","1.139","","","","has coordinates,has disorder","301040","2025-07-06","17:30:42",""
"7063844","8.3766","0.0007","11.2683","0.0009","14.7324","0.0011","80.619","0.003","84.373","0.003","83.538","0.003","1358.76","0.19","296","2","296","2","","","","","","","","6","P -1","-P 1","2","[(MeSe)2(MeS)2TTF][TCNQF2]","","","- C22 H12 F2 N4 S6 Se2 -","- C22 H12 F2 N4 S6 Se2 -","- C44 H24 F4 N8 S12 Se4 -","2","1","","Beau, Maxime; Jeon, Ie-Rang; Jeannin, Olivier; Guizouarn, Thierry; Fourmigué, Marc","Activation of chalcogen bonding in tetrathiafulvalene derivatives with Se/S differentiation","New Journal of Chemistry","2025","49","26","11501","11508","10.1039/D5NJ01745A","","x-ray","0.71073","MoKα","","0.1236","0.0599","","","0.1388","0.1728","","","","","","1.026","","","","has coordinates,has disorder","301040","2025-07-06","17:30:42",""
"7063845","13.9738","0.0007","7.8363","0.0004","16.0601","0.0008","90","","105.82","0.002","90","","1692.02","0.15","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(MeSe)2(MeS)2TTF","4,5-bis(methylseleno)-4',5'-bis(methylthio)-tetrathiafulvalene","","- C10 H12 S6 Se2 -","- C10 H12 S6 Se2 -","- C40 H48 S24 Se8 -","4","1","","Beau, Maxime; Jeon, Ie-Rang; Jeannin, Olivier; Guizouarn, Thierry; Fourmigué, Marc","Activation of chalcogen bonding in tetrathiafulvalene derivatives with Se/S differentiation","New Journal of Chemistry","2025","49","26","11501","11508","10.1039/D5NJ01745A","","x-ray","0.71073","MoKα","","0.0986","0.0603","","","0.1169","0.1292","","","","","","1.158","","","","has coordinates,has disorder","301040","2025-07-06","17:30:42",""
"7063846","12.043","0.002","16.059","0.003","16.711","0.003","90","","106.88","0.03","90","","3092.6","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H88 Cu4 N4 P4 S4 -","- C52 H88 Cu4 N4 P4 S4 -","- C104 H176 Cu8 N8 P8 S8 -","2","0.5","","Trivedi, Manoj; Sharma, Sahil; Sharma, Raj Kishore; Kumar, Girijesh; Rath, Nigam","Tetranuclear thiocyanato-bridged copper(I) catalyst for the hydrogenation of Carbon Dioxide to formate under mild conditions","New Journal of Chemistry","2025","49","27","11607","11613","10.1039/D5NJ01727K","","","0.71073","MoKα","","0.2113","0.0782","","","0.1705","0.2299","","","","","","0.972","","","","has coordinates","301442","2025-08-04","07:36:24",""
"7063847","6.27","0.0004","16.0102","0.0011","14.1883","0.0009","90","","92.133","0.003","90","","1423.29","0.16","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N4 O4 S -","- C13 H12 N4 O4 S -","- C52 H48 N16 O16 S4 -","4","1","","Vadakkedathu Palakkeezhillam, Vishnunarayanan Namboothiri; Haribabu, Jebiti; Karthik, K. S.; Suresh Kumar, Vaishnu; Manakkadan, Vipin; Rasin, Puthiyavalappil; Garg, Mohith; Arulraj, Arunachalam; Moraga, Daniel; Sreekanth, Anandaram","Functionalized nitro-piperonal thiosemicarbazone based ruthenium(ii)–arene complexes for DNA interaction, anticancer and flow cytometry studies","New Journal of Chemistry","2025","49","26","11531","11547","10.1039/D5NJ00749F","","","0.71073","MoKα","","0.099","0.0738","","","0.221","0.2577","","","","","","0.908","","","","has coordinates","301036","2025-07-06","17:30:01",""
"7063848","13.8239","0.0008","14.3869","0.0008","14.0803","0.0007","90","","117.586","0.002","90","","2482","0.2","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 Cl N4 O5 Ru S -","- C23 H27 Cl N4 O5 Ru S -","- C92 H108 Cl4 N16 O20 Ru4 S4 -","4","1","","Vadakkedathu Palakkeezhillam, Vishnunarayanan Namboothiri; Haribabu, Jebiti; Karthik, K. S.; Suresh Kumar, Vaishnu; Manakkadan, Vipin; Rasin, Puthiyavalappil; Garg, Mohith; Arulraj, Arunachalam; Moraga, Daniel; Sreekanth, Anandaram","Functionalized nitro-piperonal thiosemicarbazone based ruthenium(ii)–arene complexes for DNA interaction, anticancer and flow cytometry studies","New Journal of Chemistry","2025","49","26","11531","11547","10.1039/D5NJ00749F","","","0.71073","MoKα","","0.0441","0.0334","","","0.0777","0.0856","","","","","","1.007","","","","has coordinates","301036","2025-07-06","17:30:01",""
"7063849","20.9609","0.0009","20.9609","0.0009","17.7989","0.0007","90","","90","","90","","7820.1","0.6","150.15","","150.15","","","","","","","","","7","I 4/m","-I 4","87","","","","- C41 H43 Cl Co N2 P3 Si -","- C41 H43 Cl Co N2 P3 Si -","- C328 H344 Cl8 Co8 N16 P24 Si8 -","8","0.5","","Li, Qingshuang; Wei, Lanfeng; Sun, Hongjian; Fuhr, Olaf; Fenske, Dieter; Hinz, Alexander; Li, Xiaoyan","Improvement of Regioselectivity of Alkene Hydrosilylation Catalyzed by [PNSiNP] Pincer Cobalt(III) Hydrides Using Sodium Methoxide as an Additive","New Journal of Chemistry","2025","49","27","11646","11653","10.1039/D5NJ01460C","","","0.71073","MoKα","","0.0628","0.0391","","","0.0949","0.1027","","","","","","1.047","","","","has coordinates,has disorder","301442","2025-08-04","07:36:25",""
"7063850","15.4377","0.0003","10.88817","0.00018","18.203","0.0003","90","","107.275","0.0018","90","","2921.69","0.09","173","","173","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H49 Cl Co N2 P3 Si -","- C24 H49 Cl Co N2 P3 Si -","- C96 H196 Cl4 Co4 N8 P12 Si4 -","4","1","","Li, Qingshuang; Wei, Lanfeng; Sun, Hongjian; Fuhr, Olaf; Fenske, Dieter; Hinz, Alexander; Li, Xiaoyan","Improvement of Regioselectivity of Alkene Hydrosilylation Catalyzed by [PNSiNP] Pincer Cobalt(III) Hydrides Using Sodium Methoxide as an Additive","New Journal of Chemistry","2025","49","27","11646","11653","10.1039/D5NJ01460C","","","1.54184","CuKα","","0.0673","0.0546","","","0.1394","0.1537","","","","","","1.057","","","","has coordinates","301442","2025-08-04","07:36:25",""
"7063851","8.1723","0.0005","13.2099","0.0009","22.6697","0.0015","75.162","0.002","82.507","0.002","79.423","0.002","2316.5","0.3","100","2","100.04","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H27 B Cl2 Zr -","- C26 H27 B Cl2 Zr -","- C104 H108 B4 Cl8 Zr4 -","4","2","","Zhang, Hui; Liu, Yu; Liu, Zhengxiong; Wang, Yin; Ren, Wei","DFT analysis and synthesis of anthracene analogues via zirconocene-mediated dimerization of boron-centered precursors","New Journal of Chemistry","2025","49","25","10949","10953","10.1039/D5NJ02125A","","","0.71073","MoKα","","0.0975","0.0524","","","0.1092","0.1272","","","","","","1.018","","","","has coordinates","301059","2025-07-06","17:34:46",""
"7063852","5.9539","0.0003","11.1308","0.0006","11.705","0.0007","78.746","0.002","86.935","0.002","79.975","0.002","749.03","0.07","150","2","150","2","","","","","","","","4","P -1","-P 1","2","ORGANIC","","","- C20 H18 N2 O0 -","- C20 H18 N2 -","- C40 H36 N4 -","2","1","","Patra, Goutam Kumar; Dutta, Srishti; Kumar, Dishen; Pandey, Abhilash; Manna, Sounik; Choudhury, Sujata Maiti; Sahu, Devanand; Sharma, Vanshika; Kumari, Niraj","2,3-diphenyl-5,6,7,8-tetrahydroquinoxaline based potential optical chemosensor for detection of Ni2+ ions: Anticancer activity and biosensor imaging","New Journal of Chemistry","2025","49","27","11906","11919","10.1039/D5NJ01816A","","","0.71073","MoKα","","0.0867","0.0506","","","0.1123","0.136","","","","","","1.03","","","","has coordinates","301442","2025-08-04","07:36:25",""
"7063853","11.917","0.004","16.287","0.006","30.181","0.01","90","","90","","90","","5858","4","273","2","273.15","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H24 N24 O15 -","- C14 H24 N24 O15 -","- C112 H192 N192 O120 -","8","1","","Zou, Jia; Zhang, Li; Chen, Zhengguo; Li, Haoran; Zhou, Qianzai; Wang, Xinyu; Huang, Ming; Yu, SiJia; Yang, Haijun","A novel pentazolate with a delocalized cation and its cocrystal","New Journal of Chemistry","2025","49","25","10922","10927","10.1039/D5NJ00733J","","","0.71073","MoKα","","0.0722","0.0603","","","0.1592","0.17","","","","","","1.093","","","","has coordinates","301060","2025-07-06","17:35:03",""
"7063854","13.0759","0.0009","8.8455","0.0006","13.5603","0.0009","90","","107.872","0.003","90","","1492.74","0.18","273","2","273.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H12 N10 O9 -","- C7 H12 N10 O9 -","- C28 H48 N40 O36 -","4","1","","Zou, Jia; Zhang, Li; Chen, Zhengguo; Li, Haoran; Zhou, Qianzai; Wang, Xinyu; Huang, Ming; Yu, SiJia; Yang, Haijun","A novel pentazolate with a delocalized cation and its cocrystal","New Journal of Chemistry","2025","49","25","10922","10927","10.1039/D5NJ00733J","","","0.71073","MoKα","","0.0528","0.0459","","","0.1284","0.136","","","","","","1.029","","","","has coordinates","301060","2025-07-06","17:35:03",""
"7063855","12.2247","0.0002","9.2088","0.0001","14.6416","0.0002","90","","98.134","0.002","90","","1631.69","0.04","160","0.1","160","0.1","","","","","","","","4","I 1 2 1","I 2y","5","","","","- C18 H16 N2 O6 -","- C18 H16 N2 O6 -","- C72 H64 N8 O24 -","4","1","","Sneka, Chinnaiyah; Manikandan, Balasubramaniyam; Thamotharan, Subbiah; Blacque, Olivier; Selva Ganesan, Subramaniapillai","A concise and highly diastereoselective one-pot synthesis of vicinal tetrasubstituted furofuran analogues","New Journal of Chemistry","2025","49","26","11297","11303","10.1039/D5NJ01435B","","x-ray","1.54184","CuKα","","0.0272","0.0258","","","0.0671","0.0684","","","","","","1.057","","","","has coordinates","301035","2025-07-06","17:29:53",""
"7063856","10.7014","0.0006","13.0096","0.0006","13.6186","0.0007","90.271","0.004","111.301","0.005","98.392","0.004","1744.12","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C2.42 H2.12 N0.3 O0.12 -","- C2.42424 H2.12121 N0.30303 O0.121212 -","- C80 H70 N10 O4 -","33","16.5","","Kumar, Ram; Singh, Bholey; Kakkar, Rita; Pani, Balaram","Multifunctional rhodamine Schiff base sensor for Pb2+: fluorogenic switching, reusability, and structural elucidation through spectroscopic and molecular simulation","New Journal of Chemistry","2025","49","26","11475","11492","10.1039/D5NJ01755F","","","0.71073","MoKα","","0.0987","0.0718","","","0.2092","0.2292","","","","","","1.093","","","","has coordinates","301038","2025-07-06","17:30:26",""
"7063857","8.3914","0.0007","11.9823","0.0009","13.805","0.0012","86.538","0.003","86.395","0.003","72.921","0.003","1322.95","0.19","120","2","120","","","","","","","","","5","P -1","-P 1","2","","","","- C29 H28 Mn N5 O5 -","- C29 H28 Mn N5 O5 -","- C58 H56 Mn2 N10 O10 -","2","1","","Ahmad, Reyaz; Choudhary, Mukesh","Synthesis and design of manganese and nickel complexes with potential anticancer and antibacterial activities, and antiviral properties for therapeutic applications","New Journal of Chemistry","2025","49","28","12401","12422","10.1039/D5NJ00268K","","","0.71073","MoKα","","0.0663","0.0571","","","0.1426","0.1478","","","","","","1.169","","","","has coordinates","301442","2025-08-04","07:36:27",""
"7063858","10.6283","0.0007","10.9606","0.0007","12.4775","0.0008","86.96","0.002","87.375","0.003","64.662","0.002","1311.43","0.15","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H28 N4 Ni O5 S -","- C28 H28 N4 Ni O5 S -","- C56 H56 N8 Ni2 O10 S2 -","2","1","","Ahmad, Reyaz; Choudhary, Mukesh","Synthesis and design of manganese and nickel complexes with potential anticancer and antibacterial activities, and antiviral properties for therapeutic applications","New Journal of Chemistry","2025","49","28","12401","12422","10.1039/D5NJ00268K","","","0.71073","MoKα","","0.0402","0.0364","","","0.0898","0.0921","","","","","","1.033","","","","has coordinates","301442","2025-08-04","07:36:36",""
"7063859","5.2219","0.0004","15.7746","0.0013","15.8751","0.0013","118.016","0.002","95.149","0.003","90.249","0.003","1148.18","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H56 Cu N8 O13 -","- C50 H56 Cu N8 O13 -","- C50 H56 Cu N8 O13 -","1","0.5","","Xue, Lujiadai; Gao, Guie; Deng, Yajuan; Zhou, Shimin; Luan, Jian; Zheng, Shaolie; Wang, Xiaoyu","Anti-cancer potential of a new bioactive copper-based coordination polymer against cervical cancer","New Journal of Chemistry","2025","49","29","12561","12567","10.1039/D5NJ01294E","","","0.71073","MoKα","","0.1482","0.1351","","","0.3754","0.3837","","","","","","1.047","","","","has coordinates,has disorder","301615","2025-08-05","22:20:24",""
"7063860","7.7077","0.0001","10.5183","0.0001","12.6883","0.0001","97.407","0.001","91.858","0.001","93.375","0.001","1017.48","0.018","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H22 I N O3 S -","- C20 H22 I N O3 S -","- C40 H44 I2 N2 O6 S2 -","2","1","","Uota, Sisay; Gross, Daniella; Hwang, Bor-Jang; Butcher, Raymond; Hijji, Yousef; Wachira, James; Tadesse, Solomon; Edwards, Jesse; Edwards, Kyle; Abebe, Fasil","A “turn-off” ICT-based optical probe for the selective detection of cyanide ions in real samples","New Journal of Chemistry","2025","49","28","12218","12230","10.1039/D5NJ01489A","","","1.54184","CuKα","","0.0256","0.0249","","","0.0685","0.069","","","","","","1.054","","","","has coordinates","301442","2025-08-04","07:36:38",""
"7063861","14.5049","0.0007","14.5049","0.0007","8.4681","0.0004","90","","90","","120","","1542.93","0.13","298","2","298","2","","","","","","","","4","P 31","P 31","144","","","","- C26 H17 N O3 -","- C26 H17 N O3 -","- C78 H51 N3 O9 -","3","1","","Rodríguez, Humberto A.; Cruz, Daniel A.; Padrón, Juan I.; Lorenzo-Luis, Pablo","(S)-BINOL-derived chiral picolinate ligand as a platform for new polymer frameworks: a pilot study on the effect of the binaphthyl scaffold vs. picolinate","New Journal of Chemistry","2025","49","30","12940","12947","10.1039/D5NJ01654A","","x-ray","0.71073","MoKα","","0.0627","0.0473","","","0.0879","0.0951","","","","","","1.079","","","","has coordinates","301620","2025-08-05","22:22:07",""
"7063862","13.5985","0.0003","13.5985","0.0003","6.0863","0.0001","90","","90","","120","","974.69","0.03","298","2","298","2","","","","","","","","7","P -3","-P 3","147","","","","- C37 H27 F3 N6 O15 S Zn2 -","- C37 H27 F3 N6 O15 S Zn2 -","- C37 H27 F3 N6 O15 S Zn2 -","1","0.166667","","Rodríguez, Humberto A.; Cruz, Daniel A.; Padrón, Juan I.; Lorenzo-Luis, Pablo","(S)-BINOL-derived chiral picolinate ligand as a platform for new polymer frameworks: a pilot study on the effect of the binaphthyl scaffold vs. picolinate","New Journal of Chemistry","2025","49","30","12940","12947","10.1039/D5NJ01654A","","x-ray","0.71073","MoKα","","0.0332","0.0297","","","0.0693","0.071","","","","","","1.098","","","","has coordinates","301620","2025-08-05","22:22:07",""
"7063863","14.5386","0.0004","14.5386","0.0004","38.0549","0.0009","90","","90","","90","","8043.7","0.4","298","2","298","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C29 H27 Cu2 F6 N5 O12 S2 -","- C29 H27 Cu2 F6 N4.5 O12 S2 -","- C232 H216 Cu16 F48 N36 O96 S16 -","8","0.5","","Rodríguez, Humberto A.; Cruz, Daniel A.; Padrón, Juan I.; Lorenzo-Luis, Pablo","(S)-BINOL-derived chiral picolinate ligand as a platform for new polymer frameworks: a pilot study on the effect of the binaphthyl scaffold vs. picolinate","New Journal of Chemistry","2025","49","30","12940","12947","10.1039/D5NJ01654A","","","0.71073","MoKα","","0.1061","0.0887","","","0.2628","0.28","","","","","","1.0827","","","","has coordinates,has disorder","301620","2025-08-05","22:22:07",""
"7063864","10.425","0.0017","8.2092","0.0012","35.697","0.006","90","","90","","90","","3055","0.8","296","2","296.15","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H19 N3 O3 -","- C17 H19 N3 O3 -","- C136 H152 N24 O24 -","8","1","","Potla, Krishna Murthy; Vankayalapati , Suneetha; Osório, Francisco A. P.; Valverde, Clodoaldo; Raja, M.; Almarhoon, Zainab M.; Alam, Mahboob; Islam, Mohammad Shahidul","Mechanoluminescence and Nonlinear Optical Properties of a Self-Assembled Piperazine-Based Supramolecular System: Structural Insights and Computational Analysis","New Journal of Chemistry","2025","49","28","12439","12452","10.1039/D5NJ00633C","","","0.71073","MoKα","","0.1164","0.0758","","","0.1672","0.1862","","","","","","1.081","","","","has coordinates","301442","2025-08-04","07:36:49",""
"7063865","8.7719","0.0014","11.2287","0.0018","15.981","0.003","70.082","0.003","89.231","0.003","72.118","0.003","1401.1","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 F12 N8 Zn -","- C20 H18 F12 N8 Zn -","- C40 H36 F24 N16 Zn2 -","2","1","","Uvarova, Marina A.; Dolgushin, Fedor M.; Babeshkin, Konstantin A.; Efimov, Nikolay N.; Pettinari, Claudio; Eremenko, Igor L.; Nefedov, Sergey E.","Uncommon mononuclear pyrazole–pyrazolate complexes of CoII, CuII and Zn","New Journal of Chemistry","2025","49","30","13007","13014","10.1039/D5NJ02001H","","","0.71073","MoKα","","0.0803","0.054","","","0.1507","0.1727","","","","","","1.033","","","","has coordinates,has disorder","301618","2025-08-05","22:21:24",""
"7063866","17.982","0.003","17.969","0.003","15.915","0.003","90","","90","","90","","5142.4","1.6","120","2","120","2","","","","","","","","5","A e a 2","A 2 -2ab","41","","","","- C20 H18 Cu F12 N8 -","- C20 H18 Cu F12 N8 -","- C160 H144 Cu8 F96 N64 -","8","1","","Uvarova, Marina A.; Dolgushin, Fedor M.; Babeshkin, Konstantin A.; Efimov, Nikolay N.; Pettinari, Claudio; Eremenko, Igor L.; Nefedov, Sergey E.","Uncommon mononuclear pyrazole–pyrazolate complexes of CoII, CuII and Zn","New Journal of Chemistry","2025","49","30","13007","13014","10.1039/D5NJ02001H","","","0.71073","MoKα","","0.044","0.0376","","","0.0925","0.0966","","","","","","1.032","","","","has coordinates","301618","2025-08-05","22:21:25",""
"7063867","9.466","0.014","11.005","0.016","14.72","0.02","109.39","0.02","101.21","0.02","91.6","0.02","1412","4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 Co F12 N8 -","- C20 H18 Co F12 N8 -","- C40 H36 Co2 F24 N16 -","2","1","","Uvarova, Marina A.; Dolgushin, Fedor M.; Babeshkin, Konstantin A.; Efimov, Nikolay N.; Pettinari, Claudio; Eremenko, Igor L.; Nefedov, Sergey E.","Uncommon mononuclear pyrazole–pyrazolate complexes of CoII, CuII and Zn","New Journal of Chemistry","2025","49","30","13007","13014","10.1039/D5NJ02001H","","","0.71073","MoKα","","0.0885","0.0524","","","0.1314","0.1517","","","","","","1.016","","","","has coordinates,has disorder","301618","2025-08-05","22:21:25",""
"7063868","20.9937","0.0013","10.3294","0.0006","20.7409","0.0013","90","","107.436","0.001","90","","4291.1","0.5","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C31 H38 Cl2 Cu2 F12 N8 O4 -","- C31 H38 Cl2 Cu2 F12 N8 O4 -","- C124 H152 Cl8 Cu8 F48 N32 O16 -","4","0.5","","Uvarova, Marina A.; Dolgushin, Fedor M.; Babeshkin, Konstantin A.; Efimov, Nikolay N.; Pettinari, Claudio; Eremenko, Igor L.; Nefedov, Sergey E.","Uncommon mononuclear pyrazole–pyrazolate complexes of CoII, CuII and Zn","New Journal of Chemistry","2025","49","30","13007","13014","10.1039/D5NJ02001H","","","0.71073","MoKα","","0.049","0.0417","","","0.1097","0.1146","","","","","","1.025","","","","has coordinates,has disorder","301618","2025-08-05","22:21:25",""
"7063869","15.4218","0.0002","37.1781","0.0005","46.2728","0.0007","90","","90","","90","","26530.7","0.6","150","2","150","0.2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C42 H44 Co N5 P2 S4 -","- C42 H44 Co N5 P2 S4 -","- C1008 H1056 Co24 N120 P48 S96 -","24","6","","Srivastava, Shreya; Srivastava, Devyani; Kushwaha, Aparna; Omoding, Daniel; Kociok-Köhn, Gabriele; Kumar, Abhinav","New 1,2-bis(diphenylphosphino)ethane-laden Co(iii) dithiolate anions: dithiolate-mediated tuning of electrocatalytic performance for non-aqueous hydrogen evolution reaction","New Journal of Chemistry","2025","49","30","13175","13188","10.1039/D5NJ02374B","","x-ray","0.71073","MoKα","","0.1022","0.0696","","","0.1425","0.1605","","","","","","1.072","","","","has coordinates,has disorder","301619","2025-08-05","22:21:44",""
"7063870","10.3965","0.0005","31.2909","0.0017","11.7562","0.0006","90","","105.832","0.003","90","","3679.4","0.3","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C86.4 H46.6 Eu2 F13 N4 O12 -","- C86.4 H46.6 Eu2 F13 N4 O12 -","- C172.8 H93.2 Eu4 F26 N8 O24 -","2","0.5","","Levina, Anastasia A.; Chistyakov, Aleksandr S.; Shmelev, Maxim A.; Varaksina, Evgeniya A.; Voronina, Julia K.; Gogoleva, Natalia V.; Taydakov, Ilya V.; Sidorov, Alexey. A.; Eremenko, Igor. L.","Effects of combining fluorinated and non-fluorinated monocarboxylate anions in lanthanide complexes on the structure and photoluminescence properties","New Journal of Chemistry","2025","49","30","12959","12970","10.1039/D5NJ01296A","","","1.54178","CuKα","","0.0881","0.0779","","","0.1725","0.177","","","","","","1.222","","","","has coordinates,has disorder","301621","2025-08-05","22:22:19",""
"7063871","8.1936","0.0009","13.816","0.002","14.573","0.002","94.343","0.006","91.165","0.004","100.944","0.005","1614","0.4","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C74 H34 Eu2 F20 N4 O14 -","- C74 H34 Eu2 F20 N4 O14 -","- C74 H34 Eu2 F20 N4 O14 -","1","0.5","","Levina, Anastasia A.; Chistyakov, Aleksandr S.; Shmelev, Maxim A.; Varaksina, Evgeniya A.; Voronina, Julia K.; Gogoleva, Natalia V.; Taydakov, Ilya V.; Sidorov, Alexey. A.; Eremenko, Igor. L.","Effects of combining fluorinated and non-fluorinated monocarboxylate anions in lanthanide complexes on the structure and photoluminescence properties","New Journal of Chemistry","2025","49","30","12959","12970","10.1039/D5NJ01296A","","","0.71073","MoKα","","0.0651","0.0465","","","0.0892","0.0964","","","","","","1.026","","","","has coordinates","301621","2025-08-05","22:22:20",""
"7063872","12.814","0.003","13.154","0.003","13.473","0.003","78.612","0.006","87.418","0.006","78.377","0.006","2180.6","0.9","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C98 H68 Eu2 F14 N8 O12 -","- C98 H68 Eu2 F14 N8 O12 -","- C98 H68 Eu2 F14 N8 O12 -","1","0.5","","Levina, Anastasia A.; Chistyakov, Aleksandr S.; Shmelev, Maxim A.; Varaksina, Evgeniya A.; Voronina, Julia K.; Gogoleva, Natalia V.; Taydakov, Ilya V.; Sidorov, Alexey. A.; Eremenko, Igor. L.","Effects of combining fluorinated and non-fluorinated monocarboxylate anions in lanthanide complexes on the structure and photoluminescence properties","New Journal of Chemistry","2025","49","30","12959","12970","10.1039/D5NJ01296A","","","0.71073","MoKα","","0.0581","0.0412","","","0.0971","0.1047","","","","","","1.028","","","","has coordinates","301621","2025-08-05","22:22:20",""
"7063873","11.7808","0.0015","14.0813","0.0017","14.552","0.0018","61.931","0.003","78.366","0.004","67.495","0.004","1967.2","0.4","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C46 H46 Cl6 N8 O4 Si2 -","- C46 H46 Cl6 N8 O4 Si2 -","- C46 H46 Cl6 N8 O4 Si2 -","1","0.5","","Ni, Congjian; Ma, Xiaoli; Yang, Zhi","Synthesis, structure, and characterization of a novel heterocyclic organosilicon-quinone adduct","New Journal of Chemistry","2025","49","31","13352","13356","10.1039/D5NJ00982K","","","0.71073","MoKα","","0.1623","0.1011","","","0.2552","0.2926","","","","","","1.081","","","","has coordinates,has disorder","301627","2025-08-05","22:24:00",""
"7063874","15.455","0.002","17.685","0.002","18.393","0.002","90","","111.388","0.007","90","","4681","1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Terbium-benzimidazole","Tb(fod)3(bzi)","","- C37 H36 F21 N2 O6 Tb -","- C37.021 H36.063 F21 N2 O6 Tb -","- C148.084 H144.252 F84 N8 O24 Tb4 -","4","1","","Ali, Asgar; Ahmed, Zubair; Iftikhar, Khalid; Uddin, Rahis","Photophysical studies of low-symmetry Sm(iii) and Tb(iii) complexes reveal remarkable quantum yields","New Journal of Chemistry","2025","49","28","12368","12381","10.1039/D5NJ01687H","","","1.54178","CuKα","","0.0825","0.0549","","","0.1365","0.1569","","","","","","1.051","","","","has coordinates,has disorder","301442","2025-08-04","07:36:49",""
"7063875","34.7416","0.0015","29.0218","0.0007","46.1827","0.0017","90","","113.616","0.005","90","","42665","3","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C238 H184 Eu4 F36 N16 O24.5 -","- C238 H184 Eu4 F36 N16 O24.5 -","- C952 H736 Eu16 F144 N64 O98 -","4","1","","Guo, Feng; Zhang, Xiao-Wei; Wu, Jin-Xiu; Liu, Zhao-Gang","Chiral Eu(iii) tetrahedral cage: circularly polarized luminescence induced by an ancillary chiral terpyridyl ligand","New Journal of Chemistry","2025","49","29","12708","12715","10.1039/D5NJ01193K","","x-ray","0.71073","MoKα","","0.1266","0.0902","","","0.2509","0.2888","","","","","","1.056","","","","has coordinates,has disorder","301616","2025-08-05","22:20:38",""
"7063876","12.171","0.0017","17.084","0.002","19.615","0.003","90","","97.351","0.004","90","","4045","1","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H34 Cl2 N10 O12 Zn -","- C33 H34 Cl2 N10 O12 Zn -","- C132 H136 Cl8 N40 O48 Zn4 -","4","1","","Das, Bhriguram; Giri, Pravat K.; Barman, Milan K.; Upadhyaya, Priyanka; Pakrashy, Sourav; Dolai, Malay","Quinoline-based bio-compatible fluorophore employing a dual sensor for Mg(ii) and Zn(ii): insights from single crystal structures and spectroscopic, DFT and cell imaging studies","New Journal of Chemistry","2025","49","31","13666","13677","10.1039/D5NJ01265A","","","0.71073","MoKα","","0.0976","0.0731","","","0.2207","0.2315","","","","","","1.587","","","","has coordinates","301624","2025-08-05","22:23:10",""
"7063877","22.6848","0.0012","18.0621","0.0009","16.8994","0.0009","90","","115.938","0.002","90","","6226.8","0.6","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C68 H74 N20 O7 -","- C68 H74 N20 O7 -","- C272 H296 N80 O28 -","4","0.5","","Das, Bhriguram; Giri, Pravat K.; Barman, Milan K.; Upadhyaya, Priyanka; Pakrashy, Sourav; Dolai, Malay","Quinoline-based bio-compatible fluorophore employing a dual sensor for Mg(ii) and Zn(ii): insights from single crystal structures and spectroscopic, DFT and cell imaging studies","New Journal of Chemistry","2025","49","31","13666","13677","10.1039/D5NJ01265A","","","1.54178","CuKα","","0.0709","0.0676","","","0.2187","0.221","","","","","","1.809","","","","has coordinates","301624","2025-08-05","22:23:11",""
"7063878","12.884","0.0006","15.2319","0.0008","15.1533","0.0007","90","","113.908","0.002","90","","2718.6","0.2","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(4-oxo-2-phenyl-4H-chromen-3-olate)-(1-methyl-4-((6-methylpyridin-2-yl)methyl)-1,4-diazepane)-copper(II) perchlorate","","- C28 H30 Cl Cu N3 O7 -","- C28 H30 Cl Cu N3 O7 -","- C112 H120 Cl4 Cu4 N12 O28 -","4","1","","Ajaykamal, Tamilarasan; Bharadwaj, Vishnubhotla V. Sai Siva; Köckerling, Martin; Vadivelu, Prabha; Palaniandavar, Mallayan","Copper(ii)-flavonolate complexes of sterically hindering 3N ligands as enzyme-substrate models for copper(ii) quercetin 2,4-dioxygenase: experimental and computational study on the dioxygenation reactivity","New Journal of Chemistry","2025","49","29","12861","12874","10.1039/D4NJ05389C","","","0.71073","MoKα","","0.0849","0.0564","","","0.1383","0.1606","","","","","","1.023","","","","has coordinates","301617","2025-08-05","22:20:47",""
"7063879","9.2636","0.0012","9.3983","0.0019","17.871","0.003","85.111","0.008","87.555","0.006","69.989","0.005","1456.5","0.4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H36 Co2 N7 O14 -","- C20 H36 Co2 N7 O14 -","- C40 H72 Co4 N14 O28 -","2","1","","Vidya, Kannan Sree; Yamuna, Ganesh; Bhuvanesh, Nattamai; Ghosh, Ayyan; Dasgupta, Sreeja; Mandal, Sukanta; Vasanthkumar, Rajkumar; Gurusaravanan, Packiaraj; Sundaravel, Karuppasamy","Impact of ligand steric hindrance on the phenoxazinone synthase-like reactivity and antibacterial activity of cobalt(iii) complexes of N2O donor ligands","New Journal of Chemistry","2025","49","20","8576","8593","10.1039/D5NJ00515A","","","0.71073","MoKα","","0.0402","0.0348","","","0.0963","0.0999","","","","","","1.013","","","","has coordinates","300374","2025-07-05","22:27:37",""
"7063880","9.4192","0.0002","10.3525","0.0002","10.7729","0.0003","101.111","0.002","103.881","0.002","96.082","0.002","987.84","0.04","100","0.1","100","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C16 H23 Co N6 O8 -","- C16 H23 Co N6 O8 -","- C32 H46 Co2 N12 O16 -","2","1","","Vidya, Kannan Sree; Yamuna, Ganesh; Bhuvanesh, Nattamai; Ghosh, Ayyan; Dasgupta, Sreeja; Mandal, Sukanta; Vasanthkumar, Rajkumar; Gurusaravanan, Packiaraj; Sundaravel, Karuppasamy","Impact of ligand steric hindrance on the phenoxazinone synthase-like reactivity and antibacterial activity of cobalt(iii) complexes of N2O donor ligands","New Journal of Chemistry","2025","49","20","8576","8593","10.1039/D5NJ00515A","","x-ray","1.54184","CuKα","","0.0331","0.0312","","","0.0829","0.0834","","","","","","1.086","","","","has coordinates","300374","2025-07-05","22:27:57",""
"7063881","14.3873","0.0004","20.8399","0.0006","15.6429","0.0004","90","","99.425","0.003","90","","4626.9","0.2","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H30.84 Co N6 O9.92 -","- C18 H30.84 Co N6 O9.92 -","- C144 H246.72 Co8 N48 O79.36 -","8","2","","Vidya, Kannan Sree; Yamuna, Ganesh; Bhuvanesh, Nattamai; Ghosh, Ayyan; Dasgupta, Sreeja; Mandal, Sukanta; Vasanthkumar, Rajkumar; Gurusaravanan, Packiaraj; Sundaravel, Karuppasamy","Impact of ligand steric hindrance on the phenoxazinone synthase-like reactivity and antibacterial activity of cobalt(iii) complexes of N2O donor ligands","New Journal of Chemistry","2025","49","20","8576","8593","10.1039/D5NJ00515A","","x-ray","1.54184","CuKα","","0.0622","0.0573","","","0.1559","0.1596","","","","","","1.084","","","","has coordinates,has disorder","300374","2025-07-05","22:28:04",""
"7063882","10.7531","0.0003","11.655","0.0003","13.0553","0.0003","114.72","0.002","110.413","0.002","95.321","0.002","1337.1","0.07","100.01","0.1","100.01","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C38 H24 Cu N2 O2 -","- C38 H24 Cu N2 O2 -","- C76 H48 Cu2 N4 O4 -","2","1","","Sarkar, Gayetri; Paramanik, Krishnendu; Bandopadhyay, Nilaj; Chatterjee, Souvik; Saha, Subhajit; Panda, Subhra Jyoti; Purohit, Chandra Shekhar; Biswas, Bhaskar; Das, Hari Sankar","Copper(ii) phenalenyl complexes: structures, redox properties and catalytic activity towards Sonogashira coupling reactions","New Journal of Chemistry","2025","49","20","8232","8238","10.1039/D5NJ00906E","","x-ray","1.54184","CuKα","","0.0439","0.0405","","","0.1113","0.1141","","","","","","1.085","","","","has coordinates","300375","2025-07-05","22:29:06",""
"7063883","10.3285","0.0002","11.4386","0.0002","15.1218","0.0002","98.861","0.001","90.675","0.001","115.378","0.002","1588.81","0.05","99.91","0.19","99.91","0.19","","","","","","","","2","P -1","-P 1","2","","","","- C24 H16 -","- C24 H16 -","- C96 H64 -","4","2","","Sarkar, Gayetri; Paramanik, Krishnendu; Bandopadhyay, Nilaj; Chatterjee, Souvik; Saha, Subhajit; Panda, Subhra Jyoti; Purohit, Chandra Shekhar; Biswas, Bhaskar; Das, Hari Sankar","Copper(ii) phenalenyl complexes: structures, redox properties and catalytic activity towards Sonogashira coupling reactions","New Journal of Chemistry","2025","49","20","8232","8238","10.1039/D5NJ00906E","","x-ray","1.54184","CuKα","","0.0503","0.0451","","","0.1226","0.1271","","","","","","1.071","","","","has coordinates","300375","2025-07-05","22:29:18",""
"7063884","4.4721","0.0001","13.4666","0.0004","14.7928","0.0004","90","","93.28","0.002","90","","889.42","0.04","110","16","110","16","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H14 Cu O4 -","- C26 H14 Cu O4 -","- C52 H28 Cu2 O8 -","2","0.5","","Sarkar, Gayetri; Paramanik, Krishnendu; Bandopadhyay, Nilaj; Chatterjee, Souvik; Saha, Subhajit; Panda, Subhra Jyoti; Purohit, Chandra Shekhar; Biswas, Bhaskar; Das, Hari Sankar","Copper(ii) phenalenyl complexes: structures, redox properties and catalytic activity towards Sonogashira coupling reactions","New Journal of Chemistry","2025","49","20","8232","8238","10.1039/D5NJ00906E","","x-ray","1.54184","CuKα","","0.0328","0.0322","","","0.0935","0.094","","","","","","1.092","","","","has coordinates","300375","2025-07-05","22:29:29",""
"7063885","16.7265","0.0003","3.759","0.0001","21.7296","0.0003","90","","96.719","0.002","90","","1356.86","0.05","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H26 Cu O6 -","- C38 H26 Cu O6 -","- C76 H52 Cu2 O12 -","2","0.5","","Sarkar, Gayetri; Paramanik, Krishnendu; Bandopadhyay, Nilaj; Chatterjee, Souvik; Saha, Subhajit; Panda, Subhra Jyoti; Purohit, Chandra Shekhar; Biswas, Bhaskar; Das, Hari Sankar","Copper(ii) phenalenyl complexes: structures, redox properties and catalytic activity towards Sonogashira coupling reactions","New Journal of Chemistry","2025","49","20","8232","8238","10.1039/D5NJ00906E","","x-ray","1.54184","CuKα","","0.0419","0.0395","","","0.1135","0.1157","","","","","","1.075","","","","has coordinates","300375","2025-07-05","22:29:33",""
"7063886","19.153","0.0005","10.6458","0.0003","18.1359","0.0004","90","","114.701","0.001","90","","3359.54","0.15","170","","170","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H15 N O5 -","- C21 H15 N O5 -","- C168 H120 N8 O40 -","8","1","","Xia, Shendan; Wang, Chaojie; Xu, Yuyan; Zheng, Hao; Chen, Zhiwei","Metal-free three-component reactions of alkynes for the construction of 3,4-difunctionalized benzo[h]coumarins","New Journal of Chemistry","2025","49","18","7541","7545","10.1039/D5NJ00599J","","","0.71073","MoKα","","0.048","0.0409","","","0.1024","0.1082","","","","","","1.047","","","","has coordinates","300376","2025-07-05","22:30:34",""
"7063887","6.7083","0.0004","4.0046","0.0003","29.4801","0.0018","90","","92.687","0.003","90","","791.08","0.09","193","","193","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H7 Br N2 O -","- C8 H7 Br N2 O -","- C32 H28 Br4 N8 O4 -","4","1","","Wan, Boheng; Cui, Kairan; Xu, Jie; Xing, Shaohua; Zhu, Zimo; Lai, Yang; Wu, Sheng; Guo, Jiaxuan; Chen, Yadong; Lu, Tao; Feng, Jie; Zhu, Yong","Metal-free selective alcohol oxidation via quinazolinone: mechanistic insights and sustainable applications","New Journal of Chemistry","2025","49","18","7314","7318","10.1039/D5NJ00893J","","x-ray","1.34139","GaKα","","0.0399","0.0353","","","0.0936","0.0981","","","","","","1.057","","","","has coordinates","300377","2025-07-05","22:31:48",""
"7063888","11.0506","0.0011","16.3601","0.0014","16.9891","0.0015","90","","126.359","0.006","90","","2473.5","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 Br Cl Cu N4 O5 -","- C23 H24 Br Cl Cu N4 O5 -","- C92 H96 Br4 Cl4 Cu4 N16 O20 -","4","1","","Ari, Biman; Das, Manik; Mukherjee, Somali; Basak, Deblina; Bera, Analava; Biswas, Arunima; Kundu, Pronab; Brandao, Paola; Mondal, Shrabani; Samanta, Bidhan Chandra; Maity, Tithi","Experimental and theoretical studies on piperidine-based heteroleptic Schiff base Ni(ii) and Cu(ii) complexes investigating DNA/protein binding and anticancer activities","New Journal of Chemistry","2025","49","31","13446","13462","10.1039/D5NJ02225H","","","0.71073","MoKα","","0.2082","0.0567","","","0.1112","0.1565","","","","","","0.95","","","","has coordinates","301623","2025-08-05","22:22:46",""
"7063889","10.6529","0.0007","21.2436","0.0013","8.6654","0.0006","90","","90.147","0.003","90","","1961","0.2","293.15","","293.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H46 Br2 N12 Ni2 O4 -","- C32 H46 Br2 N12 Ni2 O4 -","- C64 H92 Br4 N24 Ni4 O8 -","2","0.5","","Ari, Biman; Das, Manik; Mukherjee, Somali; Basak, Deblina; Bera, Analava; Biswas, Arunima; Kundu, Pronab; Brandao, Paola; Mondal, Shrabani; Samanta, Bidhan Chandra; Maity, Tithi","Experimental and theoretical studies on piperidine-based heteroleptic Schiff base Ni(ii) and Cu(ii) complexes investigating DNA/protein binding and anticancer activities","New Journal of Chemistry","2025","49","31","13446","13462","10.1039/D5NJ02225H","","","0.71073","MoKα","","0.0354","0.032","","","0.0819","0.0833","","","","","","1.119","","","","has coordinates","301623","2025-08-05","22:22:57",""
"7063890","7.1868","0.0006","11.086","0.001","12.1627","0.0011","92.586","0.003","99.183","0.003","101.063","0.003","935.97","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 N O3 P -","- C22 H20 N O3 P -","- C44 H40 N2 O6 P2 -","2","1","","Slobodskaia, Serafima S.; Tsebrikova, Galina S.; Ivanova, Irina S.; Solov'ev, Vitaly P.; Ilyukhin, Andrey B.; He, Tao; Pyatova, Elena N.; Galkina, Elena N.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Phosphoryl-containing derivatives of 8-hydroxyquinoline for the selective detection of uranyl cations","New Journal of Chemistry","2025","49","31","13527","13538","10.1039/D5NJ01822F","","","0.71073","MoKα","","0.1228","0.0611","","","0.1171","0.1486","","","","","","1.025","","","","has coordinates","301626","2025-08-05","22:23:41",""
"7063891","9.6536","0.0006","11.2118","0.0007","12.9305","0.0008","105.899","0.002","111.054","0.002","93.727","0.002","1235.14","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H29 Cl2 N O6.5 P -","- C22 H29 Cl2 N O6.5 P -","- C44 H58 Cl4 N2 O13 P2 -","2","1","","Slobodskaia, Serafima S.; Tsebrikova, Galina S.; Ivanova, Irina S.; Solov'ev, Vitaly P.; Ilyukhin, Andrey B.; He, Tao; Pyatova, Elena N.; Galkina, Elena N.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Phosphoryl-containing derivatives of 8-hydroxyquinoline for the selective detection of uranyl cations","New Journal of Chemistry","2025","49","31","13527","13538","10.1039/D5NJ01822F","","","0.71073","MoKα","","0.0664","0.0475","","","0.1006","0.1084","","","","","","1.061","","","","has coordinates,has disorder","301626","2025-08-05","22:23:50",""
"7063892","8.085","0.0007","16.7576","0.0015","11.3946","0.0009","90","","110.679","0.002","90","","1444.3","0.2","100","2","100","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C20 H21 N6 O19 P U -","- C20 H21 N6 O19 P U -","- C40 H42 N12 O38 P2 U2 -","2","0.5","","Slobodskaia, Serafima S.; Tsebrikova, Galina S.; Ivanova, Irina S.; Solov'ev, Vitaly P.; Ilyukhin, Andrey B.; He, Tao; Pyatova, Elena N.; Galkina, Elena N.; Baulin, Vladimir E.; Tsivadze, Aslan Yu.","Phosphoryl-containing derivatives of 8-hydroxyquinoline for the selective detection of uranyl cations","New Journal of Chemistry","2025","49","31","13527","13538","10.1039/D5NJ01822F","","","0.71073","MoKα","","0.0412","0.037","","","0.0901","0.093","","","","","","1.128","","","","has coordinates,has disorder","301626","2025-08-05","22:23:50",""
"7063893","29.4663","0.0017","10.4668","0.0005","8.6344","0.0005","90","","95.322","0.003","90","","2651.5","0.3","296","2","296.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 Cl2 Cu N2 O -","- C12 H12 Cl2 Cu N2 O -","- C96 H96 Cl16 Cu8 N16 O8 -","8","1","","Kumar, Bidyapati; Chatterjee, Abhishikta; Chakraborty, Priyanka; Mandal, Sourav; Dey, Subrata K.","A mononuclear Cu(ii) complex as a functional mimic of both catechol oxidase and phenoxazinone synthase","New Journal of Chemistry","2025","49","32","13849","13857","10.1039/D5NJ02504D","","","0.71073","MoKα","","0.0612","0.0436","","","0.1203","0.1435","","","","","","1.139","","","","has coordinates","302719","2025-10-06","10:12:19",""
"7063894","13.7455","0.0014","11.5943","0.0012","18.7396","0.0019","90","","100.723","0.007","90","","2934.4","0.5","297","","297","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H22 Cl4 N4 Zn -","- C30 H22 Cl4 N4 Zn -","- C120 H88 Cl16 N16 Zn4 -","4","1","","Li, Mengmeng; Du, Zhi-Hong; Bo, Chunbo; Li, Min; Chen, Fei; Liu, Ning","Zn–N3 complexes for the cycloaddition of epoxides with CO2 at atmospheric pressure","New Journal of Chemistry","2025","49","30","13125","13135","10.1039/D5NJ01560J","","","1.54178","CuKα","","0.0891","0.0619","","","0.1565","0.1811","","","","","","1.04","","","","has coordinates,has disorder","301622","2025-08-05","22:22:35",""
"7063895","11.2951","0.0012","8.832","0.0008","16.7065","0.0016","90","","95.713","0.003","90","","1658.3","0.3","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H12 Cl2 N4 Zn -","- C17 H12 Cl2 N4 Zn -","- C68 H48 Cl8 N16 Zn4 -","4","1","","Li, Mengmeng; Du, Zhi-Hong; Bo, Chunbo; Li, Min; Chen, Fei; Liu, Ning","Zn–N3 complexes for the cycloaddition of epoxides with CO2 at atmospheric pressure","New Journal of Chemistry","2025","49","30","13125","13135","10.1039/D5NJ01560J","","","0.71073","MoKα","","0.2325","0.14","","","0.2619","0.3072","","","","","","1.099","","","","has coordinates","301622","2025-08-05","22:22:35",""
"7063896","7.9227","0.0012","7.8186","0.0011","26.463","0.003","90","","90","","90","","1639.2","0.4","296","2","296","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C22 H17 N -","- C22 H17 N -","- C88 H68 N4 -","4","1","","Kujur, Jyoti Prabha; Pathak, Devendra Deo","Synthesis of a new copper(ii)-immobilized cross-linked chitosan biocomposite: its application as a heterogeneous catalyst in the synthesis of N-aryl propargylamines and their post-modification","New Journal of Chemistry","2025","49","31","13304","13317","10.1039/D5NJ02038G","","x-ray","0.71073","MoKα","","0.106","0.048","","","0.1041","0.1265","","","","","","1.016","","","","has coordinates","301625","2025-08-05","22:23:20",""
"7063897","17.5246","0.0005","11.8748","0.0003","13.3999","0.0004","90","","90","","90","","2788.53","0.13","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C33 H21 N5 O7 -","- C33 H21 N5 O7 -","- C132 H84 N20 O28 -","4","1","","Bharti, Shachendra Kumar; Odera, Keiko; Tripathi, Kamini; Ward, Benzamin D.; Bhattacharya, S.; Takahashi, Ryoya; Mishra, Lallan","Structural and chemical investigation of a tridentate fluorescein hydrazone (LH3), a selective Cu2+ and Hg2+ chelator: detection of CN− and HSO4− by its Cu2+ complexes and effect on HeLa cell division","New Journal of Chemistry","2025","49","33","14219","14230","10.1039/D5NJ01491C","","","0.71073","MoKα","","0.0567","0.042","","","0.1027","0.1118","","","","","","1.047","","","","has coordinates,has disorder","302723","2025-10-06","10:13:33",""
"7063898","18.1151","0.0002","16.9077","0.0002","21.8085","0.0003","90","","90","","90","","6679.61","0.14","99.97","0.15","99.97","0.15","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C35 H30 Cl Cu N5 O10 -","- C35 H30 Cl Cu N5 O10 -","- C280 H240 Cl8 Cu8 N40 O80 -","8","1","","Bharti, Shachendra Kumar; Odera, Keiko; Tripathi, Kamini; Ward, Benzamin D.; Bhattacharya, S.; Takahashi, Ryoya; Mishra, Lallan","Structural and chemical investigation of a tridentate fluorescein hydrazone (LH3), a selective Cu2+ and Hg2+ chelator: detection of CN− and HSO4− by its Cu2+ complexes and effect on HeLa cell division","New Journal of Chemistry","2025","49","33","14219","14230","10.1039/D5NJ01491C","","x-ray","1.54184","CuKα","","0.0533","0.0439","","","0.1189","0.1276","","","","","","1.025","","","","has coordinates","302723","2025-10-06","10:13:35",""
"7063899","7.50776","0.00006","23.8096","0.0002","19.83429","0.00015","90","","91.7371","0.0007","90","","3543.88","0.05","104","6","104.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H34 Cu N6 O15 -","- C35 H34 Cu N6 O15 -","- C140 H136 Cu4 N24 O60 -","4","1","","Bharti, Shachendra Kumar; Odera, Keiko; Tripathi, Kamini; Ward, Benzamin D.; Bhattacharya, S.; Takahashi, Ryoya; Mishra, Lallan","Structural and chemical investigation of a tridentate fluorescein hydrazone (LH3), a selective Cu2+ and Hg2+ chelator: detection of CN− and HSO4− by its Cu2+ complexes and effect on HeLa cell division","New Journal of Chemistry","2025","49","33","14219","14230","10.1039/D5NJ01491C","","","1.54184","CuKα","","0.0465","0.0411","","","0.1156","0.1205","","","","","","1.048","","","","has coordinates","302723","2025-10-06","10:13:45",""
"7063900","7.8093","0.0002","18.765","0.0004","23.2256","0.0006","90","","91.465","0.002","90","","3402.4","0.14","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H26 Cl Cu N5 O14 -","- C33 H26 Cl Cu N5 O14 -","- C132 H104 Cl4 Cu4 N20 O56 -","4","1","","Bharti, Shachendra Kumar; Odera, Keiko; Tripathi, Kamini; Ward, Benzamin D.; Bhattacharya, S.; Takahashi, Ryoya; Mishra, Lallan","Structural and chemical investigation of a tridentate fluorescein hydrazone (LH3), a selective Cu2+ and Hg2+ chelator: detection of CN− and HSO4− by its Cu2+ complexes and effect on HeLa cell division","New Journal of Chemistry","2025","49","33","14219","14230","10.1039/D5NJ01491C","","x-ray","1.54184","CuKα","","0.1037","0.0667","","","0.1775","0.2058","","","","","","1.045","","","","has coordinates","302723","2025-10-06","10:13:46",""
"7063901","23.8092","0.0018","23.8092","0.0018","15.702","0.0014","90","","90","","90","","8901.1","1.2","139","","139","","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","","- C7 H5 N4 O6 Y -","- C7 H5 N4 O6 Y -","- C112 H80 N64 O96 Y16 -","16","0.5","","Yang, Jiajie; Shao, Zhen-Wu; Qiu, Yuqing; Xiong, Chaozhi; Zhang, Zhiyuan; Liu, Chong","Construction of a robust yttrium-hydroxamate metal–organic framework for H2O adsorption","New Journal of Chemistry","2025","49","32","13694","13698","10.1039/D5NJ01353D","","x-ray","0.71073","MoKα","","0.0722","0.0564","","","0.1647","0.1793","","","","","","1.1","","","","has coordinates,has disorder","302717","2025-10-06","10:11:41",""
"7063902","8.5375","0.0006","10.2973","0.0007","12.0126","0.0007","83.133","0.003","71.29","0.003","88.065","0.003","993.07","0.11","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H18 Cl N O3 -","- C24 H18 Cl N O3 -","- C48 H36 Cl2 N2 O6 -","2","1","","Banu, Shaik Farheen; Sreeshitha, Mandapalli; Wilhelm, René; Reddy, Peddiahgari Vasu Govardhana","Efficient synthesis of spirooxindole γ-lactones catalysed by new bis-benzimidazolinium NHC precursors","New Journal of Chemistry","2025","49","33","14256","14264","10.1039/D5NJ02315G","","","1.54178","CuKα","","0.0809","0.076","","","0.2109","0.2217","","","","","","1.089","","","","has coordinates","302725","2025-10-06","10:14:20",""
"7063903","9.8497","0.0008","32.182","0.003","12.7803","0.0009","90","","90.476","0.003","90","","4051","0.6","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H44 N4 O6 Zn -","- C44 H36 N4 O5 Zn -","- C176 H144 N16 O20 Zn4 -","4","1","","Ngo, Quang-Thien; Cao, Phuong-Lien Doan; Wu, Zhiyuan; Siwawannapong, Kittipan; Ntim, Thomas; Nalaoh, Phattananawee; Lindsey, Jonathan S.","Synthesis of compact water-soluble bioconjugatable porphyrins for life sciences applications","New Journal of Chemistry","2025","49","36","15584","15611","10.1039/D5NJ02077H","","x-ray","0.71073","MoKα","","0.0625","0.0569","","","0.1392","0.1434","","","","","","1.024","","","","has coordinates,has disorder","302727","2025-10-06","10:15:12",""
"7063904","7.2415","0.0002","17.2244","0.0005","13.8163","0.0004","90","","99.585","0.001","90","","1699.26","0.08","100","2","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 N2 O2 -","- C21 H18 N2 O2 -","- C84 H72 N8 O8 -","4","1","","Ngo, Quang-Thien; Cao, Phuong-Lien Doan; Wu, Zhiyuan; Siwawannapong, Kittipan; Ntim, Thomas; Nalaoh, Phattananawee; Lindsey, Jonathan S.","Synthesis of compact water-soluble bioconjugatable porphyrins for life sciences applications","New Journal of Chemistry","2025","49","36","15584","15611","10.1039/D5NJ02077H","","","0.71073","MoKα","","0.0448","0.0388","","","0.0946","0.0992","","","","","","1.02","","","","has coordinates","302727","2025-10-06","10:15:12",""
"7063905","31.7076","0.0013","16.367","0.0006","11.4836","0.0005","90","","106.795","0.004","90","","5705.3","0.4","298","2","298","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","complex1","","","- C46 H58 Mn2 N8 Na2 O13 S4 -","- C46 H58 Mn2 N8 Na2 O13 S4 -","- C184 H232 Mn8 N32 Na8 O52 S16 -","4","0.5","","Ma, De-Yang; Li, Shan-Shan; Zhao, Xin-Hua; Wang, Yan-Lan; Zhang, Shao-Liang","A heterometallic {MnIIINaI}2 coordination compound exhibiting field-induced slow magnetic relaxation","New Journal of Chemistry","2025","49","32","13705","13708","10.1039/D5NJ02593A","","","0.71073","MoKα","","0.0794","0.0527","","","0.1276","0.1523","","","","","","0.845","","","","has coordinates,has disorder","302720","2025-10-06","10:12:38",""
"7063906","12.0573","0.0005","14.1028","0.0006","16.6834","0.0008","90","","101.695","0.0012","90","","2778","0.2","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[(1,2,5,6-η)-cycloocta-1,5-diene]-(3-{9-[2-(diphenylphosphanyl)ethyl]-9λ5-borabicyclo[3.3.1]nonan-9-yl}triaza-1,2-dien-2-ium-1-ide)-rhodium","","- C30 H40 B N3 P Rh -","- C30 H40 B N3 P Rh -","- C120 H160 B4 N12 P4 Rh4 -","4","1","","Nichols, Brian R.; Petersen, Jeffrey L.; Dolinar, Brian S.; Popp, Brian V.","Primary and secondary coordination sphere Lewis acid interactions in β-phosphinoethylborane-ligated rhodium and iridium complexes","New Journal of Chemistry","2025","49","32","14073","14081","10.1039/D5NJ01429H","","","0.71073","MoKα","","0.0552","0.0373","","","0.0747","0.0832","","","","","","1.066","","","","has coordinates","302716","2025-10-06","10:11:16",""
"7063907","12.0583","0.0005","14.141","0.0005","16.6581","0.0006","90","","101.654","0.0011","90","","2781.92","0.18","296","2","296.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[(1,2,5,6-η)-cycloocta-1,5-diene]-(3-{9-[2-(diphenylphosphanyl)ethyl]-9λ5-borabicyclo[3.3.1]nonan-9-yl}triaza-1,2-dien-2-ium-1-ide)-iridium","","- C30 H40 B Ir N3 P -","- C30 H40 B Ir N3 P -","- C120 H160 B4 Ir4 N12 P4 -","4","1","","Nichols, Brian R.; Petersen, Jeffrey L.; Dolinar, Brian S.; Popp, Brian V.","Primary and secondary coordination sphere Lewis acid interactions in β-phosphinoethylborane-ligated rhodium and iridium complexes","New Journal of Chemistry","2025","49","32","14073","14081","10.1039/D5NJ01429H","","","0.71073","MoKα","","0.0341","0.0284","","","0.0585","0.0611","","","","","","1.141","","","","has coordinates","302716","2025-10-06","10:11:20",""
"7063908","16.5001","0.0006","16.5001","0.0006","15.1817","0.0006","90","","90","","90","","4133.3","0.3","293","2","293","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","Bromo-(diphenyl(ethyl)phosphine)-(cycloocta-1,5-diene)-rhodium","","- C22 H27 Br P Rh -","- C22 H27 Br P Rh -","- C176 H216 Br8 P8 Rh8 -","8","1","","Nichols, Brian R.; Petersen, Jeffrey L.; Dolinar, Brian S.; Popp, Brian V.","Primary and secondary coordination sphere Lewis acid interactions in β-phosphinoethylborane-ligated rhodium and iridium complexes","New Journal of Chemistry","2025","49","32","14073","14081","10.1039/D5NJ01429H","","","0.71073","MoKα","","0.0458","0.0345","","","0.0801","0.0906","","","","","","1.034","","","","has coordinates","302716","2025-10-06","10:11:24",""
"7063909","10.9766","0.0006","11.6327","0.0007","12.9516","0.0007","65.439","0.001","75.541","0.001","62.301","0.001","1328.48","0.13","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H40 B Cl Ir P -","- C30 H40 B Cl Ir P -","- C60 H80 B2 Cl2 Ir2 P2 -","2","1","","Nichols, Brian R.; Petersen, Jeffrey L.; Dolinar, Brian S.; Popp, Brian V.","Primary and secondary coordination sphere Lewis acid interactions in β-phosphinoethylborane-ligated rhodium and iridium complexes","New Journal of Chemistry","2025","49","32","14073","14081","10.1039/D5NJ01429H","","x-ray","0.71073","MoKα","K-L~3~","0.052","0.0414","","","0.0825","0.086","","","","","","1.037","","","","has coordinates","302716","2025-10-06","10:11:24",""
"7063910","9.8906","0.0009","12.8325","0.0013","13.14","0.0013","114.412","0.002","93.805","0.002","92.019","0.002","1511.7","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","chloro-[(1,2,5,6-η)-cycloocta-1,5-diene]-[{9-[2-(diphenylphosphanyl)ethyl]-9λ5-borabicyclo[3.3.1]nonan-9-yl}(ethylidyne)-λ5-azane]-iridium","","- C32 H43 B Cl Ir N P -","- C32 H43 B Cl Ir N P -","- C64 H86 B2 Cl2 Ir2 N2 P2 -","2","1","","Nichols, Brian R.; Petersen, Jeffrey L.; Dolinar, Brian S.; Popp, Brian V.","Primary and secondary coordination sphere Lewis acid interactions in β-phosphinoethylborane-ligated rhodium and iridium complexes","New Journal of Chemistry","2025","49","32","14073","14081","10.1039/D5NJ01429H","","","0.71073","MoKα","","0.0492","0.04","","","0.1012","0.1074","","","","","","1.032","","","","has coordinates","302716","2025-10-06","10:11:24",""
"7063911","10.8655","0.0004","11.6362","0.0004","13.1121","0.0005","65.1401","0.0011","75.7848","0.0011","63.079","0.001","1338.05","0.09","100","2","100.01","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H40 B Br P Rh -","- C30 H40 B Br P Rh -","- C60 H80 B2 Br2 P2 Rh2 -","2","1","","Nichols, Brian R.; Petersen, Jeffrey L.; Dolinar, Brian S.; Popp, Brian V.","Primary and secondary coordination sphere Lewis acid interactions in β-phosphinoethylborane-ligated rhodium and iridium complexes","New Journal of Chemistry","2025","49","32","14073","14081","10.1039/D5NJ01429H","","","0.71073","MoKα","","0.0318","0.0217","","","0.0465","0.0493","","","","","","1.042","","","","has coordinates","302716","2025-10-06","10:11:24",""
"7063912","12.2787","0.0005","14.2439","0.0006","25.4195","0.001","96.1831","0.0012","100.436","0.0011","114.988","0.0011","3877.4","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","Dichlorotetrakis{2-[9-borabicyclo[3.3.1]nonan-9-yl]ethyl}(diphenyl)phosphine)}dirhodium","","- C88 H112 B4 Cl2 P4 Rh2 -","- C88 H112 B4 Cl2 P4 Rh2 -","- C176 H224 B8 Cl4 P8 Rh4 -","2","1","","Nichols, Brian R.; Petersen, Jeffrey L.; Dolinar, Brian S.; Popp, Brian V.","Primary and secondary coordination sphere Lewis acid interactions in β-phosphinoethylborane-ligated rhodium and iridium complexes","New Journal of Chemistry","2025","49","32","14073","14081","10.1039/D5NJ01429H","","","0.71073","MoKα","","0.0592","0.0442","","","0.089","0.0942","","","","","","1.075","","","","has coordinates","302716","2025-10-06","10:11:24",""
"7063913","6.6713","0.0002","11.1427","0.0003","14.3771","0.0003","98.336","0.001","100.639","0.001","94.362","0.001","1033.45","0.05","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","(Z)-2-((6-methoxy-2-phenyl-2H-chromen-3-yl)methylene)-N-phenylhydrazine-1-carbothioamide","","- C48 H42 N6 O4 S2 -","- C48 H42 N6 O4 S2 -","- C48 H42 N6 O4 S2 -","1","0.5","","Sa, Min; Wang, Jin; Li, Jiajia; Li, Xiaojuan","A novel benzopyran-based fluorescent sensor for the selective detection of Hg2+ ions","New Journal of Chemistry","2025","49","33","14487","14493","10.1039/D5NJ02250A","","","0.71073","MoKα","","0.0472","0.0383","","","0.0969","0.1049","","","","","","1.044","","","","has coordinates","302726","2025-10-06","10:14:35",""
"7063914","17.7898","0.0007","16.0761","0.0008","14.7473","0.0006","90","","100.865","0.001","90","","4142","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H58 B2 Cu2 F8 N8 O5 -","- C33 H58 B2 Cu2 F8 N8 O5 -","- C132 H232 B8 Cu8 F32 N32 O20 -","4","1","","Liu, Yu-Di; Jiang, Wenya; Wei, Jianyu; Wu, Yuan; Shang, Jiaqi; Wang, Yimin; Wang, ShuaiQi; Liu, Kuan-Guan","Boosting the photothermal conversion performance of a dumbbell-shaped molecule with coordinated methanol","New Journal of Chemistry","2025","49","34","14659","14667","10.1039/D5NJ00995B","","","0.71073","MoKα","","0.0493","0.0354","","","0.0771","0.0844","","","","","","1.04","","","","has coordinates","302738","2025-10-06","10:18:22",""
"7063915","5.5595","0.0001","34.5896","0.0005","14.1757","0.0002","90","","97.477","0.002","90","","2702.82","0.07","273","","273","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4,4'-bis[(N-carbazole)phenyl]ethene","","- C38 H26 N2 -","- C38 H26 N2 -","- C152 H104 N8 -","4","1","","Wang, Xini; Zhang, Peng; Zheng, Ziyi; Bian, Guangling; Song, Ling","Thermal stability analysis of organic laser dye 4,4′-bis[(N-carbazole)styryl]-biphenyl","New Journal of Chemistry","2025","49","32","13709","13713","10.1039/D5NJ01391G","","","1.54184","CuKα","","0.0636","0.0561","","","0.153","0.1594","","","","","","1.062","","","","has coordinates","302715","2025-10-06","10:10:50",""
"7063916","9.8474","0.0002","13.1392","0.0002","14.3948","0.0002","97.13","0.001","92.623","0.001","97.186","0.001","1830.02","0.05","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","BSBCz-P-1","","- C52 H36 N2 -","- C52 H36 N2 -","- C104 H72 N4 -","2","1","","Wang, Xini; Zhang, Peng; Zheng, Ziyi; Bian, Guangling; Song, Ling","Thermal stability analysis of organic laser dye 4,4′-bis[(N-carbazole)styryl]-biphenyl","New Journal of Chemistry","2025","49","32","13709","13713","10.1039/D5NJ01391G","","","1.54184","CuKα","","0.0834","0.0698","","","0.1871","0.1941","","","","","","1.087","","","","has coordinates","302715","2025-10-06","10:10:51",""
"7063917","14.6593","0.001","15.7454","0.0009","31.8072","0.0018","90","","90","","90","","7341.6","0.8","296.2","","296.2","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","BSBCz-Pbca","","- C52 H36 N2 -","- C52 H36 N2 -","- C416 H288 N16 -","8","1","","Wang, Xini; Zhang, Peng; Zheng, Ziyi; Bian, Guangling; Song, Ling","Thermal stability analysis of organic laser dye 4,4′-bis[(N-carbazole)styryl]-biphenyl","New Journal of Chemistry","2025","49","32","13709","13713","10.1039/D5NJ01391G","","","1.54184","CuKα","","0.1143","0.082","","","0.2278","0.268","","","","","","1.085","","","","has coordinates","302715","2025-10-06","10:10:51",""
"7063918","10.1438","0.0008","10.818","0.001","11.0892","0.0007","113.382","0.008","101.243","0.006","109.981","0.008","969.58","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H32 Co2 N14 O4 S2 -","- C36 H32 Co2 N14 O4 S2 -","- C36 H32 Co2 N14 O4 S2 -","1","0.5","","Nag, Swati; Kumar, Raman; Singh, Manjeet; Panda, Atanu; Patra, Ranjan; Sahu, Pradip Kumar; Goswami, Soumyabrata; Sahoo, Subash C.; Nanda, Prasant K.","Influence of structural diversity in Co(ii)–oxamide complexes towards single molecule magnets and electrochemical oxygen evolution reaction","New Journal of Chemistry","2025","49","35","15236","15251","10.1039/D5NJ01208B","","","0.71073","MoKα","","0.1073","0.0851","","","0.2326","0.2634","","","","","","1.061","","","","has coordinates,has disorder","302734","2025-10-06","10:17:00",""
"7063919","17.4593","0.0006","25.0962","0.0007","21.9318","0.0006","90","","110.24","0.003","90","","9016.3","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C79 H77 Co4 N19 O14 S8 -","- C76 H66 Co4 N18 O11 S8 -","- C304 H264 Co16 N72 O44 S32 -","4","0.5","","Nag, Swati; Kumar, Raman; Singh, Manjeet; Panda, Atanu; Patra, Ranjan; Sahu, Pradip Kumar; Goswami, Soumyabrata; Sahoo, Subash C.; Nanda, Prasant K.","Influence of structural diversity in Co(ii)–oxamide complexes towards single molecule magnets and electrochemical oxygen evolution reaction","New Journal of Chemistry","2025","49","35","15236","15251","10.1039/D5NJ01208B","","","0.71073","MoKα","","0.0625","0.0503","","","0.1593","0.1672","","","","","","1.12","","","","has coordinates,has disorder","302734","2025-10-06","10:17:01",""
"7063920","9.7233","0.0003","21.3996","0.0006","22.8979","0.0007","90","","90","","90","","4764.5","0.2","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C19 H24 Br2 Fe N5 O6 -","- C19 H24 Br2 Fe N5 O6 -","- C152 H192 Br16 Fe8 N40 O48 -","8","1","","Tesfaye, Dawit; Gebrezgiabher, Mamo; Braun, Jonas; Kuchár, Juraj; Černák, Juraj; Abebe, Atakilt; Boulet, Pascal; Kalarikkal, Nandakumar; Hochdörffer, Tim; Schünemann, Volker; Anson, Christopher E.; Thomas, Madhu; Powell, Annie K.","Broad spin crossover in an iron(iii) Schiff base complex with a cis-FeN4O2 coordination environment","New Journal of Chemistry","2025","49","34","14776","14781","10.1039/D5NJ02493E","","","0.71073","MoKα","","0.0526","0.0326","","","0.0682","0.0771","","","","","","1.028","","","","has coordinates,has disorder","302735","2025-10-06","10:17:20",""
"7063921","9.7654","0.0004","21.4553","0.0009","23.0286","0.001","90","","90","","90","","4824.9","0.4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C19 H24 Br2 Fe N5 O6 -","- C19 H24 Br2 Fe N5 O6 -","- C152 H192 Br16 Fe8 N40 O48 -","8","1","","Tesfaye, Dawit; Gebrezgiabher, Mamo; Braun, Jonas; Kuchár, Juraj; Černák, Juraj; Abebe, Atakilt; Boulet, Pascal; Kalarikkal, Nandakumar; Hochdörffer, Tim; Schünemann, Volker; Anson, Christopher E.; Thomas, Madhu; Powell, Annie K.","Broad spin crossover in an iron(iii) Schiff base complex with a cis-FeN4O2 coordination environment","New Journal of Chemistry","2025","49","34","14776","14781","10.1039/D5NJ02493E","","","0.71073","MoKα","","0.0573","0.0346","","","0.0729","0.0827","","","","","","1.01","","","","has coordinates,has disorder","302735","2025-10-06","10:17:20",""
"7063922","26.675","0.002","16.1311","0.0012","30.321","0.002","90","","104.396","0.008","90","","12637.4","1.6","150.15","","150.15","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C72 H72 Co N24 O64 P2 W18 -","- C72 H72 Co N24 O64 P2 W18 -","- C288 H288 Co4 N96 O256 P8 W72 -","4","0.5","","Hao, Xiu-Li; Zhang, Chen-Hao; Feng, Chen-Kun; Su, Tian-Ru; Zhao, Mei-mei; Wen, Yan-Zhen","Two Dawson-type polyoxometalate-based metal coordination polymers as heterogeneous catalysts for desulfurization","New Journal of Chemistry","2025","49","34","14874","14881","10.1039/D5NJ02349A","","","0.71073","MoKα","","0.1001","0.0685","","","0.1632","0.1892","","","","","","1.041","","","","has coordinates","302737","2025-10-06","10:18:13",""
"7063923","14.3045","0.0009","25.6821","0.0016","14.4714","0.0009","90","","98.249","0.006","90","","5261.3","0.6","298","2","298.15","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C36 H87 N18 Ni2 O83.5 P2 W18 -","- C36 H52 N18 Ni2 O66 P2 W18 -","- C72 H104 N36 Ni4 O132 P4 W36 -","2","0.5","","Hao, Xiu-Li; Zhang, Chen-Hao; Feng, Chen-Kun; Su, Tian-Ru; Zhao, Mei-mei; Wen, Yan-Zhen","Two Dawson-type polyoxometalate-based metal coordination polymers as heterogeneous catalysts for desulfurization","New Journal of Chemistry","2025","49","34","14874","14881","10.1039/D5NJ02349A","","","0.71073","MoKα","","0.0593","0.0436","","","0.0946","0.1033","","","","","","1.01","","","","has coordinates","302737","2025-10-06","10:18:13",""
"7063924","6.935","0.002","9.239","0.003","26.657","0.009","85.783","0.012","83.437","0.01","89.824","0.009","1692.2","0.9","100","2","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H27 Au2 Cl9 N4 -","- C28 H27 Au2 Cl9 N4 -","- C56 H54 Au4 Cl18 N8 -","2","1","","Koshenskova, Kseniya A.; Bardina, Elena E.; Makotchenko, Eugeniya V.; Kharlamova, Viktoria Yu.; Mironov, Igor V.; Bekker, Olga B.; Treshalina, Helen M.; Sokolova, Darina V.; Pokrovsky, Vadim S.; Borodin, Eugenii A.; Kotel'nikov, Danil D.; Belyaev, Danila V.; Vakhrusheva, Diana V.; Krasnoborova, Svetlana Yu.; Rusinov, Gennadii L.; Timofeev, Eduard A.; Leusova, Nataliya Yu.; Kiskin, Mikhail A.; Gushchin, Artem L.; Eremenko, Igor L.; Lutsenko, Irina A.","Gold(iii) complexes containing (non)protonated oligopyridines—unexpected results in cancer drug research","New Journal of Chemistry","2025","49","32","14037","14052","10.1039/D5NJ02110C","","","0.71073","MoKα","","0.0731","0.0515","","","0.1118","0.1235","","","","","","1.045","","","","has coordinates,has disorder","302721","2025-10-06","10:12:47",""
"7063925","9.0224","0.0008","10.1313","0.0008","10.3591","0.0005","118.203","0.002","95.537","0.002","100.503","0.002","802.08","0.1","100","2","100","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H10 Au Cl4 N3 O3 -","- C12 H10 Au Cl4 N3 O3 -","- C24 H20 Au2 Cl8 N6 O6 -","2","1","","Koshenskova, Kseniya A.; Bardina, Elena E.; Makotchenko, Eugeniya V.; Kharlamova, Viktoria Yu.; Mironov, Igor V.; Bekker, Olga B.; Treshalina, Helen M.; Sokolova, Darina V.; Pokrovsky, Vadim S.; Borodin, Eugenii A.; Kotel'nikov, Danil D.; Belyaev, Danila V.; Vakhrusheva, Diana V.; Krasnoborova, Svetlana Yu.; Rusinov, Gennadii L.; Timofeev, Eduard A.; Leusova, Nataliya Yu.; Kiskin, Mikhail A.; Gushchin, Artem L.; Eremenko, Igor L.; Lutsenko, Irina A.","Gold(iii) complexes containing (non)protonated oligopyridines—unexpected results in cancer drug research","New Journal of Chemistry","2025","49","32","14037","14052","10.1039/D5NJ02110C","","","0.71073","MoKα","","0.0281","0.0196","","","0.0403","0.043","","","","","","1.05","","","","has coordinates","302721","2025-10-06","10:12:48",""
"7063926","13.8292","0.0003","13.2771","0.0003","13.3769","0.0003","90","","90.079","0.001","90","","2456.15","0.09","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Ba4 Ge2 Sb2 Se1.83 Te8.17 -","- Ba4 Ge2 Sb2 Se1.827 Te8.173 -","- Ba16 Ge8 Sb8 Se7.308 Te32.692 -","4","1","","Yadav, Sweta; Swati,; Prakash, Jai","Ba4Ge2Sb2Te8Se2 and Ba2Ge2Te4.5Se0.5: complex heteroanionic Ge-containing phases with extremely low thermal conductivities","New Journal of Chemistry","2025","49","33","14131","14141","10.1039/D5NJ01642H","","","0.71073","MoKα","","0.0246","0.0194","","","0.0377","0.039","","","","","","1.074","","","","has coordinates","302722","2025-10-06","10:13:01",""
"7063927","13.288","0.006","9.107","0.004","9.894","0.004","90","","90","","90","","1197.3","0.9","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- Ba2 Ge2 Se0.47 Te4.53 -","- Ba2 Ge2 Se0.472 Te4.528 -","- Ba8 Ge8 Se1.888 Te18.112 -","4","1","","Yadav, Sweta; Swati,; Prakash, Jai","Ba4Ge2Sb2Te8Se2 and Ba2Ge2Te4.5Se0.5: complex heteroanionic Ge-containing phases with extremely low thermal conductivities","New Journal of Chemistry","2025","49","33","14131","14141","10.1039/D5NJ01642H","","","0.71073","MoKα","","0.0196","0.0177","","","0.0291","0.0294","","","","","","1.007","","","","has coordinates","302722","2025-10-06","10:13:01",""
"7063928","13.286","0.0007","9.0973","0.0006","9.8653","0.0005","90","","90","","90","","1192.39","0.12","298","2","298","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- Ba2 Ge2 Se0.5 Te4.5 -","- Ba2 Ge2 Se0.496 Te4.504 -","- Ba8 Ge8 Se1.984 Te18.016 -","4","1","","Yadav, Sweta; Swati,; Prakash, Jai","Ba4Ge2Sb2Te8Se2 and Ba2Ge2Te4.5Se0.5: complex heteroanionic Ge-containing phases with extremely low thermal conductivities","New Journal of Chemistry","2025","49","33","14131","14141","10.1039/D5NJ01642H","","","0.71073","MoKα","","0.0338","0.0278","","","0.0466","0.0481","","","","","","1.038","","","","has coordinates","302722","2025-10-06","10:13:01",""
"7063929","13.3789","0.0008","13.2844","0.0008","13.8394","0.0008","90","","90.106","0.002","90","","2459.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Ba4 Ge2 Sb2 Se1.79 Te8.21 -","- Ba4 Ge2 Sb2 Se1.794 Te8.206 -","- Ba16 Ge8 Sb8 Se7.176 Te32.824 -","4","1","","Yadav, Sweta; Swati,; Prakash, Jai","Ba4Ge2Sb2Te8Se2 and Ba2Ge2Te4.5Se0.5: complex heteroanionic Ge-containing phases with extremely low thermal conductivities","New Journal of Chemistry","2025","49","33","14131","14141","10.1039/D5NJ01642H","","","0.71073","MoKα","","0.0425","0.0396","","","0.1174","0.1187","","","","","","1.209","","","","has coordinates","302722","2025-10-06","10:13:01",""
"7063930","6.6537","0.0013","14.404","0.003","7.3521","0.0015","90","","110.64","0.03","90","","659.4","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","A3 Complex","","- C5 H6 Cl Co0.5 N2 O -","- C5 H6 Cl Co0.5 N2 O -","- C20 H24 Cl4 Co2 N8 O4 -","4","1","","Crespi, Ayelén F.; Pérez, Ana L.; Brondino, Carlos D.; Zomero, Paula N.; Vega, Daniel; Rodríguez-Castellón, Enrique; Lázaro-Martínez, Juan M.","Analysis of copper 4(5)-imidazolecarboxaldehyde derivatives by ss-NMR, EPR, theoretical calculations and their advanced oxidation applications","New Journal of Chemistry","2025","49","33","14473","14486","10.1039/D5NJ02171E","","","0.71073","MoKα","","0.0522","0.0326","","","0.0654","0.0708","","","","","","1.083","","","","has coordinates","302724","2025-10-06","10:14:09",""
"7063931","10.9579","0.0002","10.9579","0.0002","15.2557","0.0003","90","","90","","90","","1831.84","0.06","100","2","100","2","","","","","","","","3","P 42/n :2","-P 4bc","86","","","","- C28 H18 N2 -","- C28 H18 N2 -","- C112 H72 N8 -","4","0.5","","Bai, Jinku; Wang, Shuo; Wang, Xin-Yue; Shen, Yun-Jia; Sun, Xin; Li, Zhi-Ao; Chen, Xu-Lang; Gong, Han-Yuan","Quantitative substituent effects in nitrogen-containing polycyclic aromatic hydrocarbons: implications for metal ion complexation","New Journal of Chemistry","2025","49","32","13699","13704","10.1039/D5NJ01550B","","","1.54184","CuKα","","0.0577","0.0503","","","0.1301","0.1353","","","","","","1.033","","","","has coordinates,has disorder","302718","2025-10-06","10:11:54",""
"7063932","15.4942","0.0004","21.0697","0.0004","15.6395","0.0003","90","","108.586","0.002","90","","4839.36","0.19","170","2","170","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C27.5 H16 Cl5 N2 O0.5 Zn -","- C27.5 H15.75 Cl5 N2 O0.5 Zn -","- C220 H126 Cl40 N16 O4 Zn8 -","8","1","","Bai, Jinku; Wang, Shuo; Wang, Xin-Yue; Shen, Yun-Jia; Sun, Xin; Li, Zhi-Ao; Chen, Xu-Lang; Gong, Han-Yuan","Quantitative substituent effects in nitrogen-containing polycyclic aromatic hydrocarbons: implications for metal ion complexation","New Journal of Chemistry","2025","49","32","13699","13704","10.1039/D5NJ01550B","","","1.54184","CuKα","","0.0679","0.0621","","","0.209","0.2129","","","","","","1.007","","","","has coordinates,has disorder","302718","2025-10-06","10:11:54",""
"7063933","13.2519","0.0005","11.526","0.0004","15.0362","0.0006","90","","113.978","0.005","90","","2098.45","0.16","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H18 N2 O4 -","- C30 H18 N2 O4 -","- C120 H72 N8 O16 -","4","1","","Bai, Jinku; Wang, Shuo; Wang, Xin-Yue; Shen, Yun-Jia; Sun, Xin; Li, Zhi-Ao; Chen, Xu-Lang; Gong, Han-Yuan","Quantitative substituent effects in nitrogen-containing polycyclic aromatic hydrocarbons: implications for metal ion complexation","New Journal of Chemistry","2025","49","32","13699","13704","10.1039/D5NJ01550B","","","1.54184","CuKα","","0.0785","0.0606","","","0.1437","0.1537","","","","","","1.034","","","","has coordinates","302718","2025-10-06","10:11:54",""
"7063934","11.5481","0.0005","10.6993","0.0004","15.9699","0.0006","90","","106.595","0.004","90","","1891","0.14","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H18 N2 O2 -","- C28 H18 N2 O2 -","- C112 H72 N8 O8 -","4","1","","Bai, Jinku; Wang, Shuo; Wang, Xin-Yue; Shen, Yun-Jia; Sun, Xin; Li, Zhi-Ao; Chen, Xu-Lang; Gong, Han-Yuan","Quantitative substituent effects in nitrogen-containing polycyclic aromatic hydrocarbons: implications for metal ion complexation","New Journal of Chemistry","2025","49","32","13699","13704","10.1039/D5NJ01550B","","","1.54184","CuKα","","0.0751","0.0531","","","0.1336","0.1443","","","","","","1.015","","","","has coordinates","302718","2025-10-06","10:11:54",""
"7063935","7.8812","0.0005","10.038","0.0005","13.6586","0.0007","109.138","0.005","94.299","0.005","92.69","0.005","1015.02","0.1","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H12.5 Cl0.5 F6 N2 -","- C28 H12.5 Cl0.5 F6 N2 -","- C56 H25 Cl F12 N4 -","2","1","","Bai, Jinku; Wang, Shuo; Wang, Xin-Yue; Shen, Yun-Jia; Sun, Xin; Li, Zhi-Ao; Chen, Xu-Lang; Gong, Han-Yuan","Quantitative substituent effects in nitrogen-containing polycyclic aromatic hydrocarbons: implications for metal ion complexation","New Journal of Chemistry","2025","49","32","13699","13704","10.1039/D5NJ01550B","","","1.54184","CuKα","","0.0732","0.0593","","","0.1519","0.1614","","","","","","1.036","","","","has coordinates,has disorder","302718","2025-10-06","10:11:54",""
"7063936","12.8362","0.0002","14.2164","0.0002","14.4063","0.0002","93.893","0.001","92.809","0.001","104.158","0.001","2537.34","0.07","100","0.1","100","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C47 H43 Cl2 Co F4 N13 O11 -","- C47 H43 Cl2 Co F4 N13 O11 -","- C94 H86 Cl4 Co2 F8 N26 O22 -","2","1","","Khan, Sahanwaj; Sengupta, Swaraj; Khan, Md. Adnan; Jana, Narayan Ch.; Bagh, Bidraha; Naskar, Subhendu","Electrocatalytic proton reduction by mononuclear cobalt complexes of bis(benzimidazolyl)pyridine ligands: experimental and theoretical study","New Journal of Chemistry","2025","49","37","16134","16144","10.1039/D5NJ01975C","","","1.54184","CuKα","","0.0574","0.0512","","","0.1271","0.1363","","","","","","1.059","","","","has coordinates,has disorder","302711","2025-10-06","10:09:10",""
"7063937","34.4966","0.0014","18.9116","0.0008","21.5652","0.0007","90","","101.994","0.004","90","","13761.7","0.9","298","2","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C69 H63 Cl4.5 Co1.5 N15 -","- C69 H63 Cl4.5 Co1.5 N15 -","- C552 H504 Cl36 Co12 N120 -","8","1","","Khan, Sahanwaj; Sengupta, Swaraj; Khan, Md. Adnan; Jana, Narayan Ch.; Bagh, Bidraha; Naskar, Subhendu","Electrocatalytic proton reduction by mononuclear cobalt complexes of bis(benzimidazolyl)pyridine ligands: experimental and theoretical study","New Journal of Chemistry","2025","49","37","16134","16144","10.1039/D5NJ01975C","","","0.71073","MoKα","","0.1266","0.0821","","","0.2155","0.2574","","","","","","1.038","","","","has coordinates,has disorder","302711","2025-10-06","10:09:11",""
"7063938","11.5816","0.0008","14.6348","0.0017","17.7481","0.0013","87.477","0.008","76.607","0.006","70.038","0.008","2748.6","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H50 Cl2 N10 O12 S4 Zn -","- C46 H50 Cl2 N10 O12 S4 Zn -","- C92 H100 Cl4 N20 O24 S8 Zn2 -","2","1","","Khan, Sahanwaj; Sengupta, Swaraj; Khan, Md. Adnan; Jana, Narayan Ch.; Bagh, Bidraha; Naskar, Subhendu","Electrocatalytic proton reduction by mononuclear cobalt complexes of bis(benzimidazolyl)pyridine ligands: experimental and theoretical study","New Journal of Chemistry","2025","49","37","16134","16144","10.1039/D5NJ01975C","","","0.71073","MoKα","","0.0924","0.0716","","","0.2047","0.2321","","","","","","1.042","","","","has coordinates,has disorder","302711","2025-10-06","10:09:11",""
"7063939","8.777","0.0002","11.0093","0.0003","12.3987","0.0003","72.108","0.001","87.652","0.001","77.576","0.001","1113.02","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H27 Fe N2 P -","- C26 H27 Fe N2 P -","- C52 H54 Fe2 N4 P2 -","2","1","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0225","0.0223","","","0.0606","0.0608","","","","","","1.042","","","","has coordinates","302730","2025-10-06","10:15:58",""
"7063940","13.352","0.0004","14.786","0.0004","17.0045","0.0006","76.666","0.001","79.272","0.001","65.012","0.001","2945.79","0.16","120","2","120","2","","","","","","","","9","P -1","-P 1","2","","","","- C117 H80 B2 Cl4 F48 Fe2 N4 P2 Pd2 -","- C117 H80 B2 Cl4 F48 Fe2 N4 P2 Pd2 -","- C117 H80 B2 Cl4 F48 Fe2 N4 P2 Pd2 -","1","0.5","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0343","0.0318","","","0.0766","0.0783","","","","","","1.026","","","","has coordinates","302730","2025-10-06","10:16:00",""
"7063941","11.17","0.0007","12.909","0.0007","21.5516","0.0013","84.853","0.002","83.515","0.002","67.826","0.002","2855.6","0.3","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H29 Cl4 Fe N2 P Pd -","- C27 H29 Cl4 Fe N2 P Pd -","- C108 H116 Cl16 Fe4 N8 P4 Pd4 -","4","2","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0306","0.0278","","","0.0587","0.0597","","","","","","1.152","","","","has coordinates","302730","2025-10-06","10:16:10",""
"7063942","18.2236","0.0013","18.5559","0.0012","22.2686","0.0014","65.785","0.002","71.268","0.002","66.738","0.002","6194.5","0.7","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H42 B2 F8 Fe N2 P2 Pd -","- C44 H42 B2 F8 Fe N2 P2 Pd -","- C264 H252 B12 F48 Fe6 N12 P12 Pd6 -","6","3","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0365","0.0337","","","0.0921","0.0943","","","","","","1.035","","","","has coordinates,has disorder","302730","2025-10-06","10:16:12",""
"7063943","10.4519","0.0004","14.382","0.0006","15.3656","0.0006","79.91","0.001","74.356","0.001","82.845","0.001","2182.49","0.15","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H42 F12 Fe N2 P4 Pd -","- C44 H42 F12 Fe N2 P4 Pd -","- C88 H84 F24 Fe2 N4 P8 Pd2 -","2","1","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0221","0.0212","","","0.0525","0.053","","","","","","1.044","","","","has coordinates,has disorder","302730","2025-10-06","10:16:16",""
"7063944","13.2784","0.0003","11.1432","0.0003","17.1037","0.0004","90","","94.503","0.001","90","","2522.92","0.11","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 Cl Fe N2 P Pd -","- C27 H30 Cl Fe N2 P Pd -","- C108 H120 Cl4 Fe4 N8 P4 Pd4 -","4","1","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0265","0.0254","","","0.0642","0.0649","","","","","","1.056","","","","has coordinates","302730","2025-10-06","10:16:16",""
"7063945","9.1189","0.0005","24.8822","0.0011","11.6949","0.0006","90","","111.157","0.0016","90","","2474.7","0.2","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 Cl2 Fe N2 Ni P -","- C26 H27 Cl2 Fe N2 Ni P -","- C104 H108 Cl8 Fe4 N8 Ni4 P4 -","4","1","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0293","0.029","","","0.0683","0.0684","","","","","","1.2","","","","has coordinates","302730","2025-10-06","10:16:16",""
"7063946","11.1097","0.0004","12.7025","0.0005","22.0182","0.0008","85.564","0.001","88.026","0.001","68.879","0.001","2889.74","0.19","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H29 Cl4 Fe N2 P Pt -","- C27 H29 Cl4 Fe N2 P Pt -","- C108 H116 Cl16 Fe4 N8 P4 Pt4 -","4","2","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0155","0.015","","","0.0343","0.0345","","","","","","1.081","","","","has coordinates","302730","2025-10-06","10:16:17",""
"7063947","12.5908","0.0004","14.5638","0.0005","30.1278","0.0009","90","","93.969","0.001","90","","5511.3","0.3","120","2","120","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C53 H56 B Cl5 F4 Fe2 N4 P2 Pd2 -","- C53 H56 B Cl5 F4 Fe2 N4 P2 Pd2 -","- C212 H224 B4 Cl20 F16 Fe8 N16 P8 Pd8 -","4","1","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","1.54178","CuKα","","0.0236","0.0223","","","0.0539","0.0548","","","","","","1.048","","","","has coordinates","302730","2025-10-06","10:16:17",""
"7063948","8.5316","0.0003","9.243","0.0003","18.3287","0.0006","88.762","0.001","86.497","0.001","64.448","0.001","1301.54","0.08","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H29 Fe N2 O3 P Pd -","- C30 H29 Fe N2 O3 P Pd -","- C60 H58 Fe2 N4 O6 P2 Pd2 -","2","1","","Leitner, Zdeněk; Císařová, Ivana; Kalbáčová Vejpravová, Jana; Štěpnička, Petr","Synthesis and coordination behaviour of a protic phosphinoferrocene amidine","New Journal of Chemistry","2025","49","36","15723","15735","10.1039/D5NJ02886H","","","0.71073","MoKα","","0.0166","0.0164","","","0.0408","0.0409","","","","","","1.082","","","","has coordinates","302730","2025-10-06","10:16:17",""
"7063949","15.30926","0.00013","15.86213","0.0001","16.43388","0.00013","69.0631","0.0007","78.1859","0.0007","71.2137","0.0007","3510.52","0.05","100","0.1","100","0.1","","","","","","","","9","P -1","-P 1","2","","","","- C47 H59 B Cl2 F2 N12 O4 P2 S2 -","- C47 H59 B Cl2 F2 N12 O4 P2 S2 -","- C94 H118 B2 Cl4 F4 N24 O8 P4 S4 -","2","1","","Uvarov, Denis Y.; Lesnikov, Vladislav K.; Golovanov, Ivan S.; Burikov, Sergey A.; Salnikova, Diana I.; Scherbakov, Alexander M.; Zavarzin, Igor V.; Volkova, Yulia A.","Effects of phosphorus(V)-substituted 1,3,4-thiadiazoles on the electronic properties of BODIPY fluorophores","New Journal of Chemistry","2025","49","36","15885","15894","10.1039/D5NJ01910A","","x-ray","1.54184","CuKα","","0.0359","0.035","","","0.0978","0.0985","","","","","","1.028","","","","has coordinates,has disorder","302731","2025-10-06","10:16:32",""
"7063950","10.4277","0.0018","12.208","0.002","14.862","0.003","106.349","0.004","103.089","0.005","102.213","0.005","1689.8","0.5","120","","120","","","","","","","","","7","P -1","-P 1","2","","","","- C35 H36 Br Cl N O P -","- C35 H36 Br Cl N O P -","- C70 H72 Br2 Cl2 N2 O2 P2 -","2","1","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.0465","0.0377","","","0.0983","0.103","","","","","","1.05","","","","has coordinates,has disorder","302736","2025-10-06","10:17:41",""
"7063951","9.3083","0.0011","10.0808","0.0013","14.0403","0.0016","92.334","0.004","99.211","0.004","90.963","0.004","1299","0.3","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H31 Br N O P -","- C32 H31 Br N O P -","- C64 H62 Br2 N2 O2 P2 -","2","1","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.0524","0.044","","","0.1061","0.11","","","","","","1.076","","","","has coordinates","302736","2025-10-06","10:17:43",""
"7063952","10.1637","0.0016","12.469","0.002","12.797","0.002","89.44","0.005","81.175","0.005","89.843","0.005","1602.5","0.4","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H35 Br N P -","- C34 H35 Br N P -","- C68 H70 Br2 N2 P2 -","2","1","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.0275","0.0259","","","0.0712","0.0724","","","","","","1.054","","","","has coordinates","302736","2025-10-06","10:17:43",""
"7063953","17.571","0.004","10.295","0.002","34.089","0.007","90","","90","","90","","6166","2","150","","150","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C35 H40 Br N O2.5 P -","- C35 H40 Br N O2.5 P -","- C280 H320 Br8 N8 O20 P8 -","8","2","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.1002","0.0871","","","0.2213","0.2296","","","","","","1.137","","","","has coordinates","302736","2025-10-06","10:17:43",""
"7063954","10.348","0.002","12.478","0.003","12.502","0.002","79.652","0.007","79.737","0.006","66.268","0.008","1443.7","0.5","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H33 Br N P -","- C33 H33 Br N P -","- C66 H66 Br2 N2 P2 -","2","1","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.1181","0.0699","","","0.1333","0.1571","","","","","","1.054","","","","has coordinates","302736","2025-10-06","10:17:43",""
"7063955","10.3779","0.0009","10.5708","0.0009","12.0914","0.001","100.359","0.003","100.978","0.003","94.158","0.003","1273.11","0.19","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H29 Br N P S -","- C30 H29 Br N P S -","- C60 H58 Br2 N2 P2 S2 -","2","1","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.0292","0.0253","","","0.0609","0.0626","","","","","","1.036","","","","has coordinates,has disorder","302736","2025-10-06","10:17:43",""
"7063956","10.376","0.002","12.439","0.003","14.218","0.003","67.137","0.007","73.761","0.007","79.434","0.007","1617.6","0.6","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H30 Br F N P -","- C32 H30 Br F N P -","- C64 H60 Br2 F2 N2 P2 -","2","1","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.127","0.114","","","0.2768","0.2846","","","","","","1.099","","","","has coordinates","302736","2025-10-06","10:17:43",""
"7063957","10.2729","0.001","12.6463","0.0014","12.7632","0.0012","90.187","0.004","98.461","0.004","90.335","0.004","1640","0.3","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H43 Br N O P -","- C38 H43 Br N O P -","- C76 H86 Br2 N2 O2 P2 -","2","1","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.0342","0.0315","","","0.0788","0.0804","","","","","","1.029","","","","has coordinates","302736","2025-10-06","10:17:43",""
"7063958","10.305","0.0004","17.3919","0.0007","21.4516","0.0013","99.944","0.002","92.981","0.002","106.741","0.002","3605.2","0.3","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H47 Br N O3 P -","- C40 H47 Br N O3 P -","- C160 H188 Br4 N4 O12 P4 -","4","2","","Rizbayeva, Tanzilya; Smolobochkin, Andrey; Gazizov, Almir; Babaeva, Olga; Lyubina, Anna; Sapunova, Anastasiia; Voloshina, Alexandra; Gerasimova, Daria; Burilov, Alexander; Pudovik, Michail","Diastereospecific cyclization of 3-arylidene-1-pyrrolinium salts containing an alkyltriarylphosphonium fragment: a path to the synthesis of new pyrrolizidine derivatives","New Journal of Chemistry","2025","49","34","14718","14727","10.1039/D5NJ02552D","","x-ray","0.71073","MoKα","","0.0696","0.0466","","","0.1068","0.1168","","","","","","1.017","","","","has coordinates","302736","2025-10-06","10:17:43",""
"7063959","22.2881","0.0005","9.303","0.0002","25.0735","0.0005","90","","93.118","0.002","90","","5191.2","0.19","200","0.1","200","0.1","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C55 H35 Br4 Cl3 N2 O6 S2 -","- C55 H35 Br4 Cl3 N2 O6 S2 -","- C220 H140 Br16 Cl12 N8 O24 S8 -","4","0.5","","Youssef, Khaled; Allain, Magali; Cougnon, Charles; Levillain, Eric; Melville, Hayley; Sanguinet, Lionel; Gohier, Frédéric","Investigating the impact of substitution on the optoelectronic properties of benzothiophenone S,S-dioxide","New Journal of Chemistry","2025","49","35","15096","15104","10.1039/D5NJ02518D","","","1.54184","CuKα","","0.0523","0.0494","","","0.1359","0.1392","","","","","","1.034","","","","has coordinates,has disorder","302733","2025-10-06","10:16:49",""
"7063960","6.6893","0.0002","8.732","0.0003","21.3446","0.0007","84.892","0.003","87.066","0.003","87.26","0.003","1239.01","0.07","200","0.1","200","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C55 H31 Br4 Cl3 N2 O6 S2 -","- C54 H30 Br4 N2 O6 S2 -","- C54 H30 Br4 N2 O6 S2 -","1","0.5","","Youssef, Khaled; Allain, Magali; Cougnon, Charles; Levillain, Eric; Melville, Hayley; Sanguinet, Lionel; Gohier, Frédéric","Investigating the impact of substitution on the optoelectronic properties of benzothiophenone S,S-dioxide","New Journal of Chemistry","2025","49","35","15096","15104","10.1039/D5NJ02518D","","","1.54184","CuKα","","0.0429","0.04","","","0.1073","0.1112","","","","","","1.034","","","","has coordinates","302733","2025-10-06","10:16:50",""
"7063961","14.9567","0.0006","8.5775","0.0005","10.1447","0.0004","90","","95.546","0.004","90","","1295.38","0.11","293","2","293","","","","","","","","synthesized","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 N4 S -","- C13 H12 N4 S -","- C52 H48 N16 S4 -","4","1","","Singh, Gurjaspreet; Sushma,; Kaur, Harshbir; Dalal, Anurag; Sahoo, Subash Chandra; Singh, Jandeep; George, Nancy; Esteban, Maria Angeles; Espinosa-Ruíz, Cristóbal","‘Click’ generated indole appended thiosemicarbazone–triazole cojoined organosilane: a sensor for the recognition of Hg2+ ions, in silico docking and in vitro cytotoxic evaluation","New Journal of Chemistry","2025","49","37","16056","16069","10.1039/D5NJ02083B","","x-ray","0.71073","MoKα","","0.0789","0.0571","","","0.1606","0.1779","","","","","","1.0279","","","","has coordinates","302713","2025-10-06","10:09:38",""
"7063962","9.0461","0.0002","8.2689","0.0002","11.643","0.0003","90","","100.671","0.003","90","","855.85","0.04","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H7 N O5 Zn -","- C8 H7 N O5 Zn -","- C32 H28 N4 O20 Zn4 -","4","1","","Basree,; Ali, Arif; Sepay, Nayim; Nayak, Ganesh Chandra; Siddiqui, Kafeel Ahmad; Ahmad, Musheer","DFT-assisted investigation of a 2D Zn(ii)-based coordination polymer, and its composite for supercapacitor and sensor uses","New Journal of Chemistry","2025","49","35","15105","15118","10.1039/D5NJ01894C","","","0.71073","MoKα","","0.0364","0.0295","","","0.0715","0.0741","","","","","","1.0305","","","","has coordinates","302732","2025-10-06","10:16:39",""
"7063963","10.0508","0.0003","11.1737","0.0005","12.3818","0.0003","102.72","0.003","91.193","0.002","97.12","0.003","1344.28","0.08","100","1","100","1","","","","","","","","6","P -1","-P 1","2","","","","- C52 H50 Cl4 Cu4 N16 O7 -","- C52 H36 Cl4 Cu4 N16 O7 -","- C52 H36 Cl4 Cu4 N16 O7 -","1","0.5","","Kawano, Miku; Wu, Ying-Ying; Li, Zhao-Yang; Mishima, Akio; Kawata, Satoshi; Ishikawa, Ryuta","Magnetic superexchange couplings in doubly bis(2-pyridyl)pyrazolato-bridged dinuclear copper(ii) complexes","New Journal of Chemistry","2025","49","36","15691","15699","10.1039/D5NJ02006A","","","0.71075","MoKα","","0.0457","0.0356","","","0.0927","0.0959","","","","","","1.094","","","","has coordinates","302729","2025-10-06","10:15:29",""
"7063964","9.6034","0.0004","21.4059","0.001","18.5722","0.0008","90.011","0.002","99.672","0.002","89.998","0.002","3763.6","0.3","141","","141","","","","","","","","","4","P -1","-P 1","2","","","","- C25 H18 N2 O -","- C25 H18 N2 O -","- C200 H144 N16 O8 -","8","4","","Santra, Souvik; Guchhait, Nikhil","Substituent effect on the solvatochromic behaviour of benzoimidazole based donor–acceptor type fluorescent molecules","New Journal of Chemistry","2025","49","37","16256","16270","10.1039/D5NJ02580J","","x-ray","0.71073","MoKα","","0.0897","0.0619","","","0.1397","0.1594","","","","","","1.064","","","","has coordinates","302710","2025-10-06","10:08:52",""
"7063965","10.3689","0.0005","10.5578","0.0006","12.0948","0.0007","92.824","0.002","111.322","0.002","95.348","0.002","1223.11","0.12","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H27 N3 O2 -","- C30 H27 N3 O2 -","- C60 H54 N6 O4 -","2","1","","Santra, Souvik; Guchhait, Nikhil","Substituent effect on the solvatochromic behaviour of benzoimidazole based donor–acceptor type fluorescent molecules","New Journal of Chemistry","2025","49","37","16256","16270","10.1039/D5NJ02580J","","","0.71073","MoKα","","0.1851","0.0771","","","0.1782","0.2525","","","","","","1.042","","","","has coordinates","302710","2025-10-06","10:08:53",""
"7063966","6.4775","0.0002","11.0809","0.0003","18.6254","0.0006","75.642","0.001","82.696","0.001","84.674","0.001","1281.98","0.07","199.99","","199.99","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H18 F3 N S2 -","- C34 H18 F3 N S2 -","- C68 H36 F6 N2 S4 -","2","1","","Liang, Shan; Li, Jialin; Lin, Jieyu; Liu, Wei; Na, Zhenkai; Chen, Junru; Zeng, Chongyang; Feng, Xing","Aromatic heterocyclic π-bridge engineering for broad-color tunable and stimuli-responsive pyrene-based AIEgens","New Journal of Chemistry","2025","49","38","16764","16772","10.1039/D5NJ02802G","","","0.71073","MoKα","","0.1141","0.0662","","","0.1238","0.1604","","","","","","1.028","","","","has coordinates,has disorder","302740","2025-10-06","10:18:43",""
"7063967","11.7995","0.0004","18.6988","0.0007","14.202","0.0005","90","","94.0741","0.0012","90","","3125.56","0.19","150","2","150","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C39 H36 N2 O4 -","- C39 H36 N2 O4 -","- C156 H144 N8 O16 -","4","1","","Chen, Silu; Ma, Lan; Yue, Chao; Du, Biao; Lu, Cuifen; Long, Chunyan; Wu, Wanbing; Li, Sicheng; He, Qiao; Yue, Guizhou","Base-controlled diastereoselective [3+2]-cycloaddition and Michael addition of isatin ketonitrones and chalcones to construct spiropyrrolidine oxoindoles and γ-substituted isatin ketonitrones","New Journal of Chemistry","2025","49","39","16978","16988","10.1039/D5NJ02378E","","","0.71073","MoKα","","0.051","0.0442","","","0.1065","0.1122","","","","","","1.013","","","","has coordinates","303878","2025-11-29","21:45:09",""
"7063968","12.539","0.0015","14.6451","0.0017","19.265","0.002","70.206","0.004","89.215","0.004","73.626","0.004","3180.6","0.6","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C37 H29 Br N2 O3 -","- C37 H29 Br N2 O3 -","- C148 H116 Br4 N8 O12 -","4","2","","Chen, Silu; Ma, Lan; Yue, Chao; Du, Biao; Lu, Cuifen; Long, Chunyan; Wu, Wanbing; Li, Sicheng; He, Qiao; Yue, Guizhou","Base-controlled diastereoselective [3+2]-cycloaddition and Michael addition of isatin ketonitrones and chalcones to construct spiropyrrolidine oxoindoles and γ-substituted isatin ketonitrones","New Journal of Chemistry","2025","49","39","16978","16988","10.1039/D5NJ02378E","","","0.71073","MoKα","","0.0484","0.0406","","","0.1133","0.1199","","","","","","1.073","","","","has coordinates","303878","2025-11-29","21:45:10",""
"7063969","9.839","0.0004","10.9281","0.0005","13.4307","0.0006","111.013","0.002","91.816","0.002","109.59","0.002","1250.93","0.1","296","2","296.15","","","","","","","","","5","P -1","-P 1","2","","(2Z,2'Z)-2,2'-(1H,1'H-spiro[pyrrolo[1,2-c]thiazole-3,3'-thiazolo[3,4-a]indole]-1,1'-diylidene)bis(1-phenylethan-1-one)","","- C31 H20 N2 O2 S2 -","- C31 H20 N2 O2 S2 -","- C62 H40 N4 O4 S4 -","2","1","","Tomilin, Denis N.; Stepanova, Sophia A.; Borodina, Tatyana N.; Ushakov, Igor A.; Trofimov, Boris A.","Synthesis of functionalized thiazoloindole-3-thiones and their spirocongeners from 2-acylethynyl-4,5,6,7-tetrahydroindoles and carbon disulfide","New Journal of Chemistry","2025","49","38","16820","16827","10.1039/D5NJ02380G","","","1.54178","CuKα","","0.048","0.0378","","","0.0928","0.0991","","","","","","1.035","","","","has coordinates","302739","2025-10-06","10:18:34",""
"7063970","8.8295","0.0007","9.3887","0.0008","12.4254","0.0011","69.679","0.003","88.609","0.003","85.821","0.003","963.36","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","dimethyl 2-(1,3-dimethoxy-1,3-dioxopropan-2-yl)-5-oxo-3-phenyl-2,5-dihydro-1H-pyrrole-2,4-dicarboxylate","","- C19 H19 N O9 -","- C19 H19 N O9 -","- C38 H38 N2 O18 -","2","1","","Pradhan, Priyankar; Shaikh Sumaiya, A.; Jagadeesh Babu, N.; Sudhakar, Gangarajula","Cascade reaction of 2-bromo-2H-azirine-2-carboxylate with malonic esters: facile access to highly substituted pyrrolinones","New Journal of Chemistry","2025","49","36","15573","15577","10.1039/D5NJ02356D","","","0.71073","MoKα","","0.1082","0.073","","","0.2087","0.2366","","","","","","1.068","","","","has coordinates,has disorder","302728","2025-10-06","10:15:21",""
"7063971","14.616","0.004","11.71","0.003","15.622","0.004","90","","115.853","0.008","90","","2406.2","1.1","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-benzyl 4-methyl 3-(benzyloxy)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrole-3,4-dicarboxylate","","- C27 H23 N O6 -","- C27 H23 N O6 -","- C108 H92 N4 O24 -","4","1","","Pradhan, Priyankar; Shaikh Sumaiya, A.; Jagadeesh Babu, N.; Sudhakar, Gangarajula","Cascade reaction of 2-bromo-2H-azirine-2-carboxylate with malonic esters: facile access to highly substituted pyrrolinones","New Journal of Chemistry","2025","49","36","15573","15577","10.1039/D5NJ02356D","","","0.71073","MoKα","","0.0749","0.0502","","","0.1375","0.16","","","","","","1.029","","","","has coordinates,has disorder","302728","2025-10-06","10:15:22",""
"7063972","4.6357","0.0001","13.241","0.0002","19.5183","0.0003","90","","93.488","0.001","90","","1195.84","0.04","150.15","","150.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-((Z)-(2-methyl-4-nitro-phenylimino)methyl)phenol","","- C14 H12 N2 O3 -","- C14 H12 N2 O3 -","- C56 H48 N8 O12 -","4","1","","Enamullah, Mohammed; Haque, Imdadul; Abdullah, Galib; Sourav, Fahad Hossain; Jhumur, Nisat Taslum; Islam, Mohammad Khairul; Haj Hassani Sohi, Takin; Ferber, Peter; Janiak, Christoph","Dinuclear vs. mononuclear copper(ii) complexes with nitrophenylimino-benzylal- vs. -naphthylal-based Schiff base ligands","New Journal of Chemistry","2025","49","39","17106","17123","10.1039/D5NJ02584B","","","1.54184","CuKα","","0.0405","0.0383","","","0.1075","0.1114","","","","","","1.068","","","","has coordinates","303875","2025-11-29","21:44:36",""
"7063973","6.9732","0.0002","12.8165","0.0003","15.7069","0.0004","90","","97.887","0.002","90","","1390.48","0.06","149.99","0.1","149.99","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-((Z)-(2-methyl-4-nitro-phenylimino)methyl)naphthalen-2-ol","","- C18 H14 N2 O3 -","- C18 H14 N2 O3 -","- C72 H56 N8 O12 -","4","1","","Enamullah, Mohammed; Haque, Imdadul; Abdullah, Galib; Sourav, Fahad Hossain; Jhumur, Nisat Taslum; Islam, Mohammad Khairul; Haj Hassani Sohi, Takin; Ferber, Peter; Janiak, Christoph","Dinuclear vs. mononuclear copper(ii) complexes with nitrophenylimino-benzylal- vs. -naphthylal-based Schiff base ligands","New Journal of Chemistry","2025","49","39","17106","17123","10.1039/D5NJ02584B","","x-ray","1.54184","CuKα","","0.0542","0.0496","","","0.1464","0.1486","","","","","","1.13","","","","has coordinates","303875","2025-11-29","21:44:37",""
"7063974","6.8594","0.0002","13.105","0.0004","16.0708","0.0005","90","","101.446","0.003","90","","1415.91","0.08","199.98","0.1","199.98","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-((Z)-(4-methyl-2-nitro-phenylimino)methyl)naphthalen-2-ol","","- C18 H14 N2 O3 -","- C18 H14 N2 O3 -","- C72 H56 N8 O12 -","4","1","","Enamullah, Mohammed; Haque, Imdadul; Abdullah, Galib; Sourav, Fahad Hossain; Jhumur, Nisat Taslum; Islam, Mohammad Khairul; Haj Hassani Sohi, Takin; Ferber, Peter; Janiak, Christoph","Dinuclear vs. mononuclear copper(ii) complexes with nitrophenylimino-benzylal- vs. -naphthylal-based Schiff base ligands","New Journal of Chemistry","2025","49","39","17106","17123","10.1039/D5NJ02584B","","x-ray","1.54184","CuKα","","0.0545","0.0426","","","0.1117","0.1182","","","","","","1.054","","","","has coordinates","303875","2025-11-29","21:44:37",""
"7063975","10.6103","0.0002","11.1734","0.0002","12.9695","0.0003","90","","108.211","0.003","90","","1460.56","0.06","299.17","0.1","299.17","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis{1-((Z)-(4-methyl-2-nitro-phenylimino)methyl))naphthalen-2-olato-κ^2^N,O}copper(II)","","- C36 H26 Cu N4 O6 -","- C36 H26 Cu N4 O6 -","- C72 H52 Cu2 N8 O12 -","2","0.5","","Enamullah, Mohammed; Haque, Imdadul; Abdullah, Galib; Sourav, Fahad Hossain; Jhumur, Nisat Taslum; Islam, Mohammad Khairul; Haj Hassani Sohi, Takin; Ferber, Peter; Janiak, Christoph","Dinuclear vs. mononuclear copper(ii) complexes with nitrophenylimino-benzylal- vs. -naphthylal-based Schiff base ligands","New Journal of Chemistry","2025","49","39","17106","17123","10.1039/D5NJ02584B","","x-ray","1.54184","CuKα","","0.0414","0.036","","","0.0982","0.1031","","","","","","1.064","","","","has coordinates","303875","2025-11-29","21:44:37",""
"7063976","13.8495","0.0002","19.678","0.0003","20.54938","0.00019","106.137","0.001","98.9681","0.0011","102.755","0.0012","5103.9","0.13","150.15","","150.15","","","","","","","","","5","P -1","-P 1","2","","Bis{2-((Z)-(2-methyl-4-nitro-phenylimino)methyl)phenolato-κ^2^N,O}copper(II)","","- C56 H44 Cu2 N8 O12 -","- C56 H44 Cu2 N8 O12 -","- C224 H176 Cu8 N32 O48 -","4","2","","Enamullah, Mohammed; Haque, Imdadul; Abdullah, Galib; Sourav, Fahad Hossain; Jhumur, Nisat Taslum; Islam, Mohammad Khairul; Haj Hassani Sohi, Takin; Ferber, Peter; Janiak, Christoph","Dinuclear vs. mononuclear copper(ii) complexes with nitrophenylimino-benzylal- vs. -naphthylal-based Schiff base ligands","New Journal of Chemistry","2025","49","39","17106","17123","10.1039/D5NJ02584B","","x-ray","1.54184","CuKα","","0.0431","0.0387","","","0.1051","0.1079","","","","","","1.059","","","","has coordinates","303875","2025-11-29","21:44:37",""
"7063977","8.0589","0.0002","9.5041","0.0003","9.9284","0.0003","73.915","0.001","83.529","0.001","86.707","0.001","725.74","0.04","173","2","173","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H15 Cl Cu N3 -","- C15 H15 Cl Cu N3 -","- C30 H30 Cl2 Cu2 N6 -","2","1","","Tao, Sheng; Du, Zhi-Hong; Bo, Chun-Bo; Li, Min; Chen, Fei; Liu, Ning","Base-free catalytic systems achieved via the design of copper complexes: synthesis of 2-oxazolidinones from propargylic amines and CO2","New Journal of Chemistry","2025","49","37","16122","16133","10.1039/D5NJ02766G","","","0.71073","MoKα","","0.0229","0.0218","","","0.0561","0.0568","","","","","","1.063","","","","has coordinates","302712","2025-10-06","10:09:29",""
"7063978","9.5552","0.0007","9.6313","0.0008","9.6771","0.0008","115.701","0.005","98.853","0.005","91.448","0.005","788.66","0.12","300","2","300","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 Cl Cu N2 -","- C16 H16 Cl Cu N2 -","- C32 H32 Cl2 Cu2 N4 -","2","1","","Tao, Sheng; Du, Zhi-Hong; Bo, Chun-Bo; Li, Min; Chen, Fei; Liu, Ning","Base-free catalytic systems achieved via the design of copper complexes: synthesis of 2-oxazolidinones from propargylic amines and CO2","New Journal of Chemistry","2025","49","37","16122","16133","10.1039/D5NJ02766G","","","1.54178","CuKα","","0.0938","0.0605","","","0.1514","0.1803","","","","","","1.085","","","","has coordinates","302712","2025-10-06","10:09:29",""
"7063979","10.119","0.002","9.0203","0.0017","16.587","0.004","90","","95.181","0.007","90","","1507.8","0.5","273.15","","273.15","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Br Cl Cu N2 O -","- C14 H12 Br Cl Cu N2 O -","- C56 H48 Br4 Cl4 Cu4 N8 O4 -","4","1","","Pattanayak, Satyajit; Sarkar, Tuhin; Maity, Ribhu; Das, Priyanka; Brandao, Paula; Maity, Tithi; Sarkar, Keka; Samanta, Bidhan Chandra","Biophysical characterization of centrosymmetric doubly bridged Cu(ii) complexes: comparative DNA/BSA binding and potential applications","New Journal of Chemistry","2025","49","38","16849","16862","10.1039/D5NJ01809A","","","0.71073","MoKα","","0.0292","0.0263","","","0.0675","0.0696","","","","","","1.06","","","","has coordinates","302742","2025-10-06","10:19:28",""
"7063980","9.9841","0.0006","9.0147","0.0005","16.5122","0.001","90","","95.9965","0.0018","90","","1478.03","0.15","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 Cl4 Cu2 N4 O2 -","- C28 H24 Cl4 Cu2 N4 O2 -","- C56 H48 Cl8 Cu4 N8 O4 -","2","0.5","","Pattanayak, Satyajit; Sarkar, Tuhin; Maity, Ribhu; Das, Priyanka; Brandao, Paula; Maity, Tithi; Sarkar, Keka; Samanta, Bidhan Chandra","Biophysical characterization of centrosymmetric doubly bridged Cu(ii) complexes: comparative DNA/BSA binding and potential applications","New Journal of Chemistry","2025","49","38","16849","16862","10.1039/D5NJ01809A","","","0.71073","MoKα","","0.0266","0.0244","","","0.0679","0.0699","","","","","","1.032","","","","has coordinates","302742","2025-10-06","10:19:39",""
"7063981","7.611","0.0002","9.8752","0.0003","12.4976","0.0003","90","","90","","90","","939.32","0.04","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H8 Cu N Na O7 -","- C6 H8 Cu N Na O7 -","- C24 H32 Cu4 N4 Na4 O28 -","4","1","","Sharma, Sahil; Rohilla, Jyoti; Thakur, Sahil; Singh, Raghubir; Kaur, Varinder","Silver anchored Cu–Na and Co–Na atrane MOFs as photocatalysts for the visible-light-driven degradation and decolourization of a hydroxyanthraquinone dye","New Journal of Chemistry","2025","49","37","16213","16225","10.1039/D5NJ02361K","","x-ray","0.71073","MoKα","","0.0325","0.0296","","","0.0711","0.0728","","","","","","1.036","","","","has coordinates","302714","2025-10-06","10:10:06",""
"7063982","7.9499","0.0004","9.7468","0.0004","12.2008","0.0005","90","","90","","90","","945.39","0.07","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H8 Co N Na O7 -","- C6 H8 Co N Na O7 -","- C24 H32 Co4 N4 Na4 O28 -","4","1","","Sharma, Sahil; Rohilla, Jyoti; Thakur, Sahil; Singh, Raghubir; Kaur, Varinder","Silver anchored Cu–Na and Co–Na atrane MOFs as photocatalysts for the visible-light-driven degradation and decolourization of a hydroxyanthraquinone dye","New Journal of Chemistry","2025","49","37","16213","16225","10.1039/D5NJ02361K","","x-ray","0.71073","MoKα","","0.0615","0.0501","","","0.1211","0.1282","","","","","","1.049","","","","has coordinates","302714","2025-10-06","10:10:08",""
"7063983","24.1231","0.001","19.009","0.0008","10.625","0.0004","90","","90","","90","","4872.2","0.3","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C52 H64 Dy N4 O6 P -","- C52 H64 Dy N4 O6 P -","- C208 H256 Dy4 N16 O24 P4 -","4","1","","Kammereck, Stefanie; Bousrez, Guillaume; Renier, Olivier; Paterlini, Veronica; Smetana, Volodymyr; Mudring, Anja-Verena","Crystal chemistry and luminescence properties of tetrabutylphosphonium tetrakis(8-quinolinato)lanthanidate [P4444][Ln(Q)4]·2X (X = H2O and (CH3)2CO)","New Journal of Chemistry","2025","49","38","16493","16500","10.1039/D4NJ03697B","","","0.71073","MoKα","","0.0431","0.0344","","","0.0712","0.0748","","","","","","1.044","","","","has coordinates,has disorder","302741","2025-10-06","10:19:07",""
"7063984","24.0475","0.0007","18.9425","0.0006","10.6047","0.0003","90","","90","","90","","4830.7","0.2","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C52 H64 Ho N4 O6 P -","- C52 H64 Ho N4 O6 P -","- C208 H256 Ho4 N16 O24 P4 -","4","1","","Kammereck, Stefanie; Bousrez, Guillaume; Renier, Olivier; Paterlini, Veronica; Smetana, Volodymyr; Mudring, Anja-Verena","Crystal chemistry and luminescence properties of tetrabutylphosphonium tetrakis(8-quinolinato)lanthanidate [P4444][Ln(Q)4]·2X (X = H2O and (CH3)2CO)","New Journal of Chemistry","2025","49","38","16493","16500","10.1039/D4NJ03697B","","","0.71073","MoKα","","0.075","0.0488","","","0.0636","0.0689","","","","","","1.123","","","","has coordinates,has disorder","302741","2025-10-06","10:19:08",""
"7063985","24.0667","0.001","18.9289","0.0008","10.6019","0.0004","90","","90","","90","","4829.8","0.3","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C52 H64 N4 O6 P Y -","- C52 H64 N4 O6 P Y -","- C208 H256 N16 O24 P4 Y4 -","4","1","","Kammereck, Stefanie; Bousrez, Guillaume; Renier, Olivier; Paterlini, Veronica; Smetana, Volodymyr; Mudring, Anja-Verena","Crystal chemistry and luminescence properties of tetrabutylphosphonium tetrakis(8-quinolinato)lanthanidate [P4444][Ln(Q)4]·2X (X = H2O and (CH3)2CO)","New Journal of Chemistry","2025","49","38","16493","16500","10.1039/D4NJ03697B","","","0.71073","MoKα","","0.0368","0.0301","","","0.0716","0.0746","","","","","","1.04","","","","has coordinates,has disorder","302741","2025-10-06","10:19:08",""
"7063986","24.138","0.001","18.9614","0.0008","10.6117","0.0004","90","","90","","90","","4856.9","0.3","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C52 H64 N4 O6 P Tm -","- C52 H64 N4 O6 P Tm -","- C208 H256 N16 O24 P4 Tm4 -","4","1","","Kammereck, Stefanie; Bousrez, Guillaume; Renier, Olivier; Paterlini, Veronica; Smetana, Volodymyr; Mudring, Anja-Verena","Crystal chemistry and luminescence properties of tetrabutylphosphonium tetrakis(8-quinolinato)lanthanidate [P4444][Ln(Q)4]·2X (X = H2O and (CH3)2CO)","New Journal of Chemistry","2025","49","38","16493","16500","10.1039/D4NJ03697B","","","0.71073","MoKα","","0.0303","0.0254","","","0.055","0.0572","","","","","","1.063","","","","has coordinates,has disorder","302741","2025-10-06","10:19:08",""
"7063987","11.863","0.003","11.901","0.003","21.584","0.006","94.178","0.011","99.341","0.01","114.634","0.009","2699.5","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H72 N4 O6 P Yb -","- C58 H72 N4 O6 P Yb -","- C116 H144 N8 O12 P2 Yb2 -","2","1","","Kammereck, Stefanie; Bousrez, Guillaume; Renier, Olivier; Paterlini, Veronica; Smetana, Volodymyr; Mudring, Anja-Verena","Crystal chemistry and luminescence properties of tetrabutylphosphonium tetrakis(8-quinolinato)lanthanidate [P4444][Ln(Q)4]·2X (X = H2O and (CH3)2CO)","New Journal of Chemistry","2025","49","38","16493","16500","10.1039/D4NJ03697B","","","0.71073","MoKα","","0.0738","0.059","","","0.1525","0.1634","","","","","","1.055","","","","has coordinates","302741","2025-10-06","10:19:08",""
"7063988","24.1173","0.0015","18.9621","0.0013","10.6235","0.0006","90","","90","","90","","4858.3","0.5","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C52 H64 Er N4 O6 P -","- C52 H64 Er N4 O6 P -","- C208 H256 Er4 N16 O24 P4 -","4","1","","Kammereck, Stefanie; Bousrez, Guillaume; Renier, Olivier; Paterlini, Veronica; Smetana, Volodymyr; Mudring, Anja-Verena","Crystal chemistry and luminescence properties of tetrabutylphosphonium tetrakis(8-quinolinato)lanthanidate [P4444][Ln(Q)4]·2X (X = H2O and (CH3)2CO)","New Journal of Chemistry","2025","49","38","16493","16500","10.1039/D4NJ03697B","","","0.71073","MoKα","","0.1145","0.0634","","","0.0859","0.0982","","","","","","1.178","","","","has coordinates,has disorder","302741","2025-10-06","10:19:08",""
"7063989","24.1946","0.0019","18.9548","0.0012","10.6151","0.0006","90","","90","","90","","4868.1","0.6","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C52 H64 Lu N4 O6 P -","- C52 H64 Lu N4 O6 P -","- C208 H256 Lu4 N16 O24 P4 -","4","1","","Kammereck, Stefanie; Bousrez, Guillaume; Renier, Olivier; Paterlini, Veronica; Smetana, Volodymyr; Mudring, Anja-Verena","Crystal chemistry and luminescence properties of tetrabutylphosphonium tetrakis(8-quinolinato)lanthanidate [P4444][Ln(Q)4]·2X (X = H2O and (CH3)2CO)","New Journal of Chemistry","2025","49","38","16493","16500","10.1039/D4NJ03697B","","","0.71073","MoKα","","0.0557","0.0313","","","0.0613","0.0699","","","","","","1.004","","","","has coordinates,has disorder","302741","2025-10-06","10:19:08",""
"7063990","7.2","0.0001","10.2862","0.0002","24.1774","0.0004","90","","90","","90","","1790.59","0.05","219.99","0.1","219.99","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 Br N3 O3 -","- C17 H18 Br N3 O3 -","- C68 H72 Br4 N12 O12 -","4","1","","Lou, Jing; Zhu, Xian-Qiao; Pan, Di-Cheng; Liu, De-Wu; Jing, Hui-Xian; Liu, Xiong-Li; Zhang, Wen-Jing; Cen, Hong-Xing; Deng, Guo-Dong","Monodentate/bidentate chiral Ph/Py-NO ligands: an unexpected switch of enantioselectivity in Friedel–Crafts alkylation of indoles and 2,3-dioxopyrrolidines","New Journal of Chemistry","2025","49","39","17335","17349","10.1039/D5NJ02472B","","x-ray","1.54184","CuKα","","0.0443","0.0414","","","0.1078","0.1121","","","","","","1.038","","","","has coordinates","303877","2025-11-29","21:44:58",""
"7063991","18.321","0.013","5.648","0.004","14.128","0.01","90","","123.76","0.007","90","","1215.4","1.5","296","2","296.15","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- Ba Mo5 O16 -","- Ba Mo5 O16 -","- Ba4 Mo20 O64 -","4","0.5","","Du, Shiyu; Zhang, Paipai; Liu, Haozhen; An, Donghai; Chen, Yanna","A new ultraviolet-transparent molybdate featuring a layered structure and moderate birefringence","New Journal of Chemistry","2025","49","40","17561","17567","10.1039/D5NJ03191E","","","0.71073","MoKα","","0.0526","0.0388","","","0.0756","0.081","","","","","","1.085","","","","has coordinates","303886","2025-11-29","21:50:03",""
"7063992","14.7041","0.0005","7.4689","0.0002","35.5426","0.001","90","","90.348","0.003","90","","3903.3","0.2","294.7","0.8","294.7","0.8","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50.25 H35.25 N4 O -","- C50.25 H35.25 N4 O -","- C201 H141 N16 O4 -","4","1","","Kumar, Surendra; Srivastava, Ankit Kumar; Kushwaha, Ashish Kumar; Kumar, Anjani; Singh, Roop Shikha","Mechanochromism and aggregation-induced emission directed by donor strength in quinoxaline-based D–A molecules with application in latent fingerprinting and inkless writing","New Journal of Chemistry","2025","49","39","17300","17312","10.1039/D5NJ02578H","","x-ray","0.71073","MoKα","","0.12","0.0642","","","0.1913","0.2247","","","","","","1.064","","","","has coordinates","303876","2025-11-29","21:44:49",""
"7063993","19.7024","0.0007","20.9515","0.0006","30.4086","0.0011","82.99","0.001","88.863","0.001","76.849","0.001","12131.5","0.7","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C18 H198 Bi14 La6 N8 Na12 O356 Sb6 W76 -","- C18 Bi14 La6 N8 Na12 O356 Sb6 W76 -","- C18 Bi14 La6 N8 Na12 O356 Sb6 W76 -","1","0.5","","Lian, Chen; Chen, Ya-Meng; Fan, Yan-Meng; Xu, Zhuang; Li, Hai-Lou","A La-containing poly(polyoxometalate) simultaneously comprising tungstoantimonate and tungstobismuthate segments: synthesis, structure and catalysis","New Journal of Chemistry","2025","49","40","17470","17475","10.1039/D5NJ03326H","","","0.71073","MoKα","","0.0531","0.0456","","","0.1233","0.1278","","","","","","1.027","","","","has coordinates","303885","2025-11-29","21:49:54",""
"7063994","12.831","0.002","13.078","0.003","15.724","0.003","92.818","0.015","94.827","0.013","114.084","0.018","2390.2","0.9","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C62 H46 N2 S2 -","- C62 H46 N2 S2 -","- C124 H92 N4 S4 -","2","1","","Ou, Tao; Kong, Lingxu; Song, Changsen; Shang, Bingyan; Yang, Jingjing; Zuo, Jinxin; Di, Feifan; Yan, Maocai; Ding, Lin; Li, Ruiji","Synthesis and photochromic modulation of aromaticity in dinaphthylethene derivatives","New Journal of Chemistry","2025","49","41","17841","17848","10.1039/D5NJ03137K","","x-ray","0.71073","MoKα","","0.5176","0.1748","","","0.3636","0.5661","","","","","","0.9155","","","","has coordinates","303859","2025-11-29","21:39:48",""
"7063995","9.5526","0.0008","30.64","0.002","11.7643","0.001","90","","105.132","0.009","90","","3323.9","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C90 H66 S3 -","- C90 H66 S3 -","- C180 H132 S6 -","2","1","","Ou, Tao; Kong, Lingxu; Song, Changsen; Shang, Bingyan; Yang, Jingjing; Zuo, Jinxin; Di, Feifan; Yan, Maocai; Ding, Lin; Li, Ruiji","Synthesis and photochromic modulation of aromaticity in dinaphthylethene derivatives","New Journal of Chemistry","2025","49","41","17841","17848","10.1039/D5NJ03137K","","x-ray","0.71073","MoKα","","0.278","0.0659","","","0.1318","0.2052","","","","","","0.894","","","","has coordinates","303859","2025-11-29","21:39:48",""
"7063996","13.023","0.003","16.781","0.003","10.7881","0.0017","90","","96.714","0.017","90","","2341.5","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H23 N S -","- C31 H23 N S -","- C124 H92 N4 S4 -","4","1","","Ou, Tao; Kong, Lingxu; Song, Changsen; Shang, Bingyan; Yang, Jingjing; Zuo, Jinxin; Di, Feifan; Yan, Maocai; Ding, Lin; Li, Ruiji","Synthesis and photochromic modulation of aromaticity in dinaphthylethene derivatives","New Journal of Chemistry","2025","49","41","17841","17848","10.1039/D5NJ03137K","","x-ray","0.71073","MoKα","","0.6013","0.4705","","","0.7991","0.8406","","","","","","3.967","","","","has coordinates","303859","2025-11-29","21:39:48",""
"7063997","10.431","0.004","11.026","0.004","11.802","0.006","113.27","0.04","102.05","0.04","107.42","0.03","1103.8","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H21 Cl N3 S0.5 -","- C30 H21 S -","- C60 H42 S2 -","2","1","","Ou, Tao; Kong, Lingxu; Song, Changsen; Shang, Bingyan; Yang, Jingjing; Zuo, Jinxin; Di, Feifan; Yan, Maocai; Ding, Lin; Li, Ruiji","Synthesis and photochromic modulation of aromaticity in dinaphthylethene derivatives","New Journal of Chemistry","2025","49","41","17841","17848","10.1039/D5NJ03137K","","x-ray","0.71073","MoKα","","0.2744","0.1672","","","0.4112","0.4725","","","","","","1.349","","","","has coordinates","303859","2025-11-29","21:39:48",""
"7063998","6.6698","0.0001","6.9395","0.0002","10.3982","0.0002","86.102","0.002","89.671","0.002","65.634","0.002","437.267","0.018","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H14 Co O10 -","- C20 H14 Co O10 -","- C20 H14 Co O10 -","1","0.5","","Azam, Sahil; Dutta, Subhajit; Hui, Sayani; Jana, Narayan Ch.; Bagh, Bidraha; Mahata, Partha; Mondal, Sudip Kumar","Selective detection of an organophosphorus pesticide using a pH-sensitive metal–organic compound containing a cobalt(ii) ion","New Journal of Chemistry","2025","49","40","17730","17742","10.1039/D5NJ02157J","","","1.54184","CuKα","","0.0264","0.026","","","0.0708","0.0718","","","","","","1.09","","","","has coordinates","303889","2025-11-29","21:50:43",""
"7063999","8.2316","0.0005","10.0169","0.0006","10.2069","0.0007","75.671","0.003","88.906","0.003","87.669","0.003","814.72","0.09","300","","300","","","","","","","","","5","P -1","-P 1","2","","","","- Al2 Cs2 O16 P4 Ti -","- Al2 Cs2 O16 P4 Ti -","- Al4 Cs4 O32 P8 Ti2 -","2","1","","Baiheti, Tuohetijiang; Ababaike, Mairihaba; Wumaier, Salamaiti; Wang, Shutong","M2Al2Ti(PO4)4 (M = Rb, Cs): synthesis and optical property investigation of two titanium phosphates with a dissimilar structural configuration","New Journal of Chemistry","2025","49","40","17694","17700","10.1039/D5NJ03072B","","","0.71073","MoKα","","0.0464","0.0379","","","0.0892","0.0979","","","","","","1.055","","","","has coordinates","303890","2025-11-29","21:50:53",""
"7064000","18.1206","0.0017","5.231","0.0004","7.8105","0.0007","90","","95.684","0.004","90","","736.71","0.11","156","","156","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- Al2 O16 P4 Rb2 Ti -","- Al2 O16 P4 Rb2 Ti -","- Al4 O32 P8 Rb4 Ti2 -","2","0.25","","Baiheti, Tuohetijiang; Ababaike, Mairihaba; Wumaier, Salamaiti; Wang, Shutong","M2Al2Ti(PO4)4 (M = Rb, Cs): synthesis and optical property investigation of two titanium phosphates with a dissimilar structural configuration","New Journal of Chemistry","2025","49","40","17694","17700","10.1039/D5NJ03072B","","","0.71073","MoKα","","0.0627","0.0396","","","0.0871","0.0952","","","","","","1.096","","","","has coordinates","303890","2025-11-29","21:50:54",""
"7064001","12.3359","0.0006","14.5696","0.0005","7.3867","0.0005","90","","98.76","0.03","90","","1312.12","0.16","300","","300","","","","","","","","","4","P 1 21 1","P 2yb","4","","Iron Ethyl-Isonicotinate nitroprusside","","- C21 Fe2 N8 O5 -","- C21 Fe2 N8 O5 -","- C42 Fe4 N16 O10 -","2","1","","Vázquez, M. C.; Avila, Y.; Mojica, R.; Cervera-Gabalda, L.; Galarreta-Rodríguez, I.; González, M.; Rodríguez-Hernández, J.; Rubio-Zuazo, J.; Reguera, E.","Spin crossover in Fe(4X-isonicotinate)2[Fe(CN)5NO] with X = methyl and ethyl: the effect of the 4X substituent size on the spin transition","New Journal of Chemistry","2025","49","40","17434","17446","10.1039/D5NJ02938D","powder diffraction","","","CuKa","","","","","","","","","26.2757","1.564","","","","","","","has coordinates","303888","2025-11-29","21:50:32",""
"7064002","11.5223","0.0004","15.0011","0.0006","7.24418","0.00005","90","","99.23","0.05","90","","1235.92","0.19","300","","300","","","","","","","","","4","P 1 21 1","P 2yb","4","","Iron (Methyl-Isonicotinate) nitroprussiate - 300K","","- C19 Fe2 N8 O5 -","- C19 Fe2 N8 O5 -","- C38 Fe4 N16 O10 -","2","1","","Vázquez, M. C.; Avila, Y.; Mojica, R.; Cervera-Gabalda, L.; Galarreta-Rodríguez, I.; González, M.; Rodríguez-Hernández, J.; Rubio-Zuazo, J.; Reguera, E.","Spin crossover in Fe(4X-isonicotinate)2[Fe(CN)5NO] with X = methyl and ethyl: the effect of the 4X substituent size on the spin transition","New Journal of Chemistry","2025","49","40","17434","17446","10.1039/D5NJ02938D","powder diffraction","","0.825878","synchrotron","","","","","","","","","33.3398","1.564","","","","","","","has coordinates","303888","2025-11-29","21:50:33",""
"7064003","11.4112","0.0004","14.7556","0.0006","7.0769","0.0005","90","","99.62","0.05","90","","1174.8","0.2","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","Iron (Methyl-Isonicotinate) nitroprussiate - 100K","","- C19 Fe2 N8 O5 -","- C19 Fe2 N8 O5 -","- C38 Fe4 N16 O10 -","2","1","","Vázquez, M. C.; Avila, Y.; Mojica, R.; Cervera-Gabalda, L.; Galarreta-Rodríguez, I.; González, M.; Rodríguez-Hernández, J.; Rubio-Zuazo, J.; Reguera, E.","Spin crossover in Fe(4X-isonicotinate)2[Fe(CN)5NO] with X = methyl and ethyl: the effect of the 4X substituent size on the spin transition","New Journal of Chemistry","2025","49","40","17434","17446","10.1039/D5NJ02938D","powder diffraction","","0.825787","synchrotron","","","","","","","","","28.0011","1.564","","","","","","","has coordinates","303888","2025-11-29","21:50:33",""
"7064004","12.2888","0.0006","14.5058","0.0005","7.3438","0.0005","90","","98.98","0.03","90","","1293.05","0.16","80","","80","","","","","","","","","4","P 1 21 1","P 2yb","4","","Iron Ethyl-Isonicotinate nitroprusside","","- C21 Fe2 N8 O5 -","- C21 Fe2 N8 O5 -","- C42 Fe4 N16 O10 -","2","1","","Vázquez, M. C.; Avila, Y.; Mojica, R.; Cervera-Gabalda, L.; Galarreta-Rodríguez, I.; González, M.; Rodríguez-Hernández, J.; Rubio-Zuazo, J.; Reguera, E.","Spin crossover in Fe(4X-isonicotinate)2[Fe(CN)5NO] with X = methyl and ethyl: the effect of the 4X substituent size on the spin transition","New Journal of Chemistry","2025","49","40","17434","17446","10.1039/D5NJ02938D","powder diffraction","","","CuKa","","","","","","","","","30.6551","1.564","","","","","","","has coordinates","303888","2025-11-29","21:50:33",""
"7064005","21.9114","0.0011","10.235","0.0005","20.2779","0.001","90","","95.608","0.002","90","","4525.8","0.4","120","2","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H26 Ag2 Fe N7 O3 -","- C47 H26 Ag2 Fe N7 O3 -","- C188 H104 Ag8 Fe4 N28 O12 -","4","1","","Yan, Fei-Fei; Zhou, Ren-He; Li, Xin-Feng; Zhao, Liang; Meng, Yin-Shan","A three-dimensional Hofmann-type metal–organic framework with switchable spin crossover and fluorescence properties","New Journal of Chemistry","2025","49","40","17753","17759","10.1039/D5NJ02941D","","","0.71073","MoKα","","0.0886","0.057","","","0.1325","0.149","","","","","","1.022","","","","has coordinates","303887","2025-11-29","21:50:13",""
"7064006","22.267","0.001","10.5295","0.0004","20.8347","0.0009","90","","94.834","0.002","90","","4867.5","0.4","273","2","273.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H26 Ag2 Fe N7 O3 -","- C47 H26 Ag2 Fe N7 O3 -","- C188 H104 Ag8 Fe4 N28 O12 -","4","1","","Yan, Fei-Fei; Zhou, Ren-He; Li, Xin-Feng; Zhao, Liang; Meng, Yin-Shan","A three-dimensional Hofmann-type metal–organic framework with switchable spin crossover and fluorescence properties","New Journal of Chemistry","2025","49","40","17753","17759","10.1039/D5NJ02941D","","","0.71073","MoKα","","0.1042","0.0619","","","0.1763","0.2072","","","","","","1.024","","","","has coordinates","303887","2025-11-29","21:50:15",""
"7064007","9.6288","0.0008","10.9399","0.001","11.7383","0.0009","87.939","0.003","80.976","0.003","67.318","0.003","1126.33","0.17","150","2","150","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H24 N O2 P -","- C27 H24 N O2 P -","- C54 H48 N2 O4 P2 -","2","1","","Pandey, Ankit; Kaur, Bhupinder; Dwivedi, Khilesh C.; Balakrishna, Maravanji S.","Copper nanoparticle-catalyzed synthesis of N-arylated indoles, carbazoles, and N-alkylated indoles","New Journal of Chemistry","2025","49","41","17936","17950","10.1039/D5NJ02820E","","","0.71073","MoKα","","0.0388","0.0353","","","0.0875","0.09","","","","","","1.027","","","","has coordinates","303858","2025-11-29","21:39:27",""
"7064008","14.9961","0.0016","16.8436","0.0016","9.6647","0.0009","90","","105.001","0.004","90","","2358","0.4","150","2","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 N O2 P -","- C28 H26 N O2 P -","- C112 H104 N4 O8 P4 -","4","1","","Pandey, Ankit; Kaur, Bhupinder; Dwivedi, Khilesh C.; Balakrishna, Maravanji S.","Copper nanoparticle-catalyzed synthesis of N-arylated indoles, carbazoles, and N-alkylated indoles","New Journal of Chemistry","2025","49","41","17936","17950","10.1039/D5NJ02820E","","","0.71073","MoKα","","0.0453","0.0374","","","0.0851","0.0941","","","","","","1.104","","","","has coordinates","303858","2025-11-29","21:39:27",""
"7064009","9.3433","0.0004","11.4881","0.0005","14.2465","0.0006","73.938","0.002","74.522","0.001","78.104","0.002","1401.66","0.11","150","2","150","","","","","","","","","7","P -1","-P 1","2","","","","- C60 H58 Br2 Cu2 N4 O4 P2 -","- C60 H58 Br2 Cu2 N4 O4 P2 -","- C60 H58 Br2 Cu2 N4 O4 P2 -","1","0.5","","Pandey, Ankit; Kaur, Bhupinder; Dwivedi, Khilesh C.; Balakrishna, Maravanji S.","Copper nanoparticle-catalyzed synthesis of N-arylated indoles, carbazoles, and N-alkylated indoles","New Journal of Chemistry","2025","49","41","17936","17950","10.1039/D5NJ02820E","","","0.71073","MoKα","","0.0301","0.025","","","0.0625","0.065","","","","","","1.011","","","","has coordinates","303858","2025-11-29","21:39:27",""
"7064010","9.9358","0.0013","11.7812","0.0015","11.8217","0.0015","85.957","0.004","69.575","0.004","72.871","0.004","1238.5","0.3","150","2","150","","","","","","","","","7","P -1","-P 1","2","","","","- C27 H24 Cu I N O2 P -","- C27 H24 Cu I N O2 P -","- C54 H48 Cu2 I2 N2 O4 P2 -","2","1","","Pandey, Ankit; Kaur, Bhupinder; Dwivedi, Khilesh C.; Balakrishna, Maravanji S.","Copper nanoparticle-catalyzed synthesis of N-arylated indoles, carbazoles, and N-alkylated indoles","New Journal of Chemistry","2025","49","41","17936","17950","10.1039/D5NJ02820E","","","0.71073","MoKα","","0.0206","0.0201","","","0.0515","0.0519","","","","","","1.087","","","","has coordinates","303858","2025-11-29","21:39:27",""
"7064011","11.1119","0.0019","11.501","0.002","11.673","0.002","110.624","0.006","109.704","0.009","92.648","0.007","1291.2","0.4","150.15","","150.15","","","","","","","","","7","P -1","-P 1","2","","","","- C54 H48 Br2 Cu2 N2 O4 P2 -","- C54 H48 Br2 Cu2 N2 O4 P2 -","- C54 H48 Br2 Cu2 N2 O4 P2 -","1","0.5","","Pandey, Ankit; Kaur, Bhupinder; Dwivedi, Khilesh C.; Balakrishna, Maravanji S.","Copper nanoparticle-catalyzed synthesis of N-arylated indoles, carbazoles, and N-alkylated indoles","New Journal of Chemistry","2025","49","41","17936","17950","10.1039/D5NJ02820E","","","0.71073","MoKα","","0.0315","0.0285","","","0.073","0.0751","","","","","","1.02","","","","has coordinates,has disorder","303858","2025-11-29","21:39:27",""
"7064012","12.3061","0.0009","12.7758","0.0008","17.5598","0.0012","82.501","0.002","77.156","0.002","76.439","0.002","2607.7","0.3","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C56 H52 Cu2 I2 N2 O4 P2 -","- C56 H52 Cu2 I2 N2 O4 P2 -","- C112 H104 Cu4 I4 N4 O8 P4 -","2","1","","Pandey, Ankit; Kaur, Bhupinder; Dwivedi, Khilesh C.; Balakrishna, Maravanji S.","Copper nanoparticle-catalyzed synthesis of N-arylated indoles, carbazoles, and N-alkylated indoles","New Journal of Chemistry","2025","49","41","17936","17950","10.1039/D5NJ02820E","","","0.71073","MoKα","","0.0422","0.0324","","","0.0768","0.0814","","","","","","1.02","","","","has coordinates","303858","2025-11-29","21:39:27",""
"7064013","9.9058","0.0014","11.72","0.0018","11.8011","0.0018","84.061","0.006","73.695","0.005","68.389","0.005","1222.5","0.3","150","","150","","","","","","","","","7","P -1","-P 1","2","","","","- C52 H44 Cu2 I2 N2 O4 P2 -","- C52 H44 Cu2 I2 N2 O4 P2 -","- C52 H44 Cu2 I2 N2 O4 P2 -","1","0.5","","Pandey, Ankit; Kaur, Bhupinder; Dwivedi, Khilesh C.; Balakrishna, Maravanji S.","Copper nanoparticle-catalyzed synthesis of N-arylated indoles, carbazoles, and N-alkylated indoles","New Journal of Chemistry","2025","49","41","17936","17950","10.1039/D5NJ02820E","","","0.71073","MoKα","","0.0202","0.0188","","","0.0502","0.051","","","","","","1.0961","","","","has coordinates","303858","2025-11-29","21:39:27",""
"7064014","13.932","0.004","4.3987","0.0011","21.14","0.006","90","","90.211","0.011","90","","1295.5","0.6","299","","299","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 N4 O5 -","- C13 H10 N4 O5 -","- C52 H40 N16 O20 -","4","1","","Sahu, Devanand; Roy, Rajat Kumar; Pandey, Abhilash; Dutta, Srishti; Kumar, Dishen; Sharma, Vanshika; Mahata, Kamakshya Prasad; Patra, Goutam Kumar","Fluorescent-colorimetric selective and sensitive detection of sulfide anions by salicylaldehyde-2,4-dinitrophenylhydrazone: biological, environmental and logic gate application","New Journal of Chemistry","2025","49","41","18086","18096","10.1039/D5NJ02931G","","","0.71073","MoKα","","0.1485","0.0529","","","0.1124","0.1564","","","","","","0.992","","","","has coordinates","303855","2025-11-29","21:38:49",""
"7064015","7.9286","0.0001","13.8785","0.0002","29.4112","0.0004","90","","90","","90","","3236.32","0.08","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C29 H26 F6 I N8 O P Ru -","- C29 H26 F6 I N8 O P Ru -","- C116 H104 F24 I4 N32 O4 P4 Ru4 -","4","1","","Saha, Achena; Yadav, Ekta; Nath, Shambhu; Singh, Ashu; Singh, Amrendra K.","Ru(ii)–CNC pincer complexes with bis(protic-NHC): comparative analysis with bis(classical-NHC) and mixed protic- & classical-NHC analogues","New Journal of Chemistry","2025","49","41","18191","18201","10.1039/D5NJ03111G","","x-ray","0.71073","MoKα","","0.041","0.034","","","0.0846","0.0888","","","","","","1.027","","","","has coordinates","303862","2025-11-29","21:40:31",""
"7064016","11.4185","0.0012","13.3983","0.0014","14.4111","0.0015","91.529","0.004","108.508","0.004","113.373","0.004","1889.4","0.4","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 Cl3 N O2 -","- C21 H14 Cl3 N O2 -","- C84 H56 Cl12 N4 O8 -","4","2","","Efimov, Ilya V.; Sokolov, Vladislav A.; Vasilyev, Aleksander V.; Kumar, Yogesh; Khushal,; D’Alterio, Massimo Christian; Talarico, Giovanni; Voskressensky, Leonid G.","Regio- and stereoselective synthesis of 5-(trichloromethyl)-isoxazolines","New Journal of Chemistry","2025","49","41","17987","17996","10.1039/D5NJ03070F","","","0.71073","MoKα","","0.0851","0.0764","","","0.2348","0.2381","","","","","","1.069","","","","has coordinates","303860","2025-11-29","21:39:59",""
"7064017","13.9252","0.0004","12.9976","0.0004","19.9392","0.0006","90","","104.472","0.001","90","","3494.37","0.18","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H40 Co N10 O9 Tb -","- C26 H40 Co N10 O9 Tb -","- C104 H160 Co4 N40 O36 Tb4 -","4","1","","Petrosyants, Svetlana P.; Galkina, Alina S.; Babeshkin, Konstantin A.; Ilyukhin, Andrey B.; Efimov, Nikolay N.; Eremenko, Igor L.","Cyano-bridged LnIII/CoIII coordination polymers: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2025","49","41","18041","18047","10.1039/D5NJ02829A","","","0.71073","MoKα","","0.0623","0.045","","","0.0874","0.0921","","","","","","1.075","","","","has coordinates,has disorder","303863","2025-11-29","21:40:40",""
"7064018","11.2655","0.0011","13.4789","0.0013","18.0329","0.0018","90","","90.095","0.003","90","","2738.2","0.5","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 Co Er N10 O3 -","- C24 H24 Co Er N10 O3 -","- C96 H96 Co4 Er4 N40 O12 -","4","1","","Petrosyants, Svetlana P.; Galkina, Alina S.; Babeshkin, Konstantin A.; Ilyukhin, Andrey B.; Efimov, Nikolay N.; Eremenko, Igor L.","Cyano-bridged LnIII/CoIII coordination polymers: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2025","49","41","18041","18047","10.1039/D5NJ02829A","","","0.71073","MoKα","","0.1251","0.0748","","","0.1442","0.1642","","","","","","1.05","","","","has coordinates","303863","2025-11-29","21:40:41",""
"7064019","5.4286","0.0006","5.6217","0.0007","11.0326","0.0012","97.348","0.004","99.037","0.004","90.679","0.004","329.61","0.07","296","","296","","","","","","","","","4","P -1","-P 1","2","","2,2,2-trifluoroethylamium pentazolate","","- C2 H5 F3 N6 -","- C2 H5 F3 N6 -","- C4 H10 F6 N12 -","2","1","","Liu, Bangxiang; Wang, Pengfei; Gao, Chao; Hu, Bingcheng; Sun, Chengguo","Terminal fluorination of ethylamine cations modulates the packing pattern of high-density pentazolate salts","New Journal of Chemistry","2025","49","41","18121","18128","10.1039/D5NJ02770E","","","0.71073","MoKα","","0.0733","0.0518","","","0.1274","0.1387","","","","","","1.053","","","","has coordinates","303857","2025-11-29","21:39:10",""
"7064020","7.14","0.0015","9.2173","0.0018","9.5422","0.0019","90","","90","","90","","628","0.2","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C2 H7 F N6 -","- C2 H7 F N6 -","- C8 H28 F4 N24 -","4","1","","Liu, Bangxiang; Wang, Pengfei; Gao, Chao; Hu, Bingcheng; Sun, Chengguo","Terminal fluorination of ethylamine cations modulates the packing pattern of high-density pentazolate salts","New Journal of Chemistry","2025","49","41","18121","18128","10.1039/D5NJ02770E","","","0.71073","MoKα","","0.0837","0.0518","","","0.1239","0.1393","","","","","","1.024","","","","has coordinates","303857","2025-11-29","21:39:11",""
"7064021","9.783","0.0008","8.3824","0.0007","7.8384","0.0013","90","","90","","90","","642.79","0.13","273.15","","273.15","","","","","","","","","4","I m a 2","I 2 -2a","46","","","","- C2 H6 F2 N6 -","- C2 H6 F2 N6 -","- C8 H24 F8 N24 -","4","0.5","","Liu, Bangxiang; Wang, Pengfei; Gao, Chao; Hu, Bingcheng; Sun, Chengguo","Terminal fluorination of ethylamine cations modulates the packing pattern of high-density pentazolate salts","New Journal of Chemistry","2025","49","41","18121","18128","10.1039/D5NJ02770E","","","0.71073","MoKα","","0.0553","0.0521","","","0.1314","0.1344","","","","","","1.213","","","","has coordinates","303857","2025-11-29","21:39:11",""
"7064023","20.2485","0.0003","13.0365","0.0002","8.3746","0.0001","90","","90","","90","","2210.64","0.05","295.63","0.1","295.63","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","zhL","","- C23 H29 Cl N2 Pd -","- C23 H29 Cl N2 Pd -","- C92 H116 Cl4 N8 Pd4 -","4","1","","Zhang, Hongli; Dai, Shengyu","Controlling polar monomer incorporation ratio via steric attenuation: Pd-catalyzed synthesis of polar hyperbranched polyethylenes","New Journal of Chemistry","2025","49","42","18430","18435","10.1039/D5NJ03147H","","","1.54184","CuKα","","0.0396","0.0377","","","0.1035","0.1058","","","","","","1.137","","","","has coordinates,has disorder","303874","2025-11-29","21:44:13",""
"7064024","18.842","0.0012","6.2924","0.0003","16.2912","0.0011","90","","90","","90","","1931.5","0.2","297","","297","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C25 H18 N2 O -","- C25 H18 N2 O -","- C100 H72 N8 O4 -","4","1","","Zeng, Yu; Chen, Jian-Yuan; Li, Yun; Guo, Ji-Lin; Pang, Chu-Ming; Li, Sheng-Yu; Wang, Zhao-Yang","The concise synthesis of tetrasubstituted furan-based Schiff base compounds via a one-pot method","New Journal of Chemistry","2025","49","42","18502","18509","10.1039/D5NJ03763H","","x-ray","0.71073","MoKα","","0.0923","0.0596","","","0.1065","0.1199","","","","","","1.068","","","","has coordinates","303873","2025-11-29","21:44:05",""
"7064025","12.417","","13.903","","7.153","","90","","111.541","0.005","90","","1148.6","0.04","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Cu Na4 O12 W3 -","- Cu0.956 Na4.044 O12 W3 -","- Cu3.824 Na16.176 O48 W12 -","4","0.5","","Belkhettab, Ilyas; Mokhnache, Oualid; Chetoui, Abdelmounaim; Bencherifa, Ismail; Boughzala, Habib","Structural study and physico-chemical characterization of the novel triple tungstate Na4Cu(WO4)3 with alluaudite-like structure","New Journal of Chemistry","2025","49","41","17925","17935","10.1039/D5NJ03082J","","","0.71073","MoKα","","0.0478","0.0408","","","0.1027","0.106","","","","","","1.093","","","","has coordinates","303856","2025-11-29","21:38:59",""
"7064026","14.372","0.005","25.215","0.009","23.014","0.009","90","","92.748","0.007","90","","8330","5","100.02","","100.02","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C100 H102 Co2 O14 -","- C100 H102 Co2 O14 -","- C400 H408 Co8 O56 -","4","1","","Pankratz, Trey C.; Harris, Caleb F.; Hyland, Ethan E.; Sailer, Joshua K.; Wheaton, Amelia M.; Davies, Huw M. L.; Berry, John F.","Dicobalt tetracarboxylate complexes with labile axial ligands","New Journal of Chemistry","2025","49","42","18292","18302","10.1039/D5NJ02169C","","x-ray","1.54178","CuKα","K-L~3~","0.0639","0.0479","","","0.1137","0.1226","","","","","","1.03","","","","has coordinates,has disorder","303872","2025-11-29","21:43:53",""
"7064027","12.13","0.003","12.137","0.003","13.833","0.004","109.773","0.011","98.611","0.01","104.368","0.013","1794.5","0.8","100","2","100","","","","","","","","","4","P -1","-P 1","2","","","","- C86 H86 Co O14 -","- C86 H86 Co O14 -","- C86 H86 Co O14 -","1","0.5","","Pankratz, Trey C.; Harris, Caleb F.; Hyland, Ethan E.; Sailer, Joshua K.; Wheaton, Amelia M.; Davies, Huw M. L.; Berry, John F.","Dicobalt tetracarboxylate complexes with labile axial ligands","New Journal of Chemistry","2025","49","42","18292","18302","10.1039/D5NJ02169C","","x-ray","0.71073","MoKα","","0.0351","0.0323","","","0.0871","0.0889","","","","","","1.025","","","","has coordinates","303872","2025-11-29","21:43:54",""
"7064028","20.211","0.012","16.757","0.006","21.469","0.008","90","","90.78","0.03","90","","7270","6","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C88 H80 Co2 O10 -","- C88 H80 Co2 O10 -","- C352 H320 Co8 O40 -","4","0.5","","Pankratz, Trey C.; Harris, Caleb F.; Hyland, Ethan E.; Sailer, Joshua K.; Wheaton, Amelia M.; Davies, Huw M. L.; Berry, John F.","Dicobalt tetracarboxylate complexes with labile axial ligands","New Journal of Chemistry","2025","49","42","18292","18302","10.1039/D5NJ02169C","","","1.54178","CuKα","","0.0304","0.0281","","","0.0768","0.0782","","","","","","1.059","","","","has coordinates","303872","2025-11-29","21:43:54",""
"7064029","20.931","0.003","16.88","0.002","20.205","0.003","90","","90.332","0.006","90","","7138.6","1.7","100","2","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C88 H76 Co2 O10 -","- C88 H76 Co2 O10 -","- C352 H304 Co8 O40 -","4","0.5","","Pankratz, Trey C.; Harris, Caleb F.; Hyland, Ethan E.; Sailer, Joshua K.; Wheaton, Amelia M.; Davies, Huw M. L.; Berry, John F.","Dicobalt tetracarboxylate complexes with labile axial ligands","New Journal of Chemistry","2025","49","42","18292","18302","10.1039/D5NJ02169C","","","1.54184","CuKα","","0.0492","0.0418","","","0.1172","0.1231","","","","","","1.041","","","","has coordinates,has disorder","303872","2025-11-29","21:43:54",""
"7064030","14.008","0.003","12.09","0.002","14.575","0.003","90","","105.94","0.03","90","","2373.5","0.9","100","0.2","100","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H27 N5 O11 Zn2 -","- C17 H13 N3 O9 Zn2 -","- C68 H52 N12 O36 Zn8 -","4","1","","Bakhshandeh, Monireh; Akhbari, Kamran; Soltani, Sajjad; Tylianakis, Emmanuel; Froudakis, George E.; White, Jonathan M.","Computational investigation of the potential of a zinc-based metal–organic framework as a quercetin and 5-fluorouracil anticancer drug carrier","New Journal of Chemistry","2025","49","44","19445","19453","10.1039/D5NJ01619C","","","0.710918","Synchrotron","","0.0427","0.0408","","","0.1329","0.1353","","","","","","1.13","","","","has coordinates","303853","2025-11-29","21:38:16",""
"7064031","5.9147","0.0004","9.7728","0.0007","11.5476","0.0007","97.578","0.002","94.638","0.002","90.006","0.002","659.45","0.08","300","2","300","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H17 N3 O -","- C15 H17 N3 O -","- C30 H34 N6 O2 -","2","1","","Price, Lee; Li, Zonyuan; Zhang, Wei","Synthesis of a pyrroloquinoline-containing polycyclic scaffold via decarboxylative [3+2] cycloaddition and aza-Wittig reactions","New Journal of Chemistry","2025","49","43","18970","18973","10.1039/D5NJ03128A","","","0.71073","MoKα","","0.0462","0.0389","","","0.1014","0.1074","","","","","","1.053","","","","has coordinates","303867","2025-11-29","21:41:45",""
"7064032","13.4245","0.0009","10.2009","0.0009","13.9121","0.0011","90","","107.05","0.003","90","","1821.4","0.2","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 N5 O2 -","- C18 H23 N5 O2 -","- C72 H92 N20 O8 -","4","1","","Price, Lee; Li, Zonyuan; Zhang, Wei","Synthesis of a pyrroloquinoline-containing polycyclic scaffold via decarboxylative [3+2] cycloaddition and aza-Wittig reactions","New Journal of Chemistry","2025","49","43","18970","18973","10.1039/D5NJ03128A","","","0.71073","MoKα","","0.0531","0.0422","","","0.109","0.1207","","","","","","0.972","","","","has coordinates,has disorder","303867","2025-11-29","21:41:45",""
"7064033","24.7774","0.0012","24.7774","0.0012","14.0219","0.0011","90","","90","","120","","7455","0.8","300","2","300","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C16 H19 N3 O -","- C16 H19 N3 O -","- C288 H342 N54 O18 -","18","1","","Price, Lee; Li, Zonyuan; Zhang, Wei","Synthesis of a pyrroloquinoline-containing polycyclic scaffold via decarboxylative [3+2] cycloaddition and aza-Wittig reactions","New Journal of Chemistry","2025","49","43","18970","18973","10.1039/D5NJ03128A","","","0.71073","MoKα","","0.0804","0.0595","","","0.2002","0.2328","","","","","","1.047","","","","has coordinates,has disorder","303867","2025-11-29","21:41:45",""
"7064034","14.0582","0.0013","8.7981","0.0007","13.452","0.0012","90","","111.489","0.003","90","","1548.2","0.2","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 N5 O2 -","- C15 H17 N5 O2 -","- C60 H68 N20 O8 -","4","1","","Price, Lee; Li, Zonyuan; Zhang, Wei","Synthesis of a pyrroloquinoline-containing polycyclic scaffold via decarboxylative [3+2] cycloaddition and aza-Wittig reactions","New Journal of Chemistry","2025","49","43","18970","18973","10.1039/D5NJ03128A","","","0.71073","MoKα","","0.0536","0.0432","","","0.1103","0.1198","","","","","","1.002","","","","has coordinates,has disorder","303867","2025-11-29","21:41:45",""
"7064035","10.1162","0.0007","11.1065","0.0009","10.7813","0.0008","90","","100.768","0.003","90","","1190.01","0.15","300","2","300","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 N3 O -","- C14 H15 N3 O -","- C56 H60 N12 O4 -","4","1","","Price, Lee; Li, Zonyuan; Zhang, Wei","Synthesis of a pyrroloquinoline-containing polycyclic scaffold via decarboxylative [3+2] cycloaddition and aza-Wittig reactions","New Journal of Chemistry","2025","49","43","18970","18973","10.1039/D5NJ03128A","","","0.71073","MoKα","","0.0414","0.0358","","","0.0925","0.0984","","","","","","1.022","","","","has coordinates","303867","2025-11-29","21:41:45",""
"7064036","8.596","0.0014","11.0118","0.0014","9.5399","0.0015","90","","92.78","0.005","90","","902","0.2","294","2","294.15","","","","","","","","","5","P 1 21 1","P 2yb","4","","2,3a-dimethyl-1-(phenylsulfonyl)-6-(prop-1-en-2-yl)-3a,4,5,6,7,7a-hexahydro-1H-benzo[d]imidazole","","- C18 H24 N2 O2 S -","- C18 H24 N2 O2 S -","- C36 H48 N4 O4 S2 -","2","1","","Moskalik, Mikhail Yu.; Myasnikova, Valentina S.; Astakhova, Vera V.; Borodina, Tatyana N.; Zinchenko, Sergey V.; Shainyan, Bagrat A.","Chemo-, regio-, and stereoselective heterocyclization of sulfonamides and d-limonene with solvent interception","New Journal of Chemistry","2025","49","41","18097","18102","10.1039/D5NJ02510A","","","0.71073","MoKα","","0.0974","0.0507","","","0.1056","0.1211","","","","","","1.065","","","","has coordinates","303861","2025-11-29","21:40:18",""
"7064037","9.3342","0.0007","10.5853","0.0008","19.8933","0.0014","90","","90","","90","","1965.6","0.3","294","2","294","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","1-((4-bromophenyl)sulfonyl)-2,3a-dimethyl-6-(prop-1-en-2-yl)-3a,4,5,6,7,7a-hexahydro-1H-benzo[d]imidazole","","- C18 H23 Br N2 O2 S -","- C18 H23 Br N2 O2 S -","- C72 H92 Br4 N8 O8 S4 -","4","1","","Moskalik, Mikhail Yu.; Myasnikova, Valentina S.; Astakhova, Vera V.; Borodina, Tatyana N.; Zinchenko, Sergey V.; Shainyan, Bagrat A.","Chemo-, regio-, and stereoselective heterocyclization of sulfonamides and d-limonene with solvent interception","New Journal of Chemistry","2025","49","41","18097","18102","10.1039/D5NJ02510A","","","1.54178","CuKα","","0.0466","0.0448","","","0.119","0.1204","","","","","","1.071","","","","has coordinates","303861","2025-11-29","21:40:19",""
"7064038","10.8486","0.0008","10.8486","0.0008","12.6716","0.0012","90","","90","","120","","1291.54","0.18","293.15","","293.15","","","","","","","","","6","P 32","P 32","145","","N-((1S,2R,4R)-1-methyl-4-(prop-1-en-2-yl)-2-((trifluoromethyl)sulfonamido)cyclohexyl)acetamide","","- C13 H21 F3 N2 O3 S -","- C13 H21 F3 N2 O3 S -","- C39 H63 F9 N6 O9 S3 -","3","1","","Moskalik, Mikhail Yu.; Myasnikova, Valentina S.; Astakhova, Vera V.; Borodina, Tatyana N.; Zinchenko, Sergey V.; Shainyan, Bagrat A.","Chemo-, regio-, and stereoselective heterocyclization of sulfonamides and d-limonene with solvent interception","New Journal of Chemistry","2025","49","41","18097","18102","10.1039/D5NJ02510A","","","0.71073","MoKα","","0.0568","0.0433","","","0.1036","0.1113","","","","","","1.067","","","","has coordinates","303861","2025-11-29","21:40:19",""
"7064039","9.5856","0.0004","10.5654","0.0004","20.1903","0.0008","90","","90","","90","","2044.79","0.14","294","2","294","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","2,3a-dimethyl-6-(prop-1-en-2-yl)-1-((4-(trifluoromethyl)phenyl)sulfonyl)-3a,4,5,6,7,7a-hexahydro-1H-benzo[d]imidazole","","- C19 H23 F3 N2 O2 S -","- C19 H23 F3 N2 O2 S -","- C76 H92 F12 N8 O8 S4 -","4","1","","Moskalik, Mikhail Yu.; Myasnikova, Valentina S.; Astakhova, Vera V.; Borodina, Tatyana N.; Zinchenko, Sergey V.; Shainyan, Bagrat A.","Chemo-, regio-, and stereoselective heterocyclization of sulfonamides and d-limonene with solvent interception","New Journal of Chemistry","2025","49","41","18097","18102","10.1039/D5NJ02510A","","","1.54178","CuKα","","0.0493","0.0395","","","0.0903","0.0955","","","","","","1.053","","","","has coordinates,has disorder","303861","2025-11-29","21:40:19",""
"7064040","9.3126","0.0006","10.5891","0.0008","19.6462","0.0015","90","","90","","90","","1937.4","0.2","294","2","294","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","1-((4-chlorophenyl)sulfonyl)-2,3a-dimethyl-6-(prop-1-en-2-yl)-3a,4,5,6,7,7a-hexahydro-1H-benzo[d]imidazole","","- C18 H23 Cl N2 O2 S -","- C18 H23 Cl N2 O2 S -","- C72 H92 Cl4 N8 O8 S4 -","4","1","","Moskalik, Mikhail Yu.; Myasnikova, Valentina S.; Astakhova, Vera V.; Borodina, Tatyana N.; Zinchenko, Sergey V.; Shainyan, Bagrat A.","Chemo-, regio-, and stereoselective heterocyclization of sulfonamides and d-limonene with solvent interception","New Journal of Chemistry","2025","49","41","18097","18102","10.1039/D5NJ02510A","","","0.71073","MoKα","","0.1073","0.0553","","","0.1135","0.1323","","","","","","1.0268","","","","has coordinates","303861","2025-11-29","21:40:19",""
"7064041","14.066","0.003","13.295","0.003","16.107","0.004","90","","102.059","0.009","90","","2945.7","1.2","140","","140","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 Cu N8 O11 -","- C26 H15 Cu N7 O10 -","- C104 H60 Cu4 N28 O40 -","4","1","","Rajak, Richa; Sinha, Kushagra; Gupta, Sweety; Paul, Amit","Cu-based coordination polymer@GO for supercapacitor and solid-state proton conduction applications","New Journal of Chemistry","2025","49","42","18623","18634","10.1039/D5NJ03093E","","","0.71073","MoKα","","0.2122","0.0862","","","0.2089","0.2937","","","","","","0.9945","","","","has coordinates","303871","2025-11-29","21:43:31",""
"7064042","8.2372","0.0003","16.2835","0.0006","15.2267","0.0006","90","","103.815","0.001","90","","1983.28","0.13","273.15","","273.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","C26H24N2O","","- C26 H23 N2 O -","- C26 H23 N2 O -","- C104 H92 N8 O4 -","4","1","","Kumar, Parveen; Kumar, Gourav; Tomar, Vijesh; Nemiwal, Meena","Sustainable synthesis of bis(indolyl)methane scaffolds catalyzed by CuO nanoparticles immobilized with triethylammonium bistriflimide ionic liquid","New Journal of Chemistry","2025","49","43","18817","18829","10.1039/D5NJ03257A","","","0.71073","MoKα","","0.0597","0.0474","","","0.1194","0.1308","","","","","","1.0679","","","","has coordinates","303866","2025-11-29","21:41:29",""
"7064043","10.835","0.0006","33.789","0.0019","10.7694","0.0006","90","","90","","90","","3942.7","0.4","150","2","150","2","","","","","","","","4","F m m 2","F 2 -2","42","","","","- H18 N9 O9 Rh -","- N9 O9 Rh -","- N108 O108 Rh12 -","12","0.75","","Bautina, Sofia; Vorobyeva, Sofia; Rudzis, Zakhar; Rudneva, Yuliya; Nadolinny, Vladimir; Plusnin, Pavel; Sukhikh, Taisiya; Zhurenok, Angelina; Kozlova, Ekaterina; Korenev, Sergey","Double complex salts based on [Rh(NH3)6]3+ as precursors for Rh–Nb and Rh–V alloy systems: synthesis, structure, and thermal properties","New Journal of Chemistry","2025","49","43","18753","18766","10.1039/D5NJ03210E","","","1.54178","CuKα","","0.0445","0.0443","","","0.129","0.1294","","","","","","1.067","","","","has coordinates,has disorder","303870","2025-11-29","21:43:02",""
"7064044","9.215","0.0003","13.8259","0.0005","16.4926","0.0006","90","","101.161","0.001","90","","2061.51","0.13","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H26 N6 Nb O17 Rh -","- C6 H26 N6 Nb O17 Rh -","- C24 H104 N24 Nb4 O68 Rh4 -","4","1","","Bautina, Sofia; Vorobyeva, Sofia; Rudzis, Zakhar; Rudneva, Yuliya; Nadolinny, Vladimir; Plusnin, Pavel; Sukhikh, Taisiya; Zhurenok, Angelina; Kozlova, Ekaterina; Korenev, Sergey","Double complex salts based on [Rh(NH3)6]3+ as precursors for Rh–Nb and Rh–V alloy systems: synthesis, structure, and thermal properties","New Journal of Chemistry","2025","49","43","18753","18766","10.1039/D5NJ03210E","","","1.54178","CuKα","","0.025","0.0229","","","0.0644","0.066","","","","","","1.059","","","","has coordinates","303870","2025-11-29","21:43:04",""
"7064045","11.6686","0.0007","9.69","0.0006","15.6308","0.0009","90","","91.646","0.002","90","","1766.63","0.18","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H48 N12 O28 Rh2 V2 -","- C10 H48 N12 O28 Rh2 V2 -","- C20 H96 N24 O56 Rh4 V4 -","2","0.5","","Bautina, Sofia; Vorobyeva, Sofia; Rudzis, Zakhar; Rudneva, Yuliya; Nadolinny, Vladimir; Plusnin, Pavel; Sukhikh, Taisiya; Zhurenok, Angelina; Kozlova, Ekaterina; Korenev, Sergey","Double complex salts based on [Rh(NH3)6]3+ as precursors for Rh–Nb and Rh–V alloy systems: synthesis, structure, and thermal properties","New Journal of Chemistry","2025","49","43","18753","18766","10.1039/D5NJ03210E","","","1.54178","CuKα","","0.0377","0.0366","","","0.0941","0.0952","","","","","","1.065","","","","has coordinates","303870","2025-11-29","21:43:04",""
"7064046","17.385","0.004","9.632","0.0019","21.886","0.004","90","","90","","90","","3664.9","1.3","220","2","220","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H19 N O3 -","- C22 H19 N O3 -","- C176 H152 N8 O24 -","8","1","","Sivadas, Deepanjaly K.; Ravi, Sasikala; Padmanaban, Ramanathan; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi","Reversible fluorescence redox switching in activated carbonyl-functionalized fluorophores through the conversion of α-keto esters and α-hydroxy esters","New Journal of Chemistry","2025","49","37","16075","16085","10.1039/D5NJ01251A","","","0.63","synchrotron","","0.0498","0.0474","","","0.1382","0.1406","","","","","","1.076","","","","has coordinates","302385","2025-10-05","12:01:35",""
"7064047","13.865","0.003","11.371","0.002","11.072","0.002","90","","107","0.03","90","","1669.3","0.6","220","2","220","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 O3 -","- C24 H16 O3 -","- C96 H64 O12 -","4","1","","Sivadas, Deepanjaly K.; Ravi, Sasikala; Padmanaban, Ramanathan; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi","Reversible fluorescence redox switching in activated carbonyl-functionalized fluorophores through the conversion of α-keto esters and α-hydroxy esters","New Journal of Chemistry","2025","49","37","16075","16085","10.1039/D5NJ01251A","","","0.7","synchrotron","","0.0828","0.0588","","","0.1867","0.2024","","","","","","1.078","","","","has coordinates","302385","2025-10-05","12:01:38",""
"7064048","8.9055","0.0003","10.1484","0.0003","16.3042","0.0004","72.495","0.002","77.85","0.003","70.513","0.002","1314.81","0.07","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H23 Cl5 Fe N5 P3 -","- C21 H23 Cl5 Fe N5 P3 -","- C42 H46 Cl10 Fe2 N10 P6 -","2","1","","Cemaloğlu, Reşit; Uzunalioğlu, Neşe; Akbaş, Hüseyin; Asmafiliz, Nuran; Kılıç, Zeynel; Sabah, Büşra Nur; Açık, Leyla; Hökelek, Tuncer","Phosphorus–nitrogen compounds. Part 80. Design and synthesis of hybrid multiheterocyclic cyclotriphosphazene conjugates bearing unsymmetrical pendant arms: spectral and crystallographic characterization, bioactivity and structure–activity relationship (SAR) studies","New Journal of Chemistry","2025","49","36","15866","15884","10.1039/D5NJ02457A","","","0.71073","MoKα","","0.0238","0.022","","","0.0567","0.0577","","","","","","1.04","","","","has coordinates","302386","2025-10-05","12:04:09",""
"7064049","13.2055","0.0004","9.5292","0.0003","22.4175","0.0006","90","","96.788","0.003","90","","2801.2","0.14","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H25 Cl5 Fe N5 P3 -","- C22 H25 Cl5 Fe N5 P3 -","- C88 H100 Cl20 Fe4 N20 P12 -","4","1","","Cemaloğlu, Reşit; Uzunalioğlu, Neşe; Akbaş, Hüseyin; Asmafiliz, Nuran; Kılıç, Zeynel; Sabah, Büşra Nur; Açık, Leyla; Hökelek, Tuncer","Phosphorus–nitrogen compounds. Part 80. Design and synthesis of hybrid multiheterocyclic cyclotriphosphazene conjugates bearing unsymmetrical pendant arms: spectral and crystallographic characterization, bioactivity and structure–activity relationship (SAR) studies","New Journal of Chemistry","2025","49","36","15866","15884","10.1039/D5NJ02457A","","","0.71073","MoKα","","0.0705","0.0406","","","0.0899","0.1029","","","","","","1.021","","","","has coordinates","302386","2025-10-05","12:04:11",""
"7064050","10.5699","0.0003","13.1131","0.0005","15.5271","0.0006","85.093","0.002","89.8","0.003","66.747","0.002","1968.98","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H55 Cl Fe N9 P3 -","- C37 H55 Cl Fe N9 P3 -","- C74 H110 Cl2 Fe2 N18 P6 -","2","1","","Cemaloğlu, Reşit; Uzunalioğlu, Neşe; Akbaş, Hüseyin; Asmafiliz, Nuran; Kılıç, Zeynel; Sabah, Büşra Nur; Açık, Leyla; Hökelek, Tuncer","Phosphorus–nitrogen compounds. Part 80. Design and synthesis of hybrid multiheterocyclic cyclotriphosphazene conjugates bearing unsymmetrical pendant arms: spectral and crystallographic characterization, bioactivity and structure–activity relationship (SAR) studies","New Journal of Chemistry","2025","49","36","15866","15884","10.1039/D5NJ02457A","","","0.71073","MoKα","","0.0974","0.0565","","","0.1442","0.1625","","","","","","1.075","","","","has coordinates","302386","2025-10-05","12:04:12",""
"7064051","8.1193","0.0003","17.2395","0.0007","15.7214","0.0005","90","","102.828","0.003","90","","2145.64","0.14","173","0.1","173","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","OH-SOpAD","","- C27 H23 N O3 S -","- C27 H23 N O3 S -","- C108 H92 N4 O12 S4 -","4","1","","Han, Yuanping; Liu, Hanrong; Xia, Yan; Li, Jie; Jia, Junhui","Intermolecular H-bond promoting diphenylsulfone derivatives for aggregation-induced blue-shifted thermally activated delayed fluorescence","New Journal of Chemistry","2025","49","43","18848","18854","10.1039/D5NJ03447G","","","0.71073","MoKα","","0.0537","0.0431","","","0.1027","0.1129","","","","","","1.092","","","","has coordinates","303865","2025-11-29","21:41:10",""
"7064052","8.17384","0.00017","17.3356","0.0004","15.9288","0.0004","90","","103.372","0.002","90","","2195.89","0.09","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H22 F N O2 S -","- C27 H22 F N O2 S -","- C108 H88 F4 N4 O8 S4 -","4","1","","Han, Yuanping; Liu, Hanrong; Xia, Yan; Li, Jie; Jia, Junhui","Intermolecular H-bond promoting diphenylsulfone derivatives for aggregation-induced blue-shifted thermally activated delayed fluorescence","New Journal of Chemistry","2025","49","43","18848","18854","10.1039/D5NJ03447G","","","1.54184","CuKα","","0.0569","0.05","","","0.1426","0.1515","","","","","","1.036","","","","has coordinates,has disorder","303865","2025-11-29","21:41:10",""
"7064053","14.9766","0.0005","26.9872","0.0009","17.1339","0.0006","90","","91.745","0.001","90","","6921.9","0.4","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C88 H70 Au2 Cl2 O2 P2 -","- C88 H70 Au2 Cl2 O2 P2 -","- C352 H280 Au8 Cl8 O8 P8 -","4","1","","Atencio, Anyie P.; Sevillano, Alba; Lázaro, Ariadna; Freixa, Zoraida; Aguilà, David; Angurell, Inmaculada; Rodríguez, Laura","Structural and photophysical features of triphenylene–gold(i) phosphane complexes","New Journal of Chemistry","2025","49","43","18716","18724","10.1039/D5NJ03389F","","","0.72932","Synchrotron","","0.0639","0.0545","","","0.1619","0.1753","","","","","","1.025","","","","has coordinates","303864","2025-11-29","21:40:57",""
"7064054","9.6281","0.0007","17.4341","0.0016","18.5119","0.0019","106.545","0.003","96.139","0.002","91.231","0.002","2957.2","0.5","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C38.5 H27 Au Cl P -","- C38.5 H27 Au Cl P -","- C154 H108 Au4 Cl4 P4 -","4","2","","Atencio, Anyie P.; Sevillano, Alba; Lázaro, Ariadna; Freixa, Zoraida; Aguilà, David; Angurell, Inmaculada; Rodríguez, Laura","Structural and photophysical features of triphenylene–gold(i) phosphane complexes","New Journal of Chemistry","2025","49","43","18716","18724","10.1039/D5NJ03389F","","","0.72932","Synchrotron","","0.0626","0.0439","","","0.102","0.1076","","","","","","1.056","","","","has coordinates","303864","2025-11-29","21:40:58",""
"7064055","10.007","0.0005","10.6634","0.0005","18.3089","0.0008","82.359","0.004","84.624","0.004","72.703","0.004","1845.77","0.16","100.15","","100.15","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H34 F12 Mg N4 O2 -","- C38 H34 F12 Mg N4 O2 -","- C76 H68 F24 Mg2 N8 O4 -","2","1","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.71073","MoKα","","0.0675","0.0469","","","0.1094","0.1233","","","","","","1.028","","","","has coordinates,has disorder","303869","2025-11-29","21:42:43",""
"7064056","17.054","0.003","30.209","0.006","18.21","0.004","90","","92.92","0.03","90","","9369","3","100.15","","100.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C332 H307 F96 N32 O29 Sr8 -","- C332 H307 F96 N32 O29 Sr8 -","- C332 H307 F96 N32 O29 Sr8 -","1","0.25","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.71073","Synchrotron","","0.0746","0.0631","","","0.174","0.1824","","","","","","1.086","","","","has coordinates,has disorder","303869","2025-11-29","21:42:44",""
"7064057","12.7354","0.0011","10.448","0.001","6.356","0.0006","90","","98.099","0.009","90","","837.29","0.14","123","","123","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(N-(2,6-difluorophenyl)N-(acteyl)analide)potassium","","- C8 H6 F2 K N O -","- C8 H6 F2 K N O -","- C32 H24 F8 K4 N4 O4 -","4","1","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.71073","MoKα","","0.0539","0.0347","","","0.0732","0.081","","","","","","1.03","","","","has coordinates","303869","2025-11-29","21:42:44",""
"7064058","15.5521","0.0007","14.9796","0.0007","15.7547","0.0008","90","","96.394","0.001","90","","3647.5","0.3","100.15","","100.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H28 F12 K2 N4 O2 -","- C34 H28 F12 K2 N4 O2 -","- C136 H112 F48 K8 N16 O8 -","4","1","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.71073","MoKα","","0.054","0.0351","","","0.0821","0.0903","","","","","","1.017","","","","has coordinates,has disorder","303869","2025-11-29","21:42:44",""
"7064059","9.956","0.002","15.433","0.003","20.121","0.004","68.56","0.03","82.93","0.03","89.89","0.03","2852.7","1.2","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H18 F12 N4 Sr -","- C30 H18 F12 N4 Sr -","- C120 H72 F48 N16 Sr4 -","4","2","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.71073","Synchrotron","","0.1436","0.0871","","","0.2246","0.2568","","","","","","1.03","","","","has coordinates","303869","2025-11-29","21:42:44",""
"7064060","11.9642","0.0009","19.7079","0.0014","16.3585","0.0012","90","","93.949","0.007","90","","3848","0.5","123","0.16","123","0.16","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis(N,N'-bis(2-trifluoromethylphenyl)formamidinato)bis(tetrahydrofuran)calcium(II)","","- C38 H34 Ca F12 N4 O2 -","- C38 H34 Ca F12 N4 O2 -","- C152 H136 Ca4 F48 N16 O8 -","4","1","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.7107","MoKα","","0.0941","0.05","","","0.0931","0.1158","","","","","","1.024","","","","has coordinates","303869","2025-11-29","21:42:44",""
"7064061","11.451","0.002","13.177","0.003","16.255","0.003","95.34","0.03","109.99","0.03","92.97","0.03","2285.8","0.9","100.15","","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C45 H27 F18 K3 N6 -","- C45 H27 F18 K3 N6 -","- C90 H54 F36 K6 N12 -","2","1","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.7107","MoKα","","0.1327","0.0933","","","0.259","0.2949","","","","","","1.057","","","","has coordinates","303869","2025-11-29","21:42:44",""
"7064062","35.146","0.005","35.146","0.005","21.634","0.004","90","","90","","120","","23143","6","100.15","","100.15","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C174 H168 Ba19 F80 N18 O24 -","- C174 H168 Ba19 F80 N18 O24 -","- C522 H504 Ba57 F240 N54 O72 -","3","0.166667","","Werner, Daniel; Guo, Zhifang; Blair, Victoria L.; Deacon, Glen B.; Junk, Peter C.","New examples of –C–F–Ae (Ae = alkaline earth) and –C–F–K bonding","New Journal of Chemistry","2025","49","43","18725","18734","10.1039/D5NJ03383G","","","0.71073","Synchrotron","","0.0722","0.046","","","0.1254","0.137","","","","","","1.048","","","","has coordinates","303869","2025-11-29","21:42:44",""
"7064063","10.2195","0.0007","13.0429","0.0009","13.6207","0.0009","90","","90","","90","","1815.5","0.2","150","2","150.15","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H29 Al N2 O -","- C19 H29 Al N2 O -","- C76 H116 Al4 N8 O4 -","4","1","","Chao, Yu-Chieh; Hung, Yu-Hsuan; Su, Yu-Chia; Ko, Bao-Tsan; Cheng, Ban-Jing; Hu, Ching-Han; Ting, Chien-Ling; Liu, Guan-Lin; Dehury, Budheswar; Huang, Jui-Hsien; Datta, Amitabha","Synthesis, structure and DFT calculation of bi- and tridentate ketiminate ligand-assisted aluminum complexes: potential catalyst for styrene oxide–CO2 cycloaddition reaction","New Journal of Chemistry","2025","49","44","19269","19280","10.1039/D5NJ03282B","","","0.71073","MoKα","","0.0365","0.0309","","","0.0744","0.0779","","","","","","1.052","","","","has coordinates","303854","2025-11-29","21:38:33",""
"7064064","13.078","0.0011","8.5882","0.0006","17.1374","0.0015","90","","107.316","0.003","90","","1837.6","0.3","150","2","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 Al N O2 -","- C20 H24 Al N O2 -","- C80 H96 Al4 N4 O8 -","4","1","","Chao, Yu-Chieh; Hung, Yu-Hsuan; Su, Yu-Chia; Ko, Bao-Tsan; Cheng, Ban-Jing; Hu, Ching-Han; Ting, Chien-Ling; Liu, Guan-Lin; Dehury, Budheswar; Huang, Jui-Hsien; Datta, Amitabha","Synthesis, structure and DFT calculation of bi- and tridentate ketiminate ligand-assisted aluminum complexes: potential catalyst for styrene oxide–CO2 cycloaddition reaction","New Journal of Chemistry","2025","49","44","19269","19280","10.1039/D5NJ03282B","","","0.71073","MoKα","","0.0578","0.0471","","","0.1342","0.1516","","","","","","1.01","","","","has coordinates","303854","2025-11-29","21:38:34",""
"7064065","11.4459","0.0006","12.9358","0.0007","13.0353","0.0007","118.024","0.002","92.605","0.002","108.159","0.002","1575.96","0.15","150","2","150.15","","","","","","","","","5","P -1","-P 1","2","","","","- C60 H72 Al2 N2 O8 -","- C60 H72 Al2 N2 O8 -","- C60 H72 Al2 N2 O8 -","1","0.5","","Chao, Yu-Chieh; Hung, Yu-Hsuan; Su, Yu-Chia; Ko, Bao-Tsan; Cheng, Ban-Jing; Hu, Ching-Han; Ting, Chien-Ling; Liu, Guan-Lin; Dehury, Budheswar; Huang, Jui-Hsien; Datta, Amitabha","Synthesis, structure and DFT calculation of bi- and tridentate ketiminate ligand-assisted aluminum complexes: potential catalyst for styrene oxide–CO2 cycloaddition reaction","New Journal of Chemistry","2025","49","44","19269","19280","10.1039/D5NJ03282B","","","0.71073","MoKα","","0.0801","0.0692","","","0.2036","0.2166","","","","","","1.105","","","","has coordinates","303854","2025-11-29","21:38:34",""
"7064066","10.0565","0.0003","17.3648","0.0005","16.3601","0.0006","90","","103.934","0.001","90","","2772.88","0.15","150","2","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H38 Al N O3 -","- C31 H38 Al N O3 -","- C124 H152 Al4 N4 O12 -","4","1","","Chao, Yu-Chieh; Hung, Yu-Hsuan; Su, Yu-Chia; Ko, Bao-Tsan; Cheng, Ban-Jing; Hu, Ching-Han; Ting, Chien-Ling; Liu, Guan-Lin; Dehury, Budheswar; Huang, Jui-Hsien; Datta, Amitabha","Synthesis, structure and DFT calculation of bi- and tridentate ketiminate ligand-assisted aluminum complexes: potential catalyst for styrene oxide–CO2 cycloaddition reaction","New Journal of Chemistry","2025","49","44","19269","19280","10.1039/D5NJ03282B","","","0.71073","MoKα","","0.0394","0.0346","","","0.0913","0.0951","","","","","","1.047","","","","has coordinates","303854","2025-11-29","21:38:34",""
"7064067","18.434","0.003","18.434","0.003","9.03","0.0013","90","","90","","90","","3068.5","0.8","150","2","150.15","","","","","","","","","4","P 42/n :2","-P 4bc","86","","","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C144 H152 N8 O16 -","8","1","","Chao, Yu-Chieh; Hung, Yu-Hsuan; Su, Yu-Chia; Ko, Bao-Tsan; Cheng, Ban-Jing; Hu, Ching-Han; Ting, Chien-Ling; Liu, Guan-Lin; Dehury, Budheswar; Huang, Jui-Hsien; Datta, Amitabha","Synthesis, structure and DFT calculation of bi- and tridentate ketiminate ligand-assisted aluminum complexes: potential catalyst for styrene oxide–CO2 cycloaddition reaction","New Journal of Chemistry","2025","49","44","19269","19280","10.1039/D5NJ03282B","","","0.71073","MoKα","","0.1711","0.1236","","","0.2932","0.3372","","","","","","1.092","","","","has coordinates,has disorder","303854","2025-11-29","21:38:34",""
"7064068","7.6637","0.0003","12.4519","0.0004","32.1835","0.0011","90","","90","","90","","3071.2","0.19","296","2","296.15","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H24 N2 O -","- C17 H24 N2 O -","- C136 H192 N16 O8 -","8","1","","Chao, Yu-Chieh; Hung, Yu-Hsuan; Su, Yu-Chia; Ko, Bao-Tsan; Cheng, Ban-Jing; Hu, Ching-Han; Ting, Chien-Ling; Liu, Guan-Lin; Dehury, Budheswar; Huang, Jui-Hsien; Datta, Amitabha","Synthesis, structure and DFT calculation of bi- and tridentate ketiminate ligand-assisted aluminum complexes: potential catalyst for styrene oxide–CO2 cycloaddition reaction","New Journal of Chemistry","2025","49","44","19269","19280","10.1039/D5NJ03282B","","","0.71073","MoKα","","0.0842","0.0465","","","0.1139","0.1362","","","","","","1.02","","","","has coordinates","303854","2025-11-29","21:38:34",""
"7064069","11.5405","0.0007","9.9104","0.0006","25.9429","0.0016","90","","90","","90","","2967.1","0.3","100","","100","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18.67 H18.67 B2.67 F5.33 N5.33 O1.33 -","- C18.6667 H18.6667 B2.66667 F5.33333 N5.33333 O1.33333 -","- C112 H112 B16 F32 N32 O8 -","6","0.75","","Prasannan, Dijo; Nemykin, Victor N.","Unexpected formation of α-formylated BOPHY in the reaction with copper salts","New Journal of Chemistry","2025","49","45","19649","19655","10.1039/D5NJ02748A","","","0.71073","MoKα","","0.0658","0.0559","","","0.1418","0.1477","","","","","","1.128","","","","has coordinates","303894","2025-11-29","21:52:16",""
"7064070","7.5311","0.0004","20.679","0.0012","9.2357","0.0004","90","","99.939","0.002","90","","1416.74","0.13","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 B F2 N4 O -","- C14 H15 B F2 N4 O -","- C56 H60 B4 F8 N16 O4 -","4","1","","Prasannan, Dijo; Nemykin, Victor N.","Unexpected formation of α-formylated BOPHY in the reaction with copper salts","New Journal of Chemistry","2025","49","45","19649","19655","10.1039/D5NJ02748A","","","0.71073","MoKα","","0.0676","0.0453","","","0.105","0.1171","","","","","","1.042","","","","has coordinates","303894","2025-11-29","21:52:17",""
"7064071","9.2694","0.0007","32.322","0.002","7.3866","0.0004","90","","112.807","0.002","90","","2040","0.2","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 B2 F4 N5 O -","- C21 H21 B2 F4 N5 O -","- C84 H84 B8 F16 N20 O4 -","4","1","","Prasannan, Dijo; Nemykin, Victor N.","Unexpected formation of α-formylated BOPHY in the reaction with copper salts","New Journal of Chemistry","2025","49","45","19649","19655","10.1039/D5NJ02748A","","","0.71073","MoKα","","0.1457","0.1121","","","0.1849","0.197","","","","","","1.226","","","","has coordinates","303894","2025-11-29","21:52:17",""
"7064072","13.1933","0.0014","13.386","0.0013","13.764","0.0014","98.094","0.006","93.49","0.006","118.563","0.005","2090.6","0.4","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H38 B2 Br2 F4 N10 -","- C42 H38 B2 Br2 F4 N10 -","- C84 H76 B4 Br4 F8 N20 -","2","1","","Prasannan, Dijo; Nemykin, Victor N.","Unexpected formation of α-formylated BOPHY in the reaction with copper salts","New Journal of Chemistry","2025","49","45","19649","19655","10.1039/D5NJ02748A","","x-ray","1.54178","CuKα","","0.133","0.0957","","","0.2081","0.2286","","","","","","1.092","","","","has coordinates,has disorder","303894","2025-11-29","21:52:17",""
"7064073","16.4025","0.0019","6.7909","0.0008","12.6068","0.0015","90","","90","","90","","1404.2","0.3","100","","100","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C14 H15 B F2 N4 O -","- C14 H15 B F2 N4 O -","- C56 H60 B4 F8 N16 O4 -","4","0.5","","Prasannan, Dijo; Nemykin, Victor N.","Unexpected formation of α-formylated BOPHY in the reaction with copper salts","New Journal of Chemistry","2025","49","45","19649","19655","10.1039/D5NJ02748A","","","0.71073","MoKα","","0.0936","0.0676","","","0.1291","0.1383","","","","","","1.13","","","","has coordinates,has disorder","303894","2025-11-29","21:52:17",""
"7064074","5.6125","0.0002","8.593","0.0003","12.7335","0.0004","90","","94.852","0.004","90","","611.91","0.04","293","2","293","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C14 H11 I -","- C14 H11 I -","- C28 H22 I2 -","2","0.5","","Behera, Papita; Dora, A. Smitarani; Rout, Laxmidhar","CuMoO4: a heterogeneous bimetallic nanocatalyst for the C–H activation of alkenes with iodoarenes","New Journal of Chemistry","2025","49","43","18692","18697","10.1039/D5NJ03598H","","x-ray","0.71073","MoKα","","0.0986","0.0845","","","0.1504","0.1653","","","","","","1.164","","","","has coordinates,has disorder","303868","2025-11-29","21:42:09",""
"7064075","7.6825","0.0003","17.1255","0.0004","12.8014","0.0004","90","","107.101","0.004","90","","1609.77","0.1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 F3 -","- C21 H15 F3 -","- C84 H60 F12 -","4","1","","Behera, Papita; Dora, A. Smitarani; Rout, Laxmidhar","CuMoO4: a heterogeneous bimetallic nanocatalyst for the C–H activation of alkenes with iodoarenes","New Journal of Chemistry","2025","49","43","18692","18697","10.1039/D5NJ03598H","","x-ray","0.71073","MoKα","","0.0505","0.0387","","","0.1001","0.1069","","","","","","1.042","","","","has coordinates","303868","2025-11-29","21:42:13",""
"7064076","8.889","0.0004","16.3118","0.0006","30.9535","0.0011","90","","90.224","0.002","90","","4488.1","0.3","120","","120","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21.5 H27 Au Cl2 N2 O -","- C21.5 H27 Au Cl2 N2 O -","- C172 H216 Au8 Cl16 N16 O8 -","8","2","","Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.","Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis","New Journal of Chemistry","2025","49","46","20073","20080","10.1039/D5NJ03879K","","","0.71073","MoKα","","0.0311","0.0225","","","0.0452","0.0463","","","","","","1.041","","","","has coordinates","303881","2025-11-29","21:46:08",""
"7064077","9.1103","0.0011","13.9656","0.0017","15.3213","0.0018","90","","100.211","0.005","90","","1918.5","0.4","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H27 Cl N2 O -","- C21 H27 Cl N2 O -","- C84 H108 Cl4 N8 O4 -","4","1","","Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.","Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis","New Journal of Chemistry","2025","49","46","20073","20080","10.1039/D5NJ03879K","","","0.71073","MoKα","","0.0629","0.0421","","","0.102","0.1107","","","","","","1.021","","","","has coordinates","303881","2025-11-29","21:46:09",""
"7064078","8.2856","0.0003","15.7171","0.0005","23.3139","0.0009","90","","90","","90","","3036.07","0.19","296.15","","296.15","","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C28 H40 Au Cl3 N2 O -","- C28 H40 Au Cl3 N2 O -","- C112 H160 Au4 Cl12 N8 O4 -","4","0.5","","Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.","Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis","New Journal of Chemistry","2025","49","46","20073","20080","10.1039/D5NJ03879K","","","0.71073","MoKα","","0.0258","0.0219","","","0.047","0.048","","","","","","1.15","","","","has coordinates,has disorder","303881","2025-11-29","21:46:09",""
"7064079","8.2386","0.0005","15.6144","0.0009","22.9959","0.0014","90","","90","","90","","2958.2","0.3","120","","120","","","","","","","","","6","P b c m","-P 2c 2b","57","","","","- C28 H40 Ag Cl3 N2 O -","- C28 H40 Ag Cl3 N2 O -","- C112 H160 Ag4 Cl12 N8 O4 -","4","0.5","","Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.","Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis","New Journal of Chemistry","2025","49","46","20073","20080","10.1039/D5NJ03879K","","","0.71073","MoKα","","0.032","0.0221","","","0.0528","0.0539","","","","","","1.055","","","","has coordinates,has disorder","303881","2025-11-29","21:46:09",""
"7064080","20.1968","0.0019","11.8241","0.0009","12.3109","0.0009","90","","90","","90","","2940","0.4","120","","120","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C30 H43 Cl N2 O Pd -","- C30 H43 Cl N2 O Pd -","- C120 H172 Cl4 N8 O4 Pd4 -","4","1","","Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.","Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis","New Journal of Chemistry","2025","49","46","20073","20080","10.1039/D5NJ03879K","","","0.71073","MoKα","","0.091","0.0739","","","0.1865","0.1984","","","","","","1.043","","","","has coordinates","303881","2025-11-29","21:46:09",""
"7064081","10.818","0.005","17.701","0.008","15.614","0.008","90","","105.149","0.015","90","","2886","2","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H41 Cl3 N2 O -","- C28 H41 Cl3 N2 O -","- C112 H164 Cl12 N8 O4 -","4","1","","Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.","Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis","New Journal of Chemistry","2025","49","46","20073","20080","10.1039/D5NJ03879K","","","0.71073","MoKα","","0.214","0.0846","","","0.1783","0.2241","","","","","","0.894","","","","has coordinates","303881","2025-11-29","21:46:09",""
"7064082","15.1124","0.001","14.6094","0.001","17.3407","0.0012","90","","95.704","0.002","90","","3809.6","0.4","120","","120","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H57 Cl N2 O2 Pd -","- C40 H57 Cl N2 O2 Pd -","- C160 H228 Cl4 N8 O8 Pd4 -","4","1","","Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.","Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis","New Journal of Chemistry","2025","49","46","20073","20080","10.1039/D5NJ03879K","","","0.71073","MoKα","","0.0285","0.0247","","","0.0643","0.0658","","","","","","1.042","","","","has coordinates,has disorder","303881","2025-11-29","21:46:09",""
"7064083","4.5417","0.0018","15.119","0.003","24.849","0.004","90","","90","","90","","1706.3","0.8","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H12 Cl N3 O -","- C20 H12 Cl N3 O -","- C80 H48 Cl4 N12 O4 -","4","1","","Salamanca-Perdigón, Kevin; Lozano, Johan D.; Hurtado-Rodríguez, Diana; Becerra, Diana; Rojas, Hugo; Macías, Mario A.; Castillo, Juan-Carlos","Cs2CO3-mediated synthesis of 2-alkoxy-3-cyanopyridines: integrated crystallographic, photophysical, and DFT analyses","New Journal of Chemistry","2025","49","42","18369","18383","10.1039/D5NJ03110A","","","1.54184","CuKα","","0.1026","0.0842","","","0.2085","0.2457","","","","","","1.016","","","","has coordinates","303050","2025-10-28","12:40:28",""
"7064084","8.7831","0.0007","17.0587","0.0012","25.4352","0.0019","90","","90","","90","","3810.9","0.5","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H17 Cl N2 O3 -","- C22 H17 Cl N2 O3 -","- C176 H136 Cl8 N16 O24 -","8","1","","Salamanca-Perdigón, Kevin; Lozano, Johan D.; Hurtado-Rodríguez, Diana; Becerra, Diana; Rojas, Hugo; Macías, Mario A.; Castillo, Juan-Carlos","Cs2CO3-mediated synthesis of 2-alkoxy-3-cyanopyridines: integrated crystallographic, photophysical, and DFT analyses","New Journal of Chemistry","2025","49","42","18369","18383","10.1039/D5NJ03110A","","","1.54184","CuKα","","0.0454","0.041","","","0.1116","0.1186","","","","","","1.084","","","","has coordinates","303050","2025-10-28","12:40:41",""
"7064085","14.3224","0.0012","7.5836","0.0007","18.3159","0.0015","90","","99.351","0.008","90","","1963","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H17 Cl N2 O -","- C25 H17 Cl N2 O -","- C100 H68 Cl4 N8 O4 -","4","1","","Salamanca-Perdigón, Kevin; Lozano, Johan D.; Hurtado-Rodríguez, Diana; Becerra, Diana; Rojas, Hugo; Macías, Mario A.; Castillo, Juan-Carlos","Cs2CO3-mediated synthesis of 2-alkoxy-3-cyanopyridines: integrated crystallographic, photophysical, and DFT analyses","New Journal of Chemistry","2025","49","42","18369","18383","10.1039/D5NJ03110A","","","1.54184","CuKα","","0.0456","0.042","","","0.1188","0.1247","","","","","","1.052","","","","has coordinates","303050","2025-10-28","12:40:42",""
"7064086","6.5726","0.0003","16.3198","0.0009","24.6147","0.0013","90","","90","","90","","2640.3","0.2","100","0.1","100.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H14 Cl N O2 -","- C15 H14 Cl N O2 -","- C120 H112 Cl8 N8 O16 -","8","1","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Brandão, Paula; Aravena, Daniel","Exploring magnetic anisotropy and exchange coupling in FeIII2DyIII heterotrimetallic assemblies displaying slow relaxation of magnetization","New Journal of Chemistry","2025","49","45","19605","19615","10.1039/D5NJ03857J","","","0.71073","MoKα","","0.049","0.0354","","","0.0837","0.0899","","","","","","1.04","","","","has coordinates","303893","2025-11-29","21:52:00",""
"7064087","16.6187","0.0005","27.2829","0.0008","18.613","0.0005","90","","105.229","0.003","90","","8142.9","0.4","149.98","0.1","150.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C76 H104 Dy Fe2 N5 O25 -","- C76 H86 Dy Fe2 N5 O16 -","- C304 H344 Dy4 Fe8 N20 O64 -","4","1","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Brandão, Paula; Aravena, Daniel","Exploring magnetic anisotropy and exchange coupling in FeIII2DyIII heterotrimetallic assemblies displaying slow relaxation of magnetization","New Journal of Chemistry","2025","49","45","19605","19615","10.1039/D5NJ03857J","","","0.71073","MoKα","","0.066","0.0431","","","0.0987","0.1096","","","","","","1.033","","","","has coordinates,has disorder","303893","2025-11-29","21:52:01",""
"7064088","17.9305","0.0006","12.5854","0.0003","25.864","0.0007","90","","104.547","0.003","90","","5649.4","0.3","149.99","0.1","150.15","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C60 H60 Dy Fe2 N5 O19 -","- C60 H60 Dy Fe2 N5 O19 -","- C240 H240 Dy4 Fe8 N20 O76 -","4","0.5","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Brandão, Paula; Aravena, Daniel","Exploring magnetic anisotropy and exchange coupling in FeIII2DyIII heterotrimetallic assemblies displaying slow relaxation of magnetization","New Journal of Chemistry","2025","49","45","19605","19615","10.1039/D5NJ03857J","","","1.54184","CuKα","","0.041","0.0338","","","0.0784","0.0821","","","","","","1.012","","","","has coordinates,has disorder","303893","2025-11-29","21:52:01",""
"7064089","15.5272","0.0016","18.8507","0.0019","25.889","0.003","99.325","0.004","91.237","0.004","106.046","0.004","7168.6","1.3","150","2","150","","","","","","","","","7","P -1","-P 1","2","","","","- C66 H65 Cl5 Dy Fe2 N4 O18.5 -","- C66 H65 Cl5 Dy Fe2 N4 O18.5 -","- C264 H260 Cl20 Dy4 Fe8 N16 O74 -","4","2","","Panja, Anangamohan; Jagličić, Zvonko; Jana, Narayan Ch.; Contesso, Scarlette; Brandão, Paula; Aravena, Daniel","Exploring magnetic anisotropy and exchange coupling in FeIII2DyIII heterotrimetallic assemblies displaying slow relaxation of magnetization","New Journal of Chemistry","2025","49","45","19605","19615","10.1039/D5NJ03857J","","","0.71073","MoKα","","0.0617","0.0434","","","0.1002","0.115","","","","","","1.101","","","","has coordinates,has disorder","303893","2025-11-29","21:52:01",""
"7064090","15.7938","0.0006","9.9184","0.0004","27.8711","0.0009","90","","91.812","0.003","90","","4363.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H50 Cl2 N6 Pd2 -","- C45 H50 Cl2 N6 Pd2 -","- C180 H200 Cl8 N24 Pd8 -","4","1","","Campos-Dominguez, Emmanuel; Ruiz-Mendoza, Francisco J.; Rendón-Nava, David; Flores-Jarillo, Mariana; Álvarez-Hernández, Alejandro; Mendoza-Espinosa, Daniel","Preparation and applications of metal complexes supported by fluorene- and anthrone-functionalized (bis)mesoionic 1,2,3-triazol-5-ylidenes","New Journal of Chemistry","2025","49","46","19963","19972","10.1039/D5NJ03832D","","","0.71073","MoKα","","0.0672","0.0395","","","0.0868","0.0993","","","","","","1.068","","","","has coordinates,has disorder","303883","2025-11-29","21:49:25",""
"7064091","11.994","0.0007","12.5245","0.001","17.384","0.0011","110.939","0.007","105.077","0.005","96.116","0.005","2296.6","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H49.5 I2 N8.5 -","- C39 H42 I2 N6 -","- C78 H84 I4 N12 -","2","1","","Campos-Dominguez, Emmanuel; Ruiz-Mendoza, Francisco J.; Rendón-Nava, David; Flores-Jarillo, Mariana; Álvarez-Hernández, Alejandro; Mendoza-Espinosa, Daniel","Preparation and applications of metal complexes supported by fluorene- and anthrone-functionalized (bis)mesoionic 1,2,3-triazol-5-ylidenes","New Journal of Chemistry","2025","49","46","19963","19972","10.1039/D5NJ03832D","","x-ray","0.71073","MoKα","","0.1062","0.0615","","","0.1415","0.1757","","","","","","1.063","","","","has coordinates","303883","2025-11-29","21:49:26",""
"7064092","8.053","0.0003","12.4053","0.0005","15.743","0.0006","85.589","0.003","89.725","0.003","88.001","0.003","1567.11","0.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H36 N6 O -","- C38 H36 N6 O -","- C76 H72 N12 O2 -","2","1","","Campos-Dominguez, Emmanuel; Ruiz-Mendoza, Francisco J.; Rendón-Nava, David; Flores-Jarillo, Mariana; Álvarez-Hernández, Alejandro; Mendoza-Espinosa, Daniel","Preparation and applications of metal complexes supported by fluorene- and anthrone-functionalized (bis)mesoionic 1,2,3-triazol-5-ylidenes","New Journal of Chemistry","2025","49","46","19963","19972","10.1039/D5NJ03832D","","x-ray","0.71073","MoKα","","0.0977","0.0573","","","0.1374","0.1571","","","","","","1.028","","","","has coordinates","303883","2025-11-29","21:49:27",""
"7064093","15.6174","0.0013","8.161","0.0006","24.7494","0.0019","90","","101.275","0.008","90","","3093.5","0.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C37 H36 N6 -","- C37 H36 N6 -","- C148 H144 N24 -","4","0.5","","Campos-Dominguez, Emmanuel; Ruiz-Mendoza, Francisco J.; Rendón-Nava, David; Flores-Jarillo, Mariana; Álvarez-Hernández, Alejandro; Mendoza-Espinosa, Daniel","Preparation and applications of metal complexes supported by fluorene- and anthrone-functionalized (bis)mesoionic 1,2,3-triazol-5-ylidenes","New Journal of Chemistry","2025","49","46","19963","19972","10.1039/D5NJ03832D","","x-ray","0.71073","MoKα","","0.0647","0.0459","","","0.121","0.1348","","","","","","1.029","","","","has coordinates","303883","2025-11-29","21:49:27",""
"7064094","18.7032","0.0005","11.9742","0.0003","20.567","0.0006","90","","109.161","0.003","90","","4350.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H47 I2 N7 O2 -","- C42 H47 I2 N7 O2 -","- C168 H188 I8 N28 O8 -","4","1","","Campos-Dominguez, Emmanuel; Ruiz-Mendoza, Francisco J.; Rendón-Nava, David; Flores-Jarillo, Mariana; Álvarez-Hernández, Alejandro; Mendoza-Espinosa, Daniel","Preparation and applications of metal complexes supported by fluorene- and anthrone-functionalized (bis)mesoionic 1,2,3-triazol-5-ylidenes","New Journal of Chemistry","2025","49","46","19963","19972","10.1039/D5NJ03832D","","x-ray","0.71073","","","0.0457","0.036","","","0.0909","0.1016","","","","","","1.1","","","","has coordinates","303883","2025-11-29","21:49:27",""
"7064095","6.6646","0.0003","11.2132","0.0004","12.7701","0.0005","73.514","0.003","80.003","0.003","83.314","0.003","898.92","0.06","101","2","101","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H21 N O3 S -","- C21 H21 N O3 S -","- C42 H42 N2 O6 S2 -","2","1","","Mizuno, Shota; Suzuki, Haruka; Kato, Kunihiko; Kubota, Yasuhiro; Inuzuka, Toshiyasu; Ban, Takayuki; Funabiki, Kazumasa","Counteranion-controlled aggregation-induced emission in 10H-pyrido[1,2-a]-5-indolium salts: structure–property relationships and anion–π+ interactions","New Journal of Chemistry","2025","49","45","19479","19488","10.1039/D5NJ03620H","","x-ray","1.54184","CuKα","","0.0642","0.0531","","","0.1341","0.1429","","","","","","1.033","","","","has coordinates","303892","2025-11-29","21:51:37",""
"7064096","6.8058","0.0003","10.8808","0.0004","11.4591","0.0003","101.963","0.003","99.904","0.003","101.556","0.003","792.88","0.05","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C15 H14 F3 N O3 S -","- C15 H14 F3 N O3 S -","- C30 H28 F6 N2 O6 S2 -","2","2","","Mizuno, Shota; Suzuki, Haruka; Kato, Kunihiko; Kubota, Yasuhiro; Inuzuka, Toshiyasu; Ban, Takayuki; Funabiki, Kazumasa","Counteranion-controlled aggregation-induced emission in 10H-pyrido[1,2-a]-5-indolium salts: structure–property relationships and anion–π+ interactions","New Journal of Chemistry","2025","49","45","19479","19488","10.1039/D5NJ03620H","","","1.54184","CuKα","","0.0798","0.0645","","","0.1879","0.2156","","","","","","1.091","","","","has coordinates","303892","2025-11-29","21:51:38",""
"7064097","17.5691","0.0005","17.3369","0.0005","20.5092","0.0006","90","","90","","90","","6247","0.3","99.9","0.4","99.9","0.4","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C39 H36 B Cl2 N -","- C39 H36 B Cl2 N -","- C312 H288 B8 Cl16 N8 -","8","1","","Mizuno, Shota; Suzuki, Haruka; Kato, Kunihiko; Kubota, Yasuhiro; Inuzuka, Toshiyasu; Ban, Takayuki; Funabiki, Kazumasa","Counteranion-controlled aggregation-induced emission in 10H-pyrido[1,2-a]-5-indolium salts: structure–property relationships and anion–π+ interactions","New Journal of Chemistry","2025","49","45","19479","19488","10.1039/D5NJ03620H","","x-ray","1.54184","CuKα","","0.0588","0.0493","","","0.1307","0.1415","","","","","","1.066","","","","has coordinates","303892","2025-11-29","21:51:38",""
"7064098","10.1711","0.0002","12.3512","0.0003","16.3633","0.0003","98.57","0.002","101.164","0.002","112.216","0.002","1810.28","0.08","100","0.1","100","0.1","","","","","","","","6","P 1","P 1","1","","","","- C77 H29 B2 Cl3 F40 N2 -","- C77 H29 B2 Cl3 F40 N2 -","- C77 H29 B2 Cl3 F40 N2 -","1","1","","Mizuno, Shota; Suzuki, Haruka; Kato, Kunihiko; Kubota, Yasuhiro; Inuzuka, Toshiyasu; Ban, Takayuki; Funabiki, Kazumasa","Counteranion-controlled aggregation-induced emission in 10H-pyrido[1,2-a]-5-indolium salts: structure–property relationships and anion–π+ interactions","New Journal of Chemistry","2025","49","45","19479","19488","10.1039/D5NJ03620H","","x-ray","1.54184","CuKα","","0.0544","0.0479","","","0.1118","0.1171","","","","","","1.061","","","","has coordinates,has disorder","303892","2025-11-29","21:51:38",""
"7064099","6.3465","0.0001","12.6838","0.0001","16.3499","0.0001","90","","90","","90","","1316.13","0.02","100","0.1","100","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 B F4 N -","- C14 H14 B F4 N -","- C56 H56 B4 F16 N4 -","4","1","","Mizuno, Shota; Suzuki, Haruka; Kato, Kunihiko; Kubota, Yasuhiro; Inuzuka, Toshiyasu; Ban, Takayuki; Funabiki, Kazumasa","Counteranion-controlled aggregation-induced emission in 10H-pyrido[1,2-a]-5-indolium salts: structure–property relationships and anion–π+ interactions","New Journal of Chemistry","2025","49","45","19479","19488","10.1039/D5NJ03620H","","x-ray","1.54184","CuKα","","0.0258","0.0252","","","0.0624","0.0627","","","","","","1.048","","","","has coordinates","303892","2025-11-29","21:51:38",""
"7064100","17.8202","0.0002","7.3218","0.0001","57.3725","0.0009","90","","97.864","0.001","90","","7415.33","0.18","299","2","299.39","0.17","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H23 N7 Se -","- C24 H23 N7 Se -","- C288 H276 N84 Se12 -","12","3","","Yanbaeva, Margarita; Steinke, Tim; Engelage, Elric; Weiss, Robert; Huber, Stefan M.","“Anti-electrostatic” (inter-anion) chalcogen bonding interactions","New Journal of Chemistry","2025","49","44","19086","19090","10.1039/D5NJ03660G","","x-ray","1.54184","CuKα","","0.0759","0.0491","","","0.1249","0.1426","","","","","","1.024","","","","has coordinates","303852","2025-11-29","21:38:01",""
"7064101","37.3563","0.0003","7.401","","36.7268","0.0003","90","","111.001","0.001","90","","9479.52","0.13","170","2","170","0.1","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C24 H23 N7 Se -","- C24 H23 N7 Se -","- C384 H368 N112 Se16 -","16","2","","Yanbaeva, Margarita; Steinke, Tim; Engelage, Elric; Weiss, Robert; Huber, Stefan M.","“Anti-electrostatic” (inter-anion) chalcogen bonding interactions","New Journal of Chemistry","2025","49","44","19086","19090","10.1039/D5NJ03660G","","x-ray","1.54184","CuKα","","0.0281","0.0271","","","0.0754","0.0761","","","","","","1.041","","","","has coordinates","303852","2025-11-29","21:38:02",""
"7064102","11.43579","0.00019","17.96728","0.00019","24.3438","0.0003","90","","95.5324","0.0013","90","","4978.62","0.12","299","2","299.22","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 N7 Se -","- C24 H23 N7 Se -","- C192 H184 N56 Se8 -","8","2","","Yanbaeva, Margarita; Steinke, Tim; Engelage, Elric; Weiss, Robert; Huber, Stefan M.","“Anti-electrostatic” (inter-anion) chalcogen bonding interactions","New Journal of Chemistry","2025","49","44","19086","19090","10.1039/D5NJ03660G","","x-ray","1.54184","CuKα","","0.0578","0.0449","","","0.1275","0.1372","","","","","","1.064","","","","has coordinates,has disorder","303852","2025-11-29","21:38:02",""
"7064103","23.3178","0.0011","7.8643","0.0003","22.1414","0.0009","90","","113.716","0.003","90","","3717.4","0.3","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H14 Br2 -","- C26 H14 Br2 -","- C208 H112 Br16 -","8","2","","Maliha, Sunjida Reza; Datta, Saptarshi; Badiganti, Jahnavi; Rajamoni, Jagan; Szatkowski, Lukasz; Xu, Jinjia","Study of halogen substitution effects on the structural and electronic properties of overcrowded alkene rotors","New Journal of Chemistry","2025","49","47","20558","20566","10.1039/D5NJ03468J","","","1.54178","CuKα","","0.2157","0.1656","","","0.425","0.4544","","","","","","1.51","","","","has coordinates,has disorder","304115","2025-12-07","08:06:08",""
"7064104","13.9215","0.0005","19.7974","0.0008","7.626","0.0003","90","","90","","90","","2101.8","0.14","301","","301","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C26 H12 Br4 -","- C26 H12 Br4 -","- C104 H48 Br16 -","4","0.5","","Maliha, Sunjida Reza; Datta, Saptarshi; Badiganti, Jahnavi; Rajamoni, Jagan; Szatkowski, Lukasz; Xu, Jinjia","Study of halogen substitution effects on the structural and electronic properties of overcrowded alkene rotors","New Journal of Chemistry","2025","49","47","20558","20566","10.1039/D5NJ03468J","","","0.71073","MoKα","","0.0515","0.0306","","","0.0575","0.0663","","","","","","1.032","","","","has coordinates","304115","2025-12-07","08:06:11",""
"7064105","7.6176","0.0007","11.1985","0.0009","18.9787","0.0018","90","","95.657","0.01","90","","1611.1","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H11 F3 N2 O6 -","- C15 H11 F3 N2 O6 -","- C60 H44 F12 N8 O24 -","4","1","","Kochnev, Ivan A.; Barkov, Alexey Yu.","Silver or copper-catalyzed ring opening [3+2] annulation of 2-polyfluoroalkyl chromones/6-polyfluoroalkyl pyran-4H-ones with methylene isocyanides: regioselective synthesis of 3-polyfluoroalkyl pyrroles","New Journal of Chemistry","2025","49","46","20254","20263","10.1039/D5NJ03333K","","","0.71073","MoKα","","0.1495","0.0643","","","0.169","0.237","","","","","","1.01","","","","has coordinates,has disorder","303882","2025-11-29","21:46:44",""
"7064106","7.7224","0.0007","14.8067","0.0013","15.0191","0.0011","107.418","0.007","97.252","0.007","95.632","0.007","1608.6","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H14 F3 N O4 -","- C17 H14 F3 N O4 -","- C68 H56 F12 N4 O16 -","4","2","","Kochnev, Ivan A.; Barkov, Alexey Yu.","Silver or copper-catalyzed ring opening [3+2] annulation of 2-polyfluoroalkyl chromones/6-polyfluoroalkyl pyran-4H-ones with methylene isocyanides: regioselective synthesis of 3-polyfluoroalkyl pyrroles","New Journal of Chemistry","2025","49","46","20254","20263","10.1039/D5NJ03333K","","","0.71073","MoKα","","0.2098","0.0743","","","0.1746","0.2658","","","","","","0.959","","","","has coordinates","303882","2025-11-29","21:46:45",""
"7064107","5.2062","0.0006","13.1121","0.0008","24.064","0.002","90","","90","","90","","1642.7","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H14 F3 N O2 -","- C20 H14 F3 N O2 -","- C80 H56 F12 N4 O8 -","4","1","","Kochnev, Ivan A.; Barkov, Alexey Yu.","Silver or copper-catalyzed ring opening [3+2] annulation of 2-polyfluoroalkyl chromones/6-polyfluoroalkyl pyran-4H-ones with methylene isocyanides: regioselective synthesis of 3-polyfluoroalkyl pyrroles","New Journal of Chemistry","2025","49","46","20254","20263","10.1039/D5NJ03333K","","x-ray","0.71073","MoKα","","0.1292","0.0639","","","0.1336","0.1895","","","","","","0.999","","","","has coordinates","303882","2025-11-29","21:46:45",""
"7064108","13.0298","0.0007","7.5259","0.0007","31.6005","0.0019","90","","90","","90","","3098.8","0.4","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C17 H13 F3 N2 O3 -","- C17 H13 F3 N2 O3 -","- C136 H104 F24 N16 O24 -","8","1","","Kochnev, Ivan A.; Barkov, Alexey Yu.","Silver or copper-catalyzed ring opening [3+2] annulation of 2-polyfluoroalkyl chromones/6-polyfluoroalkyl pyran-4H-ones with methylene isocyanides: regioselective synthesis of 3-polyfluoroalkyl pyrroles","New Journal of Chemistry","2025","49","46","20254","20263","10.1039/D5NJ03333K","","","0.71073","MoKα","","0.1781","0.0631","","","0.099","0.1361","","","","","","0.976","","","","has coordinates","303882","2025-11-29","21:46:45",""
"7064109","5.3102","0.0004","9.1761","0.0006","10.1904","0.0006","90","","99.852","0.006","90","","489.22","0.06","293","2","293","2","","","","","","","no","6","C 1 2 1","C 2y","5","silicate-germanate","potassium lithium niobium silicate-germanate","","- Ge1.6 K Li1.8 Nb1.04 O12 Si2.4 -","- Ge1.6 K Li1.8 Nb1.04 O12 Si2.4 -","- Ge3.2 K2 Li3.6 Nb2.08 O24 Si4.8 -","2","0.5","","Belokoneva, Elena L.; van Dinteren-Tovstopyat, Sofiya V.; Volkov, Anatoly S.; Dimitrova, Olga V.; Vigasina, Marina F.; Stefanovich, Sergey Yu.; Simonov, Sergey V.; Ksenofontov, Dmitry A.","First hydrothermally synthesized polar lithium niobium 1M mica germanate–silicate KNb (Li0.9Nb0.02□ 0.08)2[(Ge0.4Si0.6)4O10]O2 with disorder and isomorphism, and topology symmetry analysis of the polytype family","New Journal of Chemistry","2025","49","46","19955","19962","10.1039/D5NJ02691A","","","0.71073","MoKα","","0.061","0.0519","","","0.1026","0.1069","","","","","","1.031","","","","has coordinates","303879","2025-11-29","21:45:29",""
"7064110","8.4069","0.0003","9.1212","0.0003","20.3453","0.0008","91.437","0.001","100.122","0.002","97.326","0.001","1521.48","0.1","205.3","","205.3","","","","","","","","","4","P -1","-P 1","2","","","","- C66 H72 O15 P2 -","- C66 H72 O15 P2 -","- C66 H72 O15 P2 -","1","0.5","","Wei, Jian-Sheng; Du, Xiu-Ru; Du, Zhi-Qiang; Zhong, Ling-Yi; Ma, Ao-Qiang; Wang, Jian; Xia, Ai-Bao; Xu, Dan-Qian","Cs2CO3-mediated ring-opening reactions of nitrocyclopropanes via in situ generated allenes with phosphite triesters: stereoselective construction of (E)-vinylphosphonates","New Journal of Chemistry","2025","49","46","19945","19949","10.1039/D5NJ02982A","","x-ray","0.71073","MoKα","","0.1169","0.0602","","","0.1214","0.1496","","","","","","1.022","","","","has coordinates,has disorder","303884","2025-11-29","21:49:41",""
"7064111","8.3413","0.0003","8.5591","0.0003","12.6987","0.0004","107.43","0.02","104.455","0.002","93.15","0.002","829.3","0.11","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H28 Cu4 N24 O8 -","- C20 H28 Cu4 N24 O8 -","- C20 H28 Cu4 N24 O8 -","1","0.5","","Das, Nishan; Nandi, Nishithendu Bikash; Kłak, Julia; Sieroń, Lesław; Novikov, Alexander S.; Maniukiewicz, Waldemar; Misra, Tarun Kumar","Antiferromagnetic cyclic tetrameric copper(ii) complex and 8-azaxanthine derived from 1,3-dimethyl-5-(5′-methyl-3′-isoxazolyl-azo)-6-aminouracil: structures, non-covalent interactions and magnetism","New Journal of Chemistry","2025","49","46","20024","20038","10.1039/D5NJ03321G","","x-ray","0.71073","MoKα","","0.0311","0.0306","","","0.0798","0.0801","","","","","","1.072","","","","has coordinates","303880","2025-11-29","21:45:41",""
"7064112","20.8768","0.0005","5.8611","0.0001","19.6178","0.0004","90","","94.741","0.002","90","","2392.24","0.09","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H26 N12 O7 -","- C20 H26 N12 O7 -","- C80 H104 N48 O28 -","4","0.5","","Das, Nishan; Nandi, Nishithendu Bikash; Kłak, Julia; Sieroń, Lesław; Novikov, Alexander S.; Maniukiewicz, Waldemar; Misra, Tarun Kumar","Antiferromagnetic cyclic tetrameric copper(ii) complex and 8-azaxanthine derived from 1,3-dimethyl-5-(5′-methyl-3′-isoxazolyl-azo)-6-aminouracil: structures, non-covalent interactions and magnetism","New Journal of Chemistry","2025","49","46","20024","20038","10.1039/D5NJ03321G","","x-ray","1.54184","CuKα","","0.0282","0.0276","","","0.0676","0.068","","","","","","1.052","","","","has coordinates","303880","2025-11-29","21:45:42",""
"7064113","13.5715","0.0001","12.1653","0.0001","6.7738","0.0001","90","","99.392","0.001","90","","1103.37","0.02","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N6 O3 -","- C10 H10 N6 O3 -","- C40 H40 N24 O12 -","4","1","","Das, Nishan; Nandi, Nishithendu Bikash; Kłak, Julia; Sieroń, Lesław; Novikov, Alexander S.; Maniukiewicz, Waldemar; Misra, Tarun Kumar","Antiferromagnetic cyclic tetrameric copper(ii) complex and 8-azaxanthine derived from 1,3-dimethyl-5-(5′-methyl-3′-isoxazolyl-azo)-6-aminouracil: structures, non-covalent interactions and magnetism","New Journal of Chemistry","2025","49","46","20024","20038","10.1039/D5NJ03321G","","x-ray","1.54184","CuKα","","0.0327","0.0325","","","0.0891","0.0893","","","","","","1.05","","","","has coordinates","303880","2025-11-29","21:45:42",""
"7064114","7.4075","0.0005","13.1203","0.0011","21.0062","0.0015","90","","92.715","0.006","90","","2039.3","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-Hydroxy-6,6-dimethyl-2-((E)-2-(4-nitrophenyl)ethenyl)-3,5,6,7-tetrahydro-4H-benzimidazol-4-one","","- C20 H24 N4 O5 -","- C20 H24 N4 O5 -","- C80 H96 N16 O20 -","4","1","","Golfarb-Abramov, Vladislav O.; Kazennova, Anastasia V.; Basanova, Elizaveta I.; Serova, Olga A.; Bormotov, Nikolai I.; Shishkina, Larisa N.; Krasnov, Vyacheslav I.; Polovyanenko, Dmitriy N.; Moskalev, Ivan A.; Fedorov, Alexey Yu.; Arkhipov, Sergey G.; Ilyina, Margarita G.; Borisevich, Sophia S.; Yarovaya, Olga I.; Nikitina, Polina A.","Synthesis, structure investigation and evaluation of anti-orthopoxvirus activities of 2-(2-arylethenyl)imidazoles","New Journal of Chemistry","2025","49","45","19699","19717","10.1039/D5NJ03203B","","x-ray","0.71073","MoKα","","0.0888","0.0592","","","0.1604","0.1871","","","","","","1.039","","","","has coordinates","303891","2025-11-29","21:51:20",""
"7064115","13.398","0.002","9.5481","0.0013","20.887","0.004","90","","97.339","0.017","90","","2650.1","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,4,5-Trimethyl-2-((E)-2-phenylethenyl)-1H-imidazole","","- C14 H18 N2 O2 -","- C14 H18 N2 O2 -","- C112 H144 N16 O16 -","8","1","","Golfarb-Abramov, Vladislav O.; Kazennova, Anastasia V.; Basanova, Elizaveta I.; Serova, Olga A.; Bormotov, Nikolai I.; Shishkina, Larisa N.; Krasnov, Vyacheslav I.; Polovyanenko, Dmitriy N.; Moskalev, Ivan A.; Fedorov, Alexey Yu.; Arkhipov, Sergey G.; Ilyina, Margarita G.; Borisevich, Sophia S.; Yarovaya, Olga I.; Nikitina, Polina A.","Synthesis, structure investigation and evaluation of anti-orthopoxvirus activities of 2-(2-arylethenyl)imidazoles","New Journal of Chemistry","2025","49","45","19699","19717","10.1039/D5NJ03203B","","x-ray","0.71073","MoKα","","0.1272","0.0934","","","0.2657","0.2942","","","","","","1.101","","","","has coordinates","303891","2025-11-29","21:51:21",""
"7064116","12.9411","0.0008","8.0804","0.0006","14.275","0.0011","90","","105.129","0.008","90","","1440.99","0.19","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-Acetyl-1,5-dimethyl-2-((E)-2-(4-nitrophenyl)ethenyl)-1H-imidazole","","- C14 H17 N3 O4 -","- C14 H17 N3 O4 -","- C56 H68 N12 O16 -","4","1","","Golfarb-Abramov, Vladislav O.; Kazennova, Anastasia V.; Basanova, Elizaveta I.; Serova, Olga A.; Bormotov, Nikolai I.; Shishkina, Larisa N.; Krasnov, Vyacheslav I.; Polovyanenko, Dmitriy N.; Moskalev, Ivan A.; Fedorov, Alexey Yu.; Arkhipov, Sergey G.; Ilyina, Margarita G.; Borisevich, Sophia S.; Yarovaya, Olga I.; Nikitina, Polina A.","Synthesis, structure investigation and evaluation of anti-orthopoxvirus activities of 2-(2-arylethenyl)imidazoles","New Journal of Chemistry","2025","49","45","19699","19717","10.1039/D5NJ03203B","","x-ray","0.71073","MoKα","","0.0613","0.0504","","","0.1396","0.1486","","","","","","1.072","","","","has coordinates","303891","2025-11-29","21:51:21",""
"7064117","4.7308","0.0009","38.246","0.003","9.089","0.002","90","","96.796","0.017","90","","1633","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethyl","","- C16 H18 N3 O5 -","- C16 H18 N3 O5 -","- C64 H72 N12 O20 -","4","1","","Golfarb-Abramov, Vladislav O.; Kazennova, Anastasia V.; Basanova, Elizaveta I.; Serova, Olga A.; Bormotov, Nikolai I.; Shishkina, Larisa N.; Krasnov, Vyacheslav I.; Polovyanenko, Dmitriy N.; Moskalev, Ivan A.; Fedorov, Alexey Yu.; Arkhipov, Sergey G.; Ilyina, Margarita G.; Borisevich, Sophia S.; Yarovaya, Olga I.; Nikitina, Polina A.","Synthesis, structure investigation and evaluation of anti-orthopoxvirus activities of 2-(2-arylethenyl)imidazoles","New Journal of Chemistry","2025","49","45","19699","19717","10.1039/D5NJ03203B","","x-ray","0.71073","MoKα","","0.1321","0.0799","","","0.2336","0.2738","","","","","","1.008","","","","has coordinates","303891","2025-11-29","21:51:21",""
"7064118","7.3738","0.0005","14.1463","0.001","15.4463","0.001","66.399","0.006","88.379","0.005","86.836","0.005","1474.18","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 1-hydroxy-4-methyl-2-((E)-2-(4-nitrophenyl)ethenyl)-1H-imidazole-5-carboxylate","","- C30 H29 N6 O10 -","- C30 H29 N6 O10 -","- C60 H58 N12 O20 -","2","1","","Golfarb-Abramov, Vladislav O.; Kazennova, Anastasia V.; Basanova, Elizaveta I.; Serova, Olga A.; Bormotov, Nikolai I.; Shishkina, Larisa N.; Krasnov, Vyacheslav I.; Polovyanenko, Dmitriy N.; Moskalev, Ivan A.; Fedorov, Alexey Yu.; Arkhipov, Sergey G.; Ilyina, Margarita G.; Borisevich, Sophia S.; Yarovaya, Olga I.; Nikitina, Polina A.","Synthesis, structure investigation and evaluation of anti-orthopoxvirus activities of 2-(2-arylethenyl)imidazoles","New Journal of Chemistry","2025","49","45","19699","19717","10.1039/D5NJ03203B","","x-ray","0.71073","MoKα","","0.1585","0.088","","","0.2362","0.2942","","","","","","0.98","","","","has coordinates","303891","2025-11-29","21:51:21",""
"7064119","7.5492","0.0008","7.7057","0.0009","13.4133","0.0014","96.792","0.009","99.738","0.009","114.016","0.011","687.12","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1-(1-Methoxy-4-methyl-2-((E)-2-phenylethenyl)-1H-imidazol-5-yl)ethanone","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C30 H32 N4 O4 -","2","1","","Golfarb-Abramov, Vladislav O.; Kazennova, Anastasia V.; Basanova, Elizaveta I.; Serova, Olga A.; Bormotov, Nikolai I.; Shishkina, Larisa N.; Krasnov, Vyacheslav I.; Polovyanenko, Dmitriy N.; Moskalev, Ivan A.; Fedorov, Alexey Yu.; Arkhipov, Sergey G.; Ilyina, Margarita G.; Borisevich, Sophia S.; Yarovaya, Olga I.; Nikitina, Polina A.","Synthesis, structure investigation and evaluation of anti-orthopoxvirus activities of 2-(2-arylethenyl)imidazoles","New Journal of Chemistry","2025","49","45","19699","19717","10.1039/D5NJ03203B","","x-ray","0.71073","MoKα","","0.0909","0.0773","","","0.2081","0.2239","","","","","","1.03","","","","has coordinates","303891","2025-11-29","21:51:21",""
"7064131","15.8568","0.0008","21.4138","0.0011","15.4243","0.001","90","","90","","90","","5237.4","0.5","296.15","","296.15","","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C36 H74 Gd N O29 V2 -","- C36 H73.3332 Gd N O28.6666 V2 -","- C144 H293.333 Gd4 N4 O114.666 V8 -","4","0.5","","Bazhina, Evgeniya S.; Shmelev, Maxim A.; Gogoleva, Natalia V.; Matiukhina, Anna K.; Vasilev, Pavel N.; Efimov, Nikolay N.; Kiskin, Mikhail A.; Eremenko, Igor L.","Novel bimetallic LnIII/VIV (Ln = Gd, Tb, Dy, Er, Yb, Lu) compounds with cyclopropane-1,1-dicarboxylate anions and bulky tetrabutylammonium cations: synthesis, structure, magnetic properties, and thermal decomposition","New Journal of Chemistry","2025","49","47","20754","20767","10.1039/D5NJ03452C","","","0.71073","MoKα","","0.0617","0.0484","","","0.1063","0.1137","","","","","","1.121","","","","has coordinates,has disorder","304116","2025-12-07","08:07:43",""
"7064132","15.7781","0.0012","21.2907","0.0015","15.4105","0.001","90","","90","","90","","5176.8","0.6","296.15","","296.15","","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C36 H73.33 Dy N O28.67 V2 -","- C36 H73.3332 Dy N O28.6666 V2 -","- C144 H293.333 Dy4 N4 O114.666 V8 -","4","0.5","","Bazhina, Evgeniya S.; Shmelev, Maxim A.; Gogoleva, Natalia V.; Matiukhina, Anna K.; Vasilev, Pavel N.; Efimov, Nikolay N.; Kiskin, Mikhail A.; Eremenko, Igor L.","Novel bimetallic LnIII/VIV (Ln = Gd, Tb, Dy, Er, Yb, Lu) compounds with cyclopropane-1,1-dicarboxylate anions and bulky tetrabutylammonium cations: synthesis, structure, magnetic properties, and thermal decomposition","New Journal of Chemistry","2025","49","47","20754","20767","10.1039/D5NJ03452C","","","0.71073","MoKα","","0.0816","0.0537","","","0.1124","0.1275","","","","","","1.085","","","","has coordinates,has disorder","304116","2025-12-07","08:07:44",""
"7064133","15.7396","0.0009","21.332","0.001","15.4082","0.0007","90","","90","","90","","5173.4","0.4","296.15","","296.15","","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C36 H73.33 N O28.67 Tb V2 -","- C36 H73.3332 N O28.6666 Tb V2 -","- C144 H293.333 N4 O114.666 Tb4 V8 -","4","0.5","","Bazhina, Evgeniya S.; Shmelev, Maxim A.; Gogoleva, Natalia V.; Matiukhina, Anna K.; Vasilev, Pavel N.; Efimov, Nikolay N.; Kiskin, Mikhail A.; Eremenko, Igor L.","Novel bimetallic LnIII/VIV (Ln = Gd, Tb, Dy, Er, Yb, Lu) compounds with cyclopropane-1,1-dicarboxylate anions and bulky tetrabutylammonium cations: synthesis, structure, magnetic properties, and thermal decomposition","New Journal of Chemistry","2025","49","47","20754","20767","10.1039/D5NJ03452C","","","0.71073","MoKα","","0.0573","0.0506","","","0.099","0.1018","","","","","","1.192","","","","has coordinates,has disorder","304116","2025-12-07","08:07:44",""