# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-18T13:24:50+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'New J. Chem.') AND volume = 41 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
"1544795","6.9126","0.0014","7.6578","0.0015","31.895","0.006","90","","92.22","0.03","90","","1687.1","0.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cis-dioxo(2-(N-(salicylidene)amino)-4-methylphenolato-N,O,O')-(methanol)-molybdenum(VI)","","","- C16 H19 Mo N O6 -","- C16 H19 Mo N O6 -","- C64 H76 Mo4 N4 O24 -","4","1","","Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique","Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions","New J. Chem.","2017","41","2","594","","10.1039/C6NJ03174A","","","0.71073","MoKα","","0.0486","0.0321","","","0.0645","0.0699","","","","","","1.045","","","","has coordinates,has disorder","191701","2020-10-21","18:00:00",""
"1544796","8.7538","0.0005","10.0269","0.0005","10.7193","0.0006","97.063","0.004","111.466","0.005","95.831","0.004","857.95","0.09","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","cis-dioxo(2-(N-(salicylidene)amino)-5-methylphenolato-N,O,O')-(methanol)-molybdenum(VI)","","- C16 H19 Mo N O6 -","- C16 H19 Mo N O6 -","- C32 H38 Mo2 N2 O12 -","2","1","","Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique","Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions","New J. Chem.","2017","41","2","594","","10.1039/C6NJ03174A","","","0.71073","MoKα","","0.0414","0.0281","","","0.0574","0.0593","","","","","","0.924","","","","has coordinates","191701","2020-10-21","18:00:00",""
"1544797","19.61","0.0007","7.5974","0.0004","12.7835","0.0005","90","","102.179","0.004","90","","1861.68","0.14","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-dioxo(2-(N-(3-methoxysalicyliden)amino)-5-methylphenolato-N,O,O')-(methanol)-molybdenum(VI)","","- C17 H21 Mo N O7 -","- C17 H21 Mo N O7 -","- C68 H84 Mo4 N4 O28 -","4","1","","Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique","Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions","New J. Chem.","2017","41","2","594","","10.1039/C6NJ03174A","","","0.71073","MoKα","","0.0504","0.0303","","","0.0709","0.0744","","","","","","0.894","","","","has coordinates","191701","2020-10-21","18:00:00",""
"1544798","7.6444","0.0005","9.9107","0.0005","11.0535","0.0006","72.13","0.005","82.196","0.005","88.111","0.005","789.61","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","cis-dioxo(2-(N-(2-oxonapht-1-yl)methylamino)phenolato-N,O,O')-(methanol)-molybdenum(VI)","","- C18 H15 Mo N O5 -","- C18 H15 Mo N O5 -","- C36 H30 Mo2 N2 O10 -","2","1","","Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique","Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions","New J. Chem.","2017","41","2","594","","10.1039/C6NJ03174A","","","0.71073","MoKα","","0.0278","0.0229","","","0.0643","0.0653","","","","","","1.052","","","","has coordinates","191701","2020-10-21","18:00:00",""
"1544799","7.9476","0.0013","14.9809","0.0014","16.765","0.003","90","","96.268","0.019","90","","1984.1","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-dioxo(2-(N-(2-oxonapht-1-yl)methylamino)-5-methylphenolato-N,O,O')-(methanol)-molybdenum(VI)","","- C20 H21 Mo N O6 -","- C20 H21 Mo N O6 -","- C80 H84 Mo4 N4 O24 -","4","1","","Cindrić, Marina; Pavlović, Gordana; Katava, Robert; Agustin, Dominique","Towards a global greener process: from solvent-less synthesis of molybdenum(vi) ONO Schiff base complexes to catalyzed olefin epoxidation under organic-solvent-free conditions","New J. Chem.","2017","41","2","594","","10.1039/C6NJ03174A","","","0.71073","MoKα","","0.0841","0.0393","","","0.0738","0.0811","","","","","","0.85","","","","has coordinates","191701","2020-10-21","18:00:00",""
"1545613","9.1117","0.0018","11.229","0.002","12.539","0.003","95.86","0.03","103.5","0.03","102.41","0.03","1202.6","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H26 N P Pt -","- C29 H26 N P Pt -","- C58 H52 N2 P2 Pt2 -","2","1","","Shahsavari, Hamid R.; Babadi Aghakhanpour, Reza; Babaghasabha, Mojgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Notash, Behrouz","Photophysical properties of a series of cycloplatinated( <scp>ii</scp> ) complexes featuring allyldiphenylphosphane","New Journal of Chemistry","2017","41","10","3798","3810","10.1039/C7NJ00055C","","","0.71073","MoKα","","0.0546","0.0424","","","0.0952","0.0982","","","","","","0.952","","","","has coordinates","282777","2023-04-20","11:56:45",""
"1545614","9.759","0.002","10.351","0.002","23.222","0.005","90","","100.86","0.03","90","","2303.8","0.8","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H26 N P Pt -","- C27 H26 N P Pt -","- C108 H104 N4 P4 Pt4 -","4","1","","Shahsavari, Hamid R.; Babadi Aghakhanpour, Reza; Babaghasabha, Mojgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Notash, Behrouz","Photophysical properties of a series of cycloplatinated( <scp>ii</scp> ) complexes featuring allyldiphenylphosphane","New Journal of Chemistry","2017","41","10","3798","3810","10.1039/C7NJ00055C","","","0.71073","MoKα","","0.0777","0.0458","","","0.0987","0.1159","","","","","","0.926","","","","has coordinates","282777","2023-04-20","11:56:45",""
"1545615","9.6029","0.0019","13.097","0.003","19.63","0.004","90","","100.17","0.03","90","","2430.1","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 N P Pt -","- C30 H26 N P Pt -","- C120 H104 N4 P4 Pt4 -","4","1","","Shahsavari, Hamid R.; Babadi Aghakhanpour, Reza; Babaghasabha, Mojgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Notash, Behrouz","Photophysical properties of a series of cycloplatinated( <scp>ii</scp> ) complexes featuring allyldiphenylphosphane","New Journal of Chemistry","2017","41","10","3798","3810","10.1039/C7NJ00055C","","","0.71073","MoKα","","0.073","0.0397","","","0.0828","0.0952","","","","","","0.869","","","","has coordinates","282777","2023-04-20","11:56:45",""
"1545616","7.615","0.006","9.703","0.007","52","0.03","90","","90","","90","","3842","5","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C42 H44 Fe2 N4 O2 S2 -","- C42 H44 Fe2 N4 O2 S2 -","- C168 H176 Fe8 N16 O8 S8 -","4","1","","Duan, Xin-E; Li, Rui; Tong, Hong-Bo; Li, Ying-Qi; Bai, Sheng-Di; Guo, Yu-Jing; Liu, Dian-Sheng","Synthesis and structural characterization of electrochemically reversible bisferrocenes containing bis(acyl-thiourea)s: enantiomers and conformers","New J. Chem.","2017","41","9","3333","","10.1039/C6NJ03539F","","","0.71073","MoKα","","0.0632","0.058","","","0.1338","0.137","","","","","","1.115","","","","has coordinates","196499","2020-10-21","18:00:00",""
"1545617","9.707","0.002","14.545","0.003","20.921","0.004","90","","90","","90","","2953.8","1","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H32 Fe2 N4 O2 S2 -","- C30 H32 Fe2 N4 O2 S2 -","- C120 H128 Fe8 N16 O8 S8 -","4","1","","Duan, Xin-E; Li, Rui; Tong, Hong-Bo; Li, Ying-Qi; Bai, Sheng-Di; Guo, Yu-Jing; Liu, Dian-Sheng","Synthesis and structural characterization of electrochemically reversible bisferrocenes containing bis(acyl-thiourea)s: enantiomers and conformers","New J. Chem.","2017","41","9","3333","","10.1039/C6NJ03539F","","","0.71073","MoKα","","0.0333","0.0263","","","0.0537","0.0563","","","","","","1.02","","","","has coordinates","196499","2020-10-21","18:00:00",""
"1545618","9.7134","0.0008","14.5357","0.0012","20.8935","0.0017","90","","90","","90","","2950","0.4","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H32 Fe2 N4 O2 S2 -","- C30 H32 Fe2 N4 O2 S2 -","- C120 H128 Fe8 N16 O8 S8 -","4","1","","Duan, Xin-E; Li, Rui; Tong, Hong-Bo; Li, Ying-Qi; Bai, Sheng-Di; Guo, Yu-Jing; Liu, Dian-Sheng","Synthesis and structural characterization of electrochemically reversible bisferrocenes containing bis(acyl-thiourea)s: enantiomers and conformers","New J. Chem.","2017","41","9","3333","","10.1039/C6NJ03539F","","","0.71073","MoKα","","0.0487","0.0331","","","0.0592","0.0647","","","","","","1.024","","","","has coordinates","196499","2020-10-21","18:00:00",""
"1546373","7.99","0.003","12.475","0.004","14.539","0.005","94.821","0.01","94.404","0.009","108.372","0.009","1362.3","0.8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H31 N4 O3 -","- C34 H31 N4 O3 -","- C68 H62 N8 O6 -","2","1","","Coman, Anca G.; Paraschivescu, Codruta C.; Paun, Anca; Diac, Andreea; Hădade, Niculina D.; Jouffret, Laurent; Gautier, Arnaud; Matache, Mihaela; Ionita, Petre","Synthesis of novel profluorescent nitroxides as dual luminescent-paramagnetic active probes","New Journal of Chemistry","2017","41","15","7472","7480","10.1039/C7NJ01698K","","","0.71073","MoKα","","0.0796","0.0437","","","0.0994","0.1163","","","","","","1.017","","","","has coordinates","282777","2023-04-20","11:56:46",""
"1546581","10.256","0.008","10.256","0.008","13.16","0.01","90","","90","","90","","1384.2","1.9","113","2","113","2","","","","","","","","5","I -4","I -4","82","","","","- C28 H16 N10 Ni S4 -","- C28 H16 N10 Ni S4 -","- C56 H32 N20 Ni2 S8 -","2","0.25","","Xue, Dan; Luo, Su-Ping; Zhan, Shu-Zhong","A coordinatively saturated nickel complex supported by triazenido ligands: a new electrocatalyst for hydrogen generation via ligand-centered proton-transfer","New Journal of Chemistry","2017","41","16","8503","8508","10.1039/C7NJ01705G","","","0.71073","MoKα","","0.0713","0.0678","","","0.1619","0.1654","","","","","","1.031","","","","has coordinates","282777","2023-04-20","11:56:47",""
"7055835","4.7366","0.0004","11.1769","0.001","18.966","0.0018","90","","97.015","0.002","90","","996.55","0.15","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-cyano-N'-[(1E)-(4-hydroxyphenyl)methylidene]acetohydrazide","","- C10 H9 N3 O2 -","- C10 H9 N3 O2 -","- C40 H36 N12 O8 -","4","1","","Zhang, Zhenfeng; Wang, Li; Xuan, Xiaopeng","The CN⋯C‒X σ-hole interaction acts as a conformational lock","New J. Chem.","2017","41","1","42","","10.1039/C6NJ02622B","","","0.71073","MoKα","","0.0538","0.0345","","","0.076","0.0866","","","","","","1.006","","","","has coordinates","191719","2020-10-21","18:00:00",""
"7055836","4.5944","0.0003","9.3525","0.0004","22.972","0.003","90","","94.883","0.002","90","","983.5","0.15","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 N3 O2 -","- C10 H9 N3 O2 -","- C40 H36 N12 O8 -","4","1","","Zhang, Zhenfeng; Wang, Li; Xuan, Xiaopeng","The CN⋯C‒X σ-hole interaction acts as a conformational lock","New J. Chem.","2017","41","1","42","","10.1039/C6NJ02622B","","","0.71073","MoKα","","0.0937","0.0515","","","0.1314","0.154","","","","","","1.025","","","","has coordinates","191719","2020-10-21","18:00:00",""
"7055860","6.3722","0.0018","11.278","0.003","17.837","0.005","90","","90","","90","","1281.9","0.6","110.15","","110.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","imidazole derivative","imidozolyl thiozole","","- C16 H9 F N2 O S -","- C16 H9 F N2 O S -","- C64 H36 F4 N8 O4 S4 -","4","1","","Ambethkar, Sethurajan; Vellimalai, Muthalu; Padmini, Vediappen; Bhuvanesh, Nattamai","Iodine-mediated C‒N and C‒S bond formation: regioselective synthesis of benzo[4,5]imidazo[2,1-b]thiazoles","New J. Chem.","2017","41","1","75","","10.1039/C6NJ02102F","","","0.71073","MoKα","","0.042","0.0362","","","0.0737","0.077","","","","","","1.044","","","","has coordinates","191721","2020-10-21","18:00:00",""
"7055861","9.94","0.003","12.584","0.004","11.973","0.004","90","","112.959","0.003","90","","1379","0.8","110.15","","110.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","imidazole derivative","imidazolyl thiozole","","- C17 H12 N2 O S -","- C17 H12 N2 O S -","- C68 H48 N8 O4 S4 -","4","1","","Ambethkar, Sethurajan; Vellimalai, Muthalu; Padmini, Vediappen; Bhuvanesh, Nattamai","Iodine-mediated C‒N and C‒S bond formation: regioselective synthesis of benzo[4,5]imidazo[2,1-b]thiazoles","New J. Chem.","2017","41","1","75","","10.1039/C6NJ02102F","","","0.71073","MoKα","","0.0524","0.0389","","","0.0837","0.0905","","","","","","1.036","","","","has coordinates","191721","2020-10-21","18:00:00",""
"7055862","17.72","0.004","9.681","0.002","27.874","0.006","90","","107.915","0.002","90","","4549.9","1.7","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H26 Br N3 O4 -","- C25 H26 Br N3 O4 -","- C200 H208 Br8 N24 O32 -","8","2","","VenkataPrasad, Jalli; Krishnamurthy, Suvratha; Moriguchi, Tetsuji; Tsuge, Akihiko","Efficient synthesis of novel pyrrolo[2,3-c]pyridone derivatives using the Ugi four-component reaction followed by condensation reaction","New J. Chem.","2017","41","1","97","","10.1039/C6NJ02569B","","","0.71073","MoKα","","0.1273","0.0774","","","0.1424","0.1672","","","","","","1.155","","","","has coordinates","203412","2020-10-21","18:00:00",""
"7055864","7.8845","0.0003","11.9643","0.0004","14.9423","0.0004","102.268","0.002","101.916","0.002","95.003","0.003","1334.95","0.08","93","","93.15","","","","","","","","","5","P -1","-P 1","2","","1-((1-(4-bromophenyl)-1H-1,2,3-triazol-4-yl)methyl)-N-3-diphenyl-6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5(4H)-carboxamide","","- C29 H28 Br N7 O2 -","- C29 H28 Br N7 O2 -","- C58 H56 Br2 N14 O4 -","2","1","","Amaroju, Suresh; Kalaga, Mahalakshmi Naidu; Srinivasarao, Singireddi; Napiórkowska, Agnieszka; Augustynowicz-Kopeć, Ewa; Murugesan, Sankaranarayanan; Chander, Subhash; Krishnan, Rangan; Chandra Sekhar, Kondapalli Venkata Gowri","Identification and development of pyrazolo[4,3-c]pyridine carboxamides as Mycobacterium tuberculosis pantothenate synthetase inhibitors","New J. Chem.","2017","41","1","347","","10.1039/C6NJ02671K","","","0.71073","MoKα","","","0.0479","","","","0.2031","","","","","","1.003","","","","has coordinates","191720","2020-10-21","18:00:00",""
"7055865","8.6286","0.0004","8.7296","0.0004","12.6607","0.0005","107.345","0.004","98.847","0.004","99.464","0.004","876.82","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H44 N14 Ni3 O4 -","- C28 H44 N14 Ni3 O4 -","- C28 H44 N14 Ni3 O4 -","1","0.5","","Andrusenko, Elena V.; Kabin, Evgeniy V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Starova, Galina L.; Kukushkin, Vadim Yu.","Metal-mediated generation of triazapentadienate-terminated di- and trinuclear μ2-pyrazolate NiII species and control of their nuclearity","New J. Chem.","2017","41","1","316","","10.1039/C6NJ02962K","","","0.7107","MoKα","","0.0657","0.0435","","","0.0831","0.0903","","","","","","1.044","","","","has coordinates","191715","2020-10-21","18:00:00",""
"7055866","8.1705","0.0004","10.6165","0.0007","14.8093","0.0008","78.021","0.005","75.628","0.005","86.402","0.005","1217.2","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H30 N10 Ni2 O4 -","- C18 H30 N10 Ni2 O4 -","- C36 H60 N20 Ni4 O8 -","2","1","","Andrusenko, Elena V.; Kabin, Evgeniy V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Starova, Galina L.; Kukushkin, Vadim Yu.","Metal-mediated generation of triazapentadienate-terminated di- and trinuclear μ2-pyrazolate NiII species and control of their nuclearity","New J. Chem.","2017","41","1","316","","10.1039/C6NJ02962K","","","0.7107","MoKα","","0.0613","0.0417","","","0.0743","0.0817","","","","","","1.046","","","","has coordinates","191715","2020-10-21","18:00:00",""
"7055867","11.83295","0.00018","39.2516","0.0005","16.362","0.0003","90","","99.3458","0.0014","90","","7498.7","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H38 N10 Ni2 O4 -","- C38 H38 N10 Ni2 O4 -","- C304 H304 N80 Ni16 O32 -","8","2","","Andrusenko, Elena V.; Kabin, Evgeniy V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Starova, Galina L.; Kukushkin, Vadim Yu.","Metal-mediated generation of triazapentadienate-terminated di- and trinuclear μ2-pyrazolate NiII species and control of their nuclearity","New J. Chem.","2017","41","1","316","","10.1039/C6NJ02962K","","","1.54184","CuKα","","0.058","0.0442","","","0.1091","0.1169","","","","","","1.046","","","","has coordinates","203412","2020-10-21","18:00:00",""
"7055868","9.8999","0.0005","5.7496","0.0003","11.1292","0.0005","90","","98.159","0.004","90","","627.07","0.05","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H16 N6 Ni O4 -","- C8 H16 N6 Ni O4 -","- C16 H32 N12 Ni2 O8 -","2","0.5","","Andrusenko, Elena V.; Kabin, Evgeniy V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Starova, Galina L.; Kukushkin, Vadim Yu.","Metal-mediated generation of triazapentadienate-terminated di- and trinuclear μ2-pyrazolate NiII species and control of their nuclearity","New J. Chem.","2017","41","1","316","","10.1039/C6NJ02962K","","","1.5418","CuKα","","0.036","0.0324","","","0.0962","0.0991","","","","","","1.142","","","","has coordinates","191715","2020-10-21","18:00:00",""
"7055869","13.6333","0.0012","14.8982","0.0004","11.0132","0.0005","90","","112.089","0.006","90","","2072.7","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H36 N14 Ni3 O4 -","- C36 H36 N14 Ni3 O4 -","- C72 H72 N28 Ni6 O8 -","2","0.5","","Andrusenko, Elena V.; Kabin, Evgeniy V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Starova, Galina L.; Kukushkin, Vadim Yu.","Metal-mediated generation of triazapentadienate-terminated di- and trinuclear μ2-pyrazolate NiII species and control of their nuclearity","New J. Chem.","2017","41","1","316","","10.1039/C6NJ02962K","","x-ray","1.54184","CuKα","","0.0648","0.0573","","","0.1746","0.1857","","","","","","1.053","","","","has coordinates,has disorder","191715","2020-10-21","18:00:00",""
"7055870","10.193","0.0006","10.5329","0.0006","26.0752","0.0018","85.312","0.004","82.9","0.004","64.441","0.004","2504.9","0.3","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","(E)-4-(4-(benzo[d]thiazol-2-yl)styryl)-N,N-diphenylaniline","","- C33 H24 N2 S -","- C33 H24 N1.6635 S0.6635 -","- C132 H96 N6.654 S2.654 -","4","2","","Zhan, Yong; Yang, Peng; Li, Gang; Zhang, Yuanyuan; Bao, Ying","Reversible piezofluorochromism of a triphenylamine-based benzothiazole derivative with a strong fluorescence response to volatile acid vapors","New J. Chem.","2017","41","1","263","","10.1039/C6NJ02735K","","","0.71073","MoKα","","0.1347","0.0656","","","0.1578","0.1989","","","","","","1.028","","","","has coordinates,has disorder","191716","2020-10-21","18:00:00",""
"7055871","3.8235","0.0016","16.595","0.007","9.641","0.004","90","","99.676","0.007","90","","603","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C3 H5 N5 O2 -","- C3 H5 N5 O2 -","- C12 H20 N20 O8 -","4","1","","Zhou, Tianhong; Li, Yanfeng; Xu, Kangzhen; Song, Jirong; Zhao, Fengqi","The new role of 1,1-diamino-2,2-dinitroethylene (FOX-7): two unexpected reactions","New J. Chem.","2017","41","1","168","","10.1039/C6NJ03370A","","","0.71073","MoKα","","0.0687","0.0493","","","0.1166","0.1283","","","","","","0.96","","","","has coordinates","191717","2020-10-21","18:00:00",""
"7055872","13.979","0.004","18.939","0.005","22.465","0.006","101.682","0.006","107.72","0.006","94.808","0.006","5480","3","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H76 Li4 N6 O3 Si2 -","- C48 H76 Li4 N6 O3 Si2 -","- C192 H304 Li16 N24 O12 Si8 -","4","2","","Li, Wei; Bai, Sheng-Di; Su, Feng; Yuan, Shi-Fang; Duan, Xin-E; Liu, Dian-Sheng","Zirconium complexes based on an ethylene linked amidinate‒amido ligand: synthesis, characterization and ethylene polymerization","New J. Chem.","2017","41","2","661","","10.1039/C6NJ02537D","","","0.71073","MoKα","","0.1822","0.0821","","","0.1929","0.2176","","","","","","1.086","","","","has coordinates,has disorder","191697","2020-10-21","18:00:00",""
"7055873","34.8268","0.0012","9.1327","0.0003","24.1978","0.0009","90","","107.572","0.001","90","","7337.3","0.4","194","2","194","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C36 H46 N6 Si2 Zr -","- C36 H46 N6 Si2 Zr -","- C288 H368 N48 Si16 Zr8 -","8","2","","Li, Wei; Bai, Sheng-Di; Su, Feng; Yuan, Shi-Fang; Duan, Xin-E; Liu, Dian-Sheng","Zirconium complexes based on an ethylene linked amidinate‒amido ligand: synthesis, characterization and ethylene polymerization","New J. Chem.","2017","41","2","661","","10.1039/C6NJ02537D","","","0.71073","MoKα","","0.0673","0.0467","","","0.0994","0.1088","","","","","","1.023","","","","has coordinates","191697","2020-10-21","18:00:00",""
"7055874","10.584","0.003","35.281","0.008","9.826","0.002","90","","101.664","0.005","90","","3593.4","1.5","194","2","194","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C26 H44 Cl4 Li N3 O2 Si Zr -","- C26 H44 Cl4 Li N3 O2 Si Zr -","- C104 H176 Cl16 Li4 N12 O8 Si4 Zr4 -","4","1","","Li, Wei; Bai, Sheng-Di; Su, Feng; Yuan, Shi-Fang; Duan, Xin-E; Liu, Dian-Sheng","Zirconium complexes based on an ethylene linked amidinate‒amido ligand: synthesis, characterization and ethylene polymerization","New J. Chem.","2017","41","2","661","","10.1039/C6NJ02537D","","","0.71073","MoKα","","0.1089","0.0647","","","0.123","0.1385","","","","","","1.067","","","","has coordinates,has disorder","191697","2020-10-21","18:00:00",""
"7055875","12.156","0.003","13.583","0.003","13.801","0.003","89.852","0.005","77.833","0.004","77.133","0.004","2169.3","0.9","194","2","194","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H64 Li4 N4 O3 Si2 -","- C34 H64 Li4 N4 O3 Si2 -","- C68 H128 Li8 N8 O6 Si4 -","2","1","","Li, Wei; Bai, Sheng-Di; Su, Feng; Yuan, Shi-Fang; Duan, Xin-E; Liu, Dian-Sheng","Zirconium complexes based on an ethylene linked amidinate‒amido ligand: synthesis, characterization and ethylene polymerization","New J. Chem.","2017","41","2","661","","10.1039/C6NJ02537D","","","0.71073","MoKα","","0.2153","0.131","","","0.3824","0.4519","","","","","","1.06","","","","has coordinates","191697","2020-10-21","18:00:00",""
"7055876","11.4347","0.0004","14.9823","0.0005","16.8734","0.0006","90","","96.583","0.001","90","","2871.66","0.17","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H56 Cl14 N6 Si2 Zr2 -","- C40 H56 Cl14 N6 Si2 Zr2 -","- C80 H112 Cl28 N12 Si4 Zr4 -","2","0.5","","Li, Wei; Bai, Sheng-Di; Su, Feng; Yuan, Shi-Fang; Duan, Xin-E; Liu, Dian-Sheng","Zirconium complexes based on an ethylene linked amidinate‒amido ligand: synthesis, characterization and ethylene polymerization","New J. Chem.","2017","41","2","661","","10.1039/C6NJ02537D","","","0.71073","MoKα","","0.0422","0.0382","","","0.0935","0.0978","","","","","","1.044","","","","has coordinates","191697","2020-10-21","18:00:00",""
"7055877","10.51","0.005","15.733","0.007","18.67","0.008","79.12","0.02","74.44","0.02","77.5","0.02","2875","2","296","2","296","","","","","","","","","5","P -1","-P 1","2","","","","- C45 H77 Mo2 N7 O12 -","- C45 H77 Mo2 N7 O12 -","- C90 H154 Mo4 N14 O24 -","2","1","","Maurya, Mannar R.; Rana, Lata; Avecilla, Fernando","Molybdenum complexes with a μ-O{MoO2}2 core: their synthesis, crystal structure and application as catalysts for the oxidation of bicyclic alcohols using N-based additives","New J. Chem.","2017","41","2","724","","10.1039/C6NJ03162E","","","0.71073","MOKα","","0.0929","0.0584","","","0.1758","0.2634","","","","","","1.067","","","","has coordinates","191700","2020-10-21","18:00:00",""
"7055878","11.6534","0.0003","39.0383","0.0012","12.9675","0.0004","90","","116.524","0.0013","90","","5278.4","0.3","100","2","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Mo2 N2 O11 S2 -","- C20 H26 Mo2 N2 O11 S2 -","- C160 H208 Mo16 N16 O88 S16 -","8","2","","Maurya, Mannar R.; Rana, Lata; Avecilla, Fernando","Molybdenum complexes with a μ-O{MoO2}2 core: their synthesis, crystal structure and application as catalysts for the oxidation of bicyclic alcohols using N-based additives","New J. Chem.","2017","41","2","724","","10.1039/C6NJ03162E","","","0.71073","MoKα","","0.0525","0.0431","","","0.0949","0.0985","","","","","","1.097","","","","has coordinates,has disorder","191700","2020-10-21","18:00:00",""
"7055879","21.595","0.003","11.459","0.018","26.335","0.004","90","","90","","90","","6517","10","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C32 H49 N5 Zr -","- C32 H49 N5 Zr -","- C256 H392 N40 Zr8 -","8","2","","Luconi, Lapo; Kissel, Alexander A.; Rossin, Andrea; Khamaletdinova, Nadiya M.; Cherkasov, Anton V.; Tuci, Giulia; Fukin, Georgy K.; Trifonov, Alexander A.; Giambastiani, Giuliano","C1 and Cs 2-pyridylethylanilido zirconium(iv), yttrium(iii) and lutetium(iii) complexes: synthesis, characterization and catalytic activity in the isoprene polymerization","New J. Chem.","2017","41","2","540","","10.1039/C6NJ03193E","","x-ray","1.5418","CuKα","","0.1195","0.0846","","","0.1838","0.2115","","","","","","1.062","","","","has coordinates","191703","2020-10-21","18:00:00",""
"7055880","11.693","0.008","17.076","0.011","18.712","0.015","90","","91.569","0.006","90","","3735","5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C39 H55 N5 Zr -","- C39 H55 N5 Zr -","- C156 H220 N20 Zr4 -","4","1","","Luconi, Lapo; Kissel, Alexander A.; Rossin, Andrea; Khamaletdinova, Nadiya M.; Cherkasov, Anton V.; Tuci, Giulia; Fukin, Georgy K.; Trifonov, Alexander A.; Giambastiani, Giuliano","C1 and Cs 2-pyridylethylanilido zirconium(iv), yttrium(iii) and lutetium(iii) complexes: synthesis, characterization and catalytic activity in the isoprene polymerization","New J. Chem.","2017","41","2","540","","10.1039/C6NJ03193E","","x-ray","0.71069","MoKα","","0.227","0.0836","","","0.1058","0.149","","","","","","0.968","","","","has coordinates","191703","2020-10-21","18:00:00",""
"7055881","10.2449","0.0007","18.0995","0.0012","26.6375","0.0019","90","","95.685","0.001","90","","4915","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H75 N2 O Si2 Y -","- C52 H75 N2 O Si2 Y -","- C208 H300 N8 O4 Si8 Y4 -","4","1","","Luconi, Lapo; Kissel, Alexander A.; Rossin, Andrea; Khamaletdinova, Nadiya M.; Cherkasov, Anton V.; Tuci, Giulia; Fukin, Georgy K.; Trifonov, Alexander A.; Giambastiani, Giuliano","C1 and Cs 2-pyridylethylanilido zirconium(iv), yttrium(iii) and lutetium(iii) complexes: synthesis, characterization and catalytic activity in the isoprene polymerization","New J. Chem.","2017","41","2","540","","10.1039/C6NJ03193E","","","0.71073","MoKα","","0.0575","0.0411","","","0.0966","0.1015","","","","","","1.03","","","","has coordinates","191703","2020-10-21","18:00:00",""
"7055882","13.9268","0.0003","8.7933","0.0002","13.3931","0.0003","90","","97.667","0.002","90","","1625.49","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 N5 O6 V -","- C14 H10 N5 O6 V -","- C56 H40 N20 O24 V4 -","4","1","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","0.71073","MoKα","","0.0437","0.0333","","","0.0873","0.0932","","","","","","1.044","","","","has coordinates","191699","2020-10-21","18:00:00",""
"7055883","7.8991","0.0001","8.1586","0.0001","12.3149","0.0002","74.517","0.001","85.174","0.001","64.596","0.001","690.463","0.018","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H10 N5 O6 V -","- C10 H10 N5 O6 V -","- C20 H20 N10 O12 V2 -","2","1","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","0.71073","MoKα","","0.0289","0.0264","","","0.074","0.0758","","","","","","1.037","","","","has coordinates","191699","2020-10-21","18:00:00",""
"7055884","9.2182","0.0002","11.9215","0.0003","14.0719","0.0003","90","","98.587","0.002","90","","1529.09","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 N7 O7 V -","- C10 H14 N7 O7 V -","- C40 H56 N28 O28 V4 -","4","1","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","0.71073","MoKα","","0.0375","0.0322","","","0.0849","0.0885","","","","","","1.075","","","","has coordinates","191699","2020-10-21","18:00:00",""
"7055885","5.019","0.0004","6.4793","0.0004","12.6014","0.0006","91.545","0.004","99.276","0.005","110.23","0.006","377.97","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 N4 O6 Zn -","- C14 H10 N4 O6 Zn -","- C14 H10 N4 O6 Zn -","1","0.5","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","0.71073","MoKα","","0.043","0.0365","","","0.0667","0.0706","","","","","","1.151","","","","has coordinates","191699","2020-10-21","18:00:00",""
"7055886","10.5093","0.0002","11.7016","0.0002","12.5825","0.0002","81.159","0.001","86.783","0.001","72.654","0.001","1459.34","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H26 N8 O4 Zn -","- C31 H26 N8 O4 Zn -","- C62 H52 N16 O8 Zn2 -","2","1","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","0.71073","MoKα","","0.0486","0.0434","","","0.1202","0.1271","","","","","","1.026","","","","has coordinates","191699","2020-10-21","18:00:00",""
"7055887","10.13","0.0001","11.4236","0.0002","17.9233","0.0003","90","","114.146","0.001","90","","1892.63","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H12 N6 O4 Zn -","- C19 H12 N6 O4 Zn -","- C76 H48 N24 O16 Zn4 -","4","1","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","1.54184","CuKα","","0.0334","0.0279","","","0.0688","0.0729","","","","","","1.06","","","","has coordinates","191699","2020-10-21","18:00:00",""
"7055888","19.2608","0.0004","7.1469","0.0001","17.3723","0.0004","90","","90","","90","","2391.38","0.08","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H16 N6 O4 Zn -","- C24 H16 N6 O4 Zn -","- C96 H64 N24 O16 Zn4 -","4","1","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","0.71073","MoKα","","0.0458","0.0342","","","0.0788","0.0849","","","","","","1.045","","","","has coordinates","191699","2020-10-21","18:00:00",""
"7055889","13.035","0.0003","29.0574","0.0007","20.4786","0.0005","90","","118.529","0.002","90","","6814.7","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H30 N6 O6 Zn -","- C35 H30 N6 O6 Zn -","- C280 H240 N48 O48 Zn8 -","8","2","","Koleša-Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Vanadium and zinc complexes of 5-cyanopicolinate and pyrazine derivatives: synthesis, structural elucidation and in vitro insulino-mimetic activity study","New J. Chem.","2017","41","2","735","","10.1039/C6NJ02961B","","","0.71073","MoKα","","0.0994","0.0585","","","0.1756","0.2059","","","","","","1.072","","","","has coordinates,has disorder","191699","2020-10-21","18:00:00",""
"7055890","11.906","0.005","13.462","0.005","15.476","0.005","69.79","0.005","83.07","0.005","89.517","0.005","2309.3","1.5","120","2","120.15","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H24 In N3 S6 -","- C18 H24 In N3 S6 -","- C72 H96 In4 N12 S24 -","4","2","","Ghosh, Abhisek Brata; Saha, Namrata; Sarkar, Arpita; Dutta, Amit Kumar; Maji, Swarup Kumar; Adhikary, Bibhutosh","Observation of enhanced photocurrent response in M‒CuInS2 (M = Au, Ag) heteronanostructures: phase selective synthesis and application","New J. Chem.","2017","41","2","692","","10.1039/C6NJ02439D","","","0.71073","MoKα","","0.0515","0.0358","","","0.0768","0.0827","","","","","","1.029","","","","has coordinates,has disorder","191704","2020-10-21","18:00:00",""
"7055891","10.6096","0.0007","12.9537","0.0008","14.5386","0.0009","84.106","0.002","72.903","0.002","72.028","0.002","1816.5","0.2","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H38 Cu N P2 S2 -","- C42 H38 Cu N P2 S2 -","- C84 H76 Cu2 N2 P4 S4 -","2","1","","Ghosh, Abhisek Brata; Saha, Namrata; Sarkar, Arpita; Dutta, Amit Kumar; Maji, Swarup Kumar; Adhikary, Bibhutosh","Observation of enhanced photocurrent response in M‒CuInS2 (M = Au, Ag) heteronanostructures: phase selective synthesis and application","New J. Chem.","2017","41","2","692","","10.1039/C6NJ02439D","","","0.71073","MoKα","","0.0702","0.0452","","","0.1171","0.1403","","","","","","1.023","","","","has coordinates","191704","2020-10-21","18:00:00",""
"7055892","7.9019","0.0005","9.722","0.0006","10.8821","0.0007","97.947","0.001","95.917","0.001","113.062","0.001","750.36","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H13 N O7 Zn -","- C16 H13 N O7 Zn -","- C32 H26 N2 O14 Zn2 -","2","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0398","0.0336","","","0.082","0.0857","","","","","","1.041","","","","has coordinates","191706","2020-10-21","18:00:00",""
"7055893","8.6847","0.0005","18.816","0.0011","14.1392","0.0009","90","","91.92","0.001","90","","2309.2","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 N3 O7 Zn -","- C26 H21 N3 O7 Zn -","- C104 H84 N12 O28 Zn4 -","4","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.055","0.035","","","0.0773","0.0829","","","","","","1.016","","","","has coordinates","191706","2020-10-21","18:00:00",""
"7055894","24.119","0.004","7.794","0.0012","18.09","0.003","90","","100.985","0.002","90","","3338.3","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H13 N2 O5 S0 Zn -","- C21 H13 N2 O5 Zn -","- C168 H104 N16 O40 Zn8 -","8","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0871","0.0409","","","0.0625","0.0683","","","","","","1.051","","","","has coordinates","191706","2020-10-21","18:00:00",""
"7055895","21.187","0.01","21.187","0.01","21.9","0.02","90","","90","","120","","8514","10","296","2","296","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C18 H20.5 Cu N1.5 O9 -","- C16 H11 Cu N O6 -","- C288 H198 Cu18 N18 O108 -","18","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0826","0.051","","","0.0992","0.1078","","","","","","0.947","","","","has coordinates,has disorder","191706","2020-10-21","18:00:00",""
"7055896","13.981","0.002","13.594","0.002","30.578","0.005","90","","93.477","0.003","90","","5800.9","1.5","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C68 H42 Cl2 Cu3 N8 O18 -","- C68 H42 Cl2 Cu3 N8 O18 -","- C272 H168 Cl8 Cu12 N32 O72 -","4","0.5","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0485","0.0362","","","0.0908","0.0961","","","","","","1.005","","","","has coordinates","191706","2020-10-21","18:00:00",""
"7055897","11.807","0.009","9.928","0.009","23.44","0.02","90","","97.668","0.015","90","","2723","4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C35 H34 Co N6 O6 -","- C29 H25 Co N3 O6 -","- C116 H100 Co4 N12 O24 -","4","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0783","0.0465","","","0.1042","0.1158","","","","","","1.066","","","","has coordinates,has disorder","191706","2020-10-21","18:00:00",""
"7055898","14.579","0.004","16.227","0.004","15.737","0.003","90","","117.599","0.018","90","","3299.3","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H36 Co N4 O11 -","- C32 H36 Co N4 O11 -","- C128 H144 Co4 N16 O44 -","4","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0602","0.0409","","","0.0974","0.1056","","","","","","1.057","","","","has coordinates","191706","2020-10-21","18:00:00",""
"7055899","9.5056","0.0004","37.3101","0.0015","14.736","0.0006","90","","96.305","0.001","90","","5194.6","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H46 N6 O15 S0 Zn2 -","- C57 H46 N6 O15 Zn2 -","- C228 H184 N24 O60 Zn8 -","4","1","","Li, Huijun; Wang, Yuan; He, Yaling; Xu, Zhouqing; Zhao, Xiaolei; Han, Yi","Synthesis of several novel coordination complexes: ion exchange, magnetic and photocatalytic studies","New J. Chem.","2017","41","3","1046","","10.1039/C6NJ02863B","","","0.71073","MoKα","","0.0967","0.0675","","","0.158","0.1671","","","","","","1.104","","","","has coordinates","191706","2020-10-21","18:00:00",""
"7055900","14.2129","0.0008","17.0556","0.001","26.872","0.0015","89.444","0.005","83.294","0.004","82.777","0.005","6418","0.6","140","1","140","1","","","","","","","","4","P -1","-P 1","2","","","","- C124 H114 Mn12 O47 -","- C124 H108 Mn12 O47 -","- C248 H216 Mn24 O94 -","2","1","","Kushch, Lyudmila A.; Kazakova, Anna V.; Mironova, Svetlana A.; Yagubskii, Eduard B.; Simonov, Sergey V.; Zorina, Leokadiya V.; Shibaeva, Rimma P.; Sadakov, Andrey V.; Mironov, Vladimir S.","A perylene complex with a one-dimensional coordination polymer containing [Mn6O2(CHCl2COO)10(H2O)2] cluster units linked by 3,10-perylenequinone bridges","New J. Chem.","2017","41","2","793","","10.1039/C6NJ03097A","","","0.71073","MoKα","","0.1903","0.0559","","","0.061","0.0691","","","","","","0.916","","","","has coordinates,has disorder","191702","2020-10-21","18:00:00",""
"7055901","19.829","0.0018","23.556","0.004","23.62","0.002","109.625","0.003","111.342","0.002","98.625","0.003","9202","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C100 H52 Cl40 Mn12 O52 -","- C100 H52 Cl40 Mn12 O52 -","- C200 H104 Cl80 Mn24 O104 -","2","1","","Kushch, Lyudmila A.; Kazakova, Anna V.; Mironova, Svetlana A.; Yagubskii, Eduard B.; Simonov, Sergey V.; Zorina, Leokadiya V.; Shibaeva, Rimma P.; Sadakov, Andrey V.; Mironov, Vladimir S.","A perylene complex with a one-dimensional coordination polymer containing [Mn6O2(CHCl2COO)10(H2O)2] cluster units linked by 3,10-perylenequinone bridges","New J. Chem.","2017","41","2","793","","10.1039/C6NJ03097A","","","0.71073","MoKα","","0.3007","0.0961","","","0.1816","0.2168","","","","","","1.012","","","","has coordinates,has disorder","191702","2020-10-21","18:00:00",""
"7055902","9.4863","0.0006","10.0848","0.0006","13.3834","0.0009","110.202","0.003","91.71","0.003","112.977","0.002","1085.99","0.12","293","","293","","","","","","","","","5","P -1","-P 1","2","RT-L4F","2'-(4-fluorophenyl)-1'-nitro-1',2',5',6',7',7a'-hexahydrospiro[indeno[1,2-b]quinoxaline-11,3'-pyrrolizine]","","- C27 H21 F N4 O2 -","- C27 H21 F N4 O2 -","- C54 H42 F2 N8 O4 -","2","1","","Akondi, Adinarayana Murthy; Mekala, Sowmya; Kantam, Mannepalli Lakshmi; Trivedi, Rajiv; Raju Chowhan, L.; Das, Amitava","An expedient microwave assisted regio- and stereoselective synthesis of spiroquinoxaline pyrrolizine derivatives and their AChE inhibitory activity","New J. Chem.","2017","41","2","873","","10.1039/C6NJ02869A","","","0.71075","MoKα","","","0.0453","","","","0.1289","","","","","","0.997","","","","has coordinates","191696","2020-10-21","18:00:00",""
"7055903","7.79","0.0004","5.2518","0.0003","18.107","0.001","90","","92.039","0.003","90","","740.32","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","gmma","","- C16 H16 N2 S2 -","- C16 H16 N2 S2 -","- C32 H32 N4 S4 -","2","0.5","","Saha, Pinaki; Samanta, Debasish; Ghosh, Prasanta","Glyoxalbis(2-methylmercaptoanil) complexes of nickel and ruthenium: radical versus non-radical states","New J. Chem.","2017","41","3","1149","","10.1039/C6NJ02903E","","","0.71073","MoKα","","0.0545","0.0409","","","0.1043","0.1142","","","","","","0.969","","","","has coordinates","191707","2020-10-21","18:00:00",""
"7055904","18.1597","0.0019","16.2161","0.0018","6.9479","0.0007","90","","90","","90","","2046","0.4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","1_CH2Cl2","","- C17 H18 Cl4 N2 Ni S2 -","- C17 H18 Cl4 N2 Ni S2 -","- C68 H72 Cl16 N8 Ni4 S8 -","4","0.5","","Saha, Pinaki; Samanta, Debasish; Ghosh, Prasanta","Glyoxalbis(2-methylmercaptoanil) complexes of nickel and ruthenium: radical versus non-radical states","New J. Chem.","2017","41","3","1149","","10.1039/C6NJ02903E","","","0.71073","MoKα","","0.0313","0.0271","","","0.0725","0.0752","","","","","","0.971","","","","has coordinates","191707","2020-10-21","18:00:00",""
"7055905","7.4899","0.0003","24.1677","0.0008","19.6549","0.0007","90","","100.84","0.001","90","","3494.3","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Cl2 N2 Ru S2 -","- C16 H16 Cl2 N2 Ru S2 -","- C128 H128 Cl16 N16 Ru8 S16 -","8","2","","Saha, Pinaki; Samanta, Debasish; Ghosh, Prasanta","Glyoxalbis(2-methylmercaptoanil) complexes of nickel and ruthenium: radical versus non-radical states","New J. Chem.","2017","41","3","1149","","10.1039/C6NJ02903E","","","0.71073","MoKα","","0.0666","0.0402","","","0.0788","0.0895","","","","","","1.135","","","","has coordinates","191707","2020-10-21","18:00:00",""
"7055906","19.963","0.005","19.963","0.005","15.819","0.005","90","","90","","120","","5460","3","273","2","273","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C34 H33 Cl2 N2 O P Ru S2 -","- C34 H31 Cl2 N2 O P Ru S2 -","- C204 H186 Cl12 N12 O6 P6 Ru6 S12 -","6","0.5","","Saha, Pinaki; Samanta, Debasish; Ghosh, Prasanta","Glyoxalbis(2-methylmercaptoanil) complexes of nickel and ruthenium: radical versus non-radical states","New J. Chem.","2017","41","3","1149","","10.1039/C6NJ02903E","","","0.71073","MoKα","","0.0704","0.0532","","","0.1523","0.1773","","","","","","1.061","","","","has coordinates,has disorder","191707","2020-10-21","18:00:00",""
"7055907","29.476","","6.975","","13.591","","90","","112.53","","90","","2580.98","","120","2","120","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","2-amino-chalcone","(E)-1-(2-aminophenyl)-3-(3-bromo-5-hydroyphenyl)-prop-2-en-1-one","","- C15 H12 Br N O2 -","- C15 H12 Br N O2 -","- C120 H96 Br8 N8 O16 -","8","1","","Almeida, Leonardo R.; Anjos, Murilo M.; Ribeiro, Gabriela C.; Valverde, Clodoaldo; Machado, Daniel F. S.; Oliveira, Guilherme R.; Napolitano, Hamilton B.; de Oliveira, Heibbe C. B.","Synthesis, structural characterization and computational study of a novel amino chalcone: a potential nonlinear optical material","New J. Chem.","2017","41","4","1744","","10.1039/C5NJ03214H","","x-ray","0.71073","MoKα","","0.0194","0.0178","","","0.046","0.047","","","","","","1.084","","","","has coordinates","193877","2020-10-21","18:00:00",""
"7055908","9.8852","0.0005","16.8825","0.0009","8.172","0.0004","90","","93.423","0.002","90","","1361.37","0.12","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H20 Co O9 -","- C8 H18 Co O9 -","- C32 H72 Co4 O36 -","4","1","","Li, Zhong-Yi; Cao, Yuan-Qing; Zhang, Xiang-Ming; Xu, Ya-Lan; Cao, Guang-Xiu; Zhang, Fu-Li; Li, Su-Zhi; Zhang, Fu-Qiang; Zhai, Bin","Linking cobalt‒water chains with cis-1,4-cyclohexanedicarboxylate bridges to form a 2D network exhibiting spin-canted antiferromagnetism","New J. Chem.","2017","41","2","457","","10.1039/C6NJ03278H","","","0.71073","MoKα","","0.0815","0.0676","","","0.1911","0.1984","","","","","","1.058","","","","has coordinates,has disorder","191698","2020-10-21","18:00:00",""
"7055909","5.9313","0.0006","25.036","0.003","8.5659","0.0009","90","","93.723","0.004","90","","1269.3","0.2","172","2","172","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 N8 O8 -","- C7 H6 N8 O8 -","- C28 H24 N32 O32 -","4","1","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Lin, Qiuhan; Yang, Hongwei","Compounds based on 3-amino-4-(5-methyl-1,2,4-oxadiazol-3-yl)furazan as insensitive energetic materials","New J. Chem.","2017","41","3","1202","","10.1039/C6NJ03333D","","","0.71073","MoKα","","0.0916","0.0426","","","0.0783","0.0922","","","","","","1.021","","","","has coordinates","191714","2020-10-21","18:00:00",""
"7055910","7.6336","0.0009","3.8428","0.0005","32.115","0.004","90","","90.568","0.005","90","","942","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 N6 Na O5 -","- C5 H5 N6 Na O5 -","- C20 H20 N24 Na4 O20 -","4","1","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Lin, Qiuhan; Yang, Hongwei","Compounds based on 3-amino-4-(5-methyl-1,2,4-oxadiazol-3-yl)furazan as insensitive energetic materials","New J. Chem.","2017","41","3","1202","","10.1039/C6NJ03333D","","","0.71073","MoKα","","0.1143","0.0636","","","0.1371","0.1548","","","","","","1.049","","","","has coordinates","191714","2020-10-21","18:00:00",""
"7055911","8.3172","0.001","7.226","0.001","14.148","0.002","90","","90","","90","","850.3","0.2","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C5 H4 N6 O4 -","- C5 H4 N6 O4 -","- C20 H16 N24 O16 -","4","1","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Lin, Qiuhan; Yang, Hongwei","Compounds based on 3-amino-4-(5-methyl-1,2,4-oxadiazol-3-yl)furazan as insensitive energetic materials","New J. Chem.","2017","41","3","1202","","10.1039/C6NJ03333D","","","0.71073","MoKα","","0.0466","0.0314","","","0.0621","0.0686","","","","","","1.039","","","","has coordinates","191714","2020-10-21","18:00:00",""
"7055912","32.485","0.007","4.054","0.0008","14.208","0.003","90","","98.098","0.008","90","","1852.5","0.7","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C5 H7 N7 O5 -","- C5 H7 N7 O5 -","- C40 H56 N56 O40 -","8","1","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Lin, Qiuhan; Yang, Hongwei","Compounds based on 3-amino-4-(5-methyl-1,2,4-oxadiazol-3-yl)furazan as insensitive energetic materials","New J. Chem.","2017","41","3","1202","","10.1039/C6NJ03333D","","","0.71073","MoKα","","0.0833","0.0455","","","0.0905","0.1052","","","","","","1.036","","","","has coordinates","191714","2020-10-21","18:00:00",""
"7055913","8.0321","0.0008","8.2137","0.0008","10.1222","0.0009","73.271","0.003","80.987","0.003","65.449","0.003","581.19","0.1","172","2","172","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H10 N10 O4 -","- C6 H10 N10 O4 -","- C12 H20 N20 O8 -","2","1","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Lin, Qiuhan; Yang, Hongwei","Compounds based on 3-amino-4-(5-methyl-1,2,4-oxadiazol-3-yl)furazan as insensitive energetic materials","New J. Chem.","2017","41","3","1202","","10.1039/C6NJ03333D","","","0.71073","MoKα","","0.0781","0.0426","","","0.0892","0.103","","","","","","1.021","","","","has coordinates","191714","2020-10-21","18:00:00",""
"7055914","24.8882","0.0011","9.1632","0.0004","33.9677","0.0012","90","","101.789","0.004","90","","7583.1","0.6","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C78 H57 Cl4 Fe2 N15 O22 -","- C78 H57 Cl4 Fe2 N15 O22 -","- C312 H228 Cl16 Fe8 N60 O88 -","4","0.5","","Shee, Nirmal K.; Drew, Michael G. B.; Datta, Dipankar","Isolation of a metal-to-ligand charge-transfer (MLCT) state of a tris 1,4-diimine complex of iron in the solid state: X-ray crystal structure and EPR","New J. Chem.","2017","41","2","452","","10.1039/C6NJ02874H","","","0.71073","MoKα","","0.2166","0.0695","","","0.1536","0.2","","","","","","0.832","","","","has coordinates,has disorder","191695","2020-10-21","18:00:00",""
"7055915","8.979","0.0003","15.1223","0.0005","15.7117","0.0008","90","","100.137","0.004","90","","2100.08","0.15","175","","175","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-Bis(2,4,6-trimethylphenyl)-4,5-trans-dimethyl]imidazolidinium chloride","","- C23 H31 Cl N2 -","- C23 H31 Cl N2 -","- C92 H124 Cl4 N8 -","4","1","","Beillard, Audrey; Bantreil, Xavier; Métro, Thomas-Xavier; Martinez, Jean; Lamaty, Frédéric","Mechanochemistry for facilitated access to N,N-diaryl NHC metal complexes","New J. Chem.","2017","41","3","1057","","10.1039/C6NJ02895K","","","1.54184","CuKα","","0.0751","0.0678","","0.072","0.0709","0.0709","","","","","","1.0241","","","","has coordinates","191708","2020-10-21","18:00:00",""
"7055916","9.6949","0.0008","16.3365","0.0019","12.523","0.0001","90","","96.097","0.008","90","","1972.2","0.3","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H18 N2 O -","- C28 H18 N2 O -","- C112 H72 N8 O4 -","4","2","","Samanta, Soham; Manna, Utsab; Das, Gopal","White-light emission from simple AIE‒ESIPT-excimer tripled single molecular system","New J. Chem.","2017","41","3","1064","","10.1039/C6NJ03070J","","","0.71073","MoKα","","0.174","0.1277","","","0.3054","0.3615","","","","","","1.189","","","","has coordinates","191709","2020-10-21","18:00:00",""
"7055917","11.974","0.0002","14.1021","0.0002","17.2015","0.0004","102.505","0.0007","101.119","0.0007","106.199","0.0007","2621.9","0.09","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C112.5 H117 B2 Cl Ni2 O4 P6 S4 -","- C112.5 H117 B2 Cl Ni2 O4 P6 S4 -","- C112.5 H117 B2 Cl Ni2 O4 P6 S4 -","1","0.5","","Yadav, Reena; Singh, Ashish Kumar; Waghadkar, Yogesh; Kociok-Köhn, Gabriele; Kumar, Abhinav; Chauhan, Ratna; Rane, Sunit; Gosavi, Suresh","1,2-Bis(diphenylphosphino)ethane nickel(ii) O,O′-dialkyldithiophosphates as potential precursors for nickel sulfides","New J. Chem.","2017","41","3","1327","","10.1039/C6NJ03186B","","","0.71073","MoKα","","0.066","0.0452","","","0.0963","0.1034","","","","","","1.112","","","","has coordinates","191710","2020-10-21","18:00:00",""
"7055918","9.5117","0.0001","17.2102","0.0002","22.5279","0.0003","90","","100.921","0.0007","90","","3620.99","0.07","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H38 F6 Ni O2 P4 S2 -","- C32 H38 F6 Ni O2 P4 S2 -","- C128 H152 F24 Ni4 O8 P16 S8 -","4","1","","Yadav, Reena; Singh, Ashish Kumar; Waghadkar, Yogesh; Kociok-Köhn, Gabriele; Kumar, Abhinav; Chauhan, Ratna; Rane, Sunit; Gosavi, Suresh","1,2-Bis(diphenylphosphino)ethane nickel(ii) O,O′-dialkyldithiophosphates as potential precursors for nickel sulfides","New J. Chem.","2017","41","3","1327","","10.1039/C6NJ03186B","","","0.71073","MoKα","","0.0802","0.0593","","","0.1291","0.137","","","","","","1.115","","","","has coordinates","191710","2020-10-21","18:00:00",""
"7055919","14.2516","0.0002","18.8126","0.0002","18.1568","0.0003","90","","100.694","0.0006","90","","4783.46","0.12","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H54 B Ni O2 P3 S2 -","- C54 H54 B Ni O2 P3 S2 -","- C216 H216 B4 Ni4 O8 P12 S8 -","4","1","","Yadav, Reena; Singh, Ashish Kumar; Waghadkar, Yogesh; Kociok-Köhn, Gabriele; Kumar, Abhinav; Chauhan, Ratna; Rane, Sunit; Gosavi, Suresh","1,2-Bis(diphenylphosphino)ethane nickel(ii) O,O′-dialkyldithiophosphates as potential precursors for nickel sulfides","New J. Chem.","2017","41","3","1327","","10.1039/C6NJ03186B","","","0.71073","MoKα","","0.0823","0.0454","","","0.0849","0.0965","","","","","","1.035","","","","has coordinates","191710","2020-10-21","18:00:00",""
"7055920","6.8322","0.0002","11.3756","0.0004","12.59","0.0004","79.412","0.002","89.08","0.002","75.553","0.002","930.97","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 H12 Cu3 N22 -","- C4 H12 Cu3 N22 -","- C8 H24 Cu6 N44 -","2","1","","Zeng, Ying; Liu, Sui-Jun; Liu, Cai-Ming; Xie, Yong-Rong; Du, Zi-Yi","Diversified magnetic behaviors of new nickel(ii) and copper(ii) azido coordination polymers templated by diethyl or triethyl amines","New J. Chem.","2017","41","3","1212","","10.1039/C6NJ03268K","","","0.71073","MoKα","","0.0275","0.0252","","","0.065","0.0666","","","","","","1.014","","","","has coordinates","191712","2020-10-21","18:00:00",""
"7055921","10.404","0.0008","7.9731","0.0006","13.5232","0.001","90","","97.113","0.001","90","","1113.14","0.15","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H16 N8 Ni -","- C6 H16 N8 Ni -","- C24 H64 N32 Ni4 -","4","1","","Zeng, Ying; Liu, Sui-Jun; Liu, Cai-Ming; Xie, Yong-Rong; Du, Zi-Yi","Diversified magnetic behaviors of new nickel(ii) and copper(ii) azido coordination polymers templated by diethyl or triethyl amines","New J. Chem.","2017","41","3","1212","","10.1039/C6NJ03268K","","","0.71073","MoKα","","0.0282","0.0219","","","0.0523","0.0549","","","","","","1.011","","","","has coordinates","191712","2020-10-21","18:00:00",""
"7055922","8.6636","0.0006","11.8031","0.0008","11.9525","0.0008","91.65","0.001","94.884","0.001","91.011","0.001","1217.04","0.14","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H16 Cu4 N28 -","- C6 H16 Cu4 N28 -","- C12 H32 Cu8 N56 -","2","1","","Zeng, Ying; Liu, Sui-Jun; Liu, Cai-Ming; Xie, Yong-Rong; Du, Zi-Yi","Diversified magnetic behaviors of new nickel(ii) and copper(ii) azido coordination polymers templated by diethyl or triethyl amines","New J. Chem.","2017","41","3","1212","","10.1039/C6NJ03268K","","","0.71073","MoKα","","0.0208","0.0184","","","0.0458","0.0469","","","","","","1.057","","","","has coordinates","191712","2020-10-21","18:00:00",""
"7055923","5.536","0.005","10.628","0.005","11.77","0.005","90","","90","","90","","692.5","0.8","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- H4 Ni O8 V2 -","- H4 Ni O8 V2 -","- H16 Ni4 O32 V8 -","4","0.5","","Li, Ning; Zhang, Zhong; Liu, Yiwei; Lu, Ying; He, Danfeng; Xu, Li; Zhong, Xiahua; Liu, Shuxia","Magnetic and luminescence properties of an inorganic 3D nickel‒vanadium bimetallic framework","New J. Chem.","2017","41","3","1245","","10.1039/C6NJ03413F","","","0.71069","MoKα","","0.0212","0.0205","","","0.0471","0.0475","","","","","","1.008","","","","has coordinates","191713","2020-10-21","18:00:00",""
"7055924","10.406","0.0004","27.2442","0.0009","13.1722","0.0005","90","","102.395","0.001","90","","3647.3","0.2","296","2","296.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C3.52 H2.55 Cd0.36 N0.12 O2.3 Si0.12 -","- C3.51515 H2.54545 Cd0.363636 N0.121212 O2.30303 Si0.121212 -","- C116 H84 Cd12 N4 O76 Si4 -","33","8.25","","Tian, Hong-Rui; Gao, Chao-Ying; Yang, Yang; Ai, Jing; Liu, Chao; Xu, Zhen-Guo; Sun, Zhong-Ming","A microporous Cd-MOF based on a hexavalent silicon-centred connector and luminescence sensing of small molecules","New J. Chem.","2017","41","3","1137","","10.1039/C6NJ03470E","","","0.71073","MoKα","","0.0385","0.0318","","","0.0817","0.0848","","","","","","1.07","","","","has coordinates","191711","2020-10-21","18:00:00",""
"7055925","17.3071","0.0006","17.3071","0.0006","28.5287","0.0012","90","","90","","90","","8545.4","0.6","100","2","100","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C122 H186 Cu2 N24 O43 S13 -","- C104 H88 Cu2 N24 O20 S4 -","- C208 H176 Cu4 N48 O40 S8 -","2","0.125","","Adarsh, N. N.; Chakraborty, Amarnath; Tarrés, Màrius; Dey, Surjendu; Novio, Fernando; Chattopadhyay, Basab; Ribas, Xavi; Ruiz-Molina, Daniel","Ligand and solvent effects in the formation and self-assembly of a metallosupramolecular cage","New J. Chem.","2017","41","3","1179","","10.1039/C6NJ03456J","","","0.71073","MoKα","","0.0787","0.0677","","","0.1993","0.2113","","","","","","0.97","","","","has coordinates","191705","2020-10-21","18:00:00",""
"7055926","14.456","0.005","20.541","0.007","22.843","0.009","73.881","0.009","79.477","0.01","88.62","0.009","6404","4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C108 H146 Cu2 N24 O37 S2 -","- C108 Cu2 N24 O29 S2 -","- C216 Cu4 N48 O58 S4 -","2","1","","Adarsh, N. N.; Chakraborty, Amarnath; Tarrés, Màrius; Dey, Surjendu; Novio, Fernando; Chattopadhyay, Basab; Ribas, Xavi; Ruiz-Molina, Daniel","Ligand and solvent effects in the formation and self-assembly of a metallosupramolecular cage","New J. Chem.","2017","41","3","1179","","10.1039/C6NJ03456J","","","0.71073","MoKα","","0.1235","0.0964","","","0.2381","0.2596","","","","","","1.09","","","","has coordinates","191705","2020-10-21","18:00:00",""
"7055927","12.979","0.004","8.793","0.002","16.272","0.005","90","","111.842","0.008","90","","1723.7","0.9","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H32 Cl2 Cu3 N4 O12 -","- C32 H32 Cl2 Cu3 N4 O12 -","- C64 H64 Cl4 Cu6 N8 O24 -","2","0.5","","Das, Sanju; Sarkar, Yeasmin; Majumder, Rini; Mukherjee, Santanu; Bandyopadhyay, Jaya; Ray, Ambarish; Parui, Partha Pratim","A unique cysteine selective water soluble fluorescent probe operable in multiple sensing cycles for the detection of biogenic cysteine in multicellular living species","New J. Chem.","2017","41","4","1488","","10.1039/C6NJ03291E","","","0.71073","MoKα","","0.0439","0.0365","","","0.1074","0.1208","","","","","","1.149","","","","has coordinates","193880","2020-10-21","18:00:00",""
"7055928","15.879","0.003","9.6304","0.0017","17.698","0.003","90","","111.401","0.003","90","","2519.8","0.8","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H29 F3 N2 O3 S -","- C24 H29 F3 N2 O3 S -","- C96 H116 F12 N8 O12 S4 -","4","1","","Zhang, Caiyun; Zhang, Fan; Lv, Shichang; Shi, Min; Zhang, Jun","Facile syntheses of N-heterocyclic carbene precursors through Cu(ii)- or Ag(i)-catalyzed amination of N-alkynyl formamidines","New J. Chem.","2017","41","5","1889","","10.1039/C6NJ03276A","","","0.71073","MoKα","","0.1089","0.0738","","","0.2176","0.2508","","","","","","1.026","","","","has coordinates","193870","2020-10-21","18:00:00",""
"7055929","20.338","0.007","16.179","0.005","21.087","0.007","90","","90","","90","","6939","4","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C30 H41 Cl2 F3 N2 O3 S -","- C30 H41 Cl2 F3 N2 O3 S -","- C240 H328 Cl16 F24 N16 O24 S8 -","8","1","","Zhang, Caiyun; Zhang, Fan; Lv, Shichang; Shi, Min; Zhang, Jun","Facile syntheses of N-heterocyclic carbene precursors through Cu(ii)- or Ag(i)-catalyzed amination of N-alkynyl formamidines","New J. Chem.","2017","41","5","1889","","10.1039/C6NJ03276A","","","0.71073","MoKα","","0.1718","0.073","","","0.1881","0.2294","","","","","","0.911","","","","has coordinates","193870","2020-10-21","18:00:00",""
"7055930","11.655","0.005","9.012","0.004","12.686","0.005","90","","115.981","0.004","90","","1197.8","0.9","196","2","196","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","methylpyrrolidinium salicylate","","- C12 H17 N O3 -","- C12 H17 N O3 -","- C48 H68 N4 O12 -","4","1","","Zavgorodnya, Oleksandra; Shamshina, Julia L.; Mittenthal, Max; McCrary, Parker D.; Rachiero, Giovanni P.; Titi, Hatem M.; Rogers, Robin D.","Polyethylene glycol derivatization of the non-active ion in active pharmaceutical ingredient ionic liquids enhances transdermal delivery","New J. Chem.","2017","41","4","1499","","10.1039/C6NJ03709G","","","0.71073","MoKα","","0.0627","0.0506","","","0.1395","0.1509","","","","","","1.037","","","","has coordinates","193875","2020-10-21","18:00:00",""
"7055931","8.2203","0.0003","17.0001","0.0007","21.4579","0.0008","72.425","0.004","85","0.003","84.651","0.003","2840.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H28 Au Br N2 O4 -","- C30 H28 Au Br N2 O4 -","- C120 H112 Au4 Br4 N8 O16 -","4","2","","Rendón-Nava, David; Mendoza-Espinosa, Daniel; Negrón-Silva, Guillermo E.; Téllez-Arreola, José Luis; Martínez-Torres, Ataúlfo; Valdez-Calderón, Alejandro; González-Montiel, Simplicio","Chrysin functionalized NHC‒Au(i) complexes: synthesis, characterization and effects on the nematode Caenorhabditis elegans","New J. Chem.","2017","41","5","2013","","10.1039/C6NJ03299K","","","1.54178","CuKα","","0.0554","0.0449","","","0.1207","0.1305","","","","","","1.041","","","","has coordinates","193873","2020-10-21","18:00:00",""
"7055932","9.1831","0.0006","10.8161","0.0006","29.4087","0.0015","90","","91.0802","0.0013","90","","2920.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H30 Au Br N2 O4 -","- C31 H30 Au Br N2 O4 -","- C124 H120 Au4 Br4 N8 O16 -","4","1","","Rendón-Nava, David; Mendoza-Espinosa, Daniel; Negrón-Silva, Guillermo E.; Téllez-Arreola, José Luis; Martínez-Torres, Ataúlfo; Valdez-Calderón, Alejandro; González-Montiel, Simplicio","Chrysin functionalized NHC‒Au(i) complexes: synthesis, characterization and effects on the nematode Caenorhabditis elegans","New J. Chem.","2017","41","5","2013","","10.1039/C6NJ03299K","","","1.54178","CuKα","","0.048","0.0419","","","0.1117","0.1169","","","","","","1.083","","","","has coordinates","193873","2020-10-21","18:00:00",""
"7055933","10.7343","0.0006","11.1683","0.0006","14.4997","0.0012","106.064","0.005","102.815","0.005","104.401","0.004","1537.03","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H68 Cl14 N6 O12 Ti3 -","- C34 H68 Cl14 N6 O12 Ti3 -","- C34 H68 Cl14 N6 O12 Ti3 -","1","0.5","","Bortoluzzi, Marco; Bresciani, Giulio; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Synthesis and structural characterization of mixed halide‒N,N-diethylcarbamates of group 4 metals, including a case of unusual tetrahydrofuran activation","New J. Chem.","2017","41","4","1781","","10.1039/C6NJ03489F","","","0.71073","MoKα","","0.0846","0.0428","","","0.0886","0.1075","","","","","","1.02","","","","has coordinates","193876","2020-10-21","18:00:00",""
"7055934","8.6586","0.0009","13.0597","0.0014","14.2197","0.0015","82.059","0.008","76.615","0.007","78.133","0.007","1523.9","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H90 Cl10 N20 Ti -","- C34 H90 Cl10 N20 Ti -","- C34 H90 Cl10 N20 Ti -","1","0.5","","Bortoluzzi, Marco; Bresciani, Giulio; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Synthesis and structural characterization of mixed halide‒N,N-diethylcarbamates of group 4 metals, including a case of unusual tetrahydrofuran activation","New J. Chem.","2017","41","4","1781","","10.1039/C6NJ03489F","","","0.71073","MoKα","","0.117","0.0869","","","0.226","0.2456","","","","","","1.106","","","","has coordinates","193876","2020-10-21","18:00:00",""
"7055935","11.5959","0.0012","18.794","0.002","14.538","0.0016","90","","102.888","0.003","90","","3088.5","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H74 Cl4 Hf4 N6 O18 -","- C38 H74 Cl4 Hf4 N6 O18 -","- C76 H148 Cl8 Hf8 N12 O36 -","2","0.5","","Bortoluzzi, Marco; Bresciani, Giulio; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","Synthesis and structural characterization of mixed halide‒N,N-diethylcarbamates of group 4 metals, including a case of unusual tetrahydrofuran activation","New J. Chem.","2017","41","4","1781","","10.1039/C6NJ03489F","","","0.71073","MoKα","","0.0935","0.0635","","","0.151","0.1701","","","","","","1.024","","","","has coordinates,has disorder","193876","2020-10-21","18:00:00",""
"7055936","23.112","0.006","9.1","0.002","19.022","0.005","90","","99.852","0.005","90","","3941.7","1.7","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H23 B F24 N2 -","- C38 H23 B F24 N2 -","- C152 H92 B4 F96 N8 -","4","0.5","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71075","MoKα","","0.0857","0.0769","","","0.2055","0.2144","","","","","","1.043","","","","has coordinates,has disorder","193878","2020-10-21","18:00:00",""
"7055937","23.113","0.015","9.231","0.006","19.075","0.012","90","","100.128","0.011","90","","4006","4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H25 B F24 N2 -","- C39 H25 B F24 N2 -","- C156 H100 B4 F96 N8 -","4","0.5","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71075","MoKα","","0.1232","0.0877","","","0.136","0.1516","","","","","","1.171","","","","has coordinates,has disorder","193878","2020-10-21","18:00:00",""
"7055938","18.901","0.009","13.222","0.007","16.877","0.009","90","","97.131","0.01","90","","4185","4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H31 B F24 N2 -","- C42 H31 B F24 N2 -","- C168 H124 B4 F96 N8 -","4","1","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71073","MoKα","","0.1188","0.083","","","0.1579","0.1797","","","","","","1.128","","","","has coordinates","193878","2020-10-21","18:00:00",""
"7055939","16.4634","0.001","17.5859","0.001","18.2282","0.0013","110.823","0.008","103.281","0.007","110.957","0.008","4203.9","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H32 B F24 N -","- C41 H32 B F24 N -","- C164 H128 B4 F96 N4 -","4","2","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71075","MoKα","","0.1608","0.0824","","","0.1619","0.1947","","","","","","1.026","","","","has coordinates,has disorder","193878","2020-10-21","18:00:00",""
"7055940","12.2647","0.0005","13.6343","0.0005","14.9811","0.0005","76.854","0.003","75.421","0.003","67.846","0.004","2220.82","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H27 B Cl2 F24 N2 -","- C43 H27 B Cl2 F24 N2 -","- C86 H54 B2 Cl4 F48 N4 -","2","1","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71075","MoKα","","0.0911","0.0729","","","0.2019","0.2187","","","","","","1.019","","","","has coordinates,has disorder","193878","2020-10-21","18:00:00",""
"7055941","18.685","0.003","17.676","0.002","19.68","0.003","90","","118.318","0.002","90","","5722","1.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C59 H49 B F24 N2 -","- C59 H49 B F24 N2 -","- C236 H196 B4 F96 N8 -","4","1","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71075","MoKα","","0.0707","0.0454","","","0.1103","0.1206","","","","","","0.988","","","","has coordinates,has disorder","193878","2020-10-21","18:00:00",""
"7055942","11.724","0.004","15.811","0.005","18.68","0.006","90","","99.958","0.005","90","","3410.5","1.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H11 Al F36 N2 O4 -","- C22 H11 Al F36 N2 O4 -","- C88 H44 Al4 F144 N8 O16 -","4","1","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71075","MoKα","","0.0643","0.0552","","","0.1003","0.104","","","","","","1.201","","","","has coordinates,has disorder","193878","2020-10-21","18:00:00",""
"7055943","9.544","0.005","12.396","0.007","15.641","0.009","88.23","0.02","82.22","0.019","78.052","0.019","1793.7","1.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H13 Al F36 N2 O4 -","- C23 H13 Al F36 N2 O4 -","- C46 H26 Al2 F72 N4 O8 -","2","1","","Levason, William; Pugh, David; Reid, Gillian","Imidazolium-based ionic liquids with large weakly coordinating anions","New J. Chem.","2017","41","4","1677","","10.1039/C6NJ03674K","","","0.71075","MoKα","","0.1015","0.0685","","","0.1262","0.1426","","","","","","1.155","","","","has coordinates,has disorder","193878","2020-10-21","18:00:00",""
"7055944","8.48","0.0017","25.563","0.005","9.97","0.002","90","","99.16","0.03","90","","2133.7","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 N O4 -","- C25 H27 N O4 -","- C100 H108 N4 O16 -","4","1","","Voskressensky, Leonid G.; Titov, Alexander A.; Dzhankaziev, Maksad S.; Borisova, Tatiana N.; Kobzev, Maxim S.; Dorovatovskii, Pavel V.; Khrustalev, Victor N.; Aksenov, Alexander V.; Varlamov, Alexey V.","First synthesis of heterocyclic allenes ‒ benzazecine derivatives","New J. Chem.","2017","41","5","1902","","10.1039/C6NJ03403A","","","0.9699","synchrotron","","0.0594","0.0477","","","0.1247","0.134","","","","","","1.055","","","","has coordinates","193868","2020-10-21","18:00:00",""
"7055945","14.998","0.005","8.7997","0.0004","23.691","0.008","90","","148.87","0.08","90","","1616","4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H22 N4 O6 Zn -","- C10 H22 N4 O6 Zn -","- C40 H88 N16 O24 Zn4 -","4","1","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","0.71073","MoKα","","0.0266","0.0226","","","0.06","0.0629","","","","","","1.053","","","","has coordinates","193867","2020-10-21","18:00:00",""
"7055946","32.755","0.0017","10.5714","0.0005","13.5063","0.0006","90","","110.305","0.004","90","","4386.2","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 Cl2 N4 O6 Zn -","- C18 H20 Cl2 N4 O6 Zn -","- C144 H160 Cl16 N32 O48 Zn8 -","8","1","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","0.71073","MoKα","","0.0471","0.0402","","","0.1001","0.1039","","","","","","1.08","","","","has coordinates","193867","2020-10-21","18:00:00",""
"7055947","8.7052","0.0005","12.9506","0.0006","17.0474","0.0007","108.023","0.004","90.814","0.004","95.484","0.004","1817.27","0.16","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H32 Cl2 F6 N8 O9 S2 Zn -","- C24 H32 Cl2 F6 N8 O9 S2 Zn -","- C48 H64 Cl4 F12 N16 O18 S4 Zn2 -","2","1","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","0.71073","MoKα","","0.0688","0.0509","","","0.1203","0.1342","","","","","","1.045","","","","has coordinates","193867","2020-10-21","18:00:00",""
"7055948","16.8415","0.0003","20.4363","0.0004","16.1946","0.0003","90","","90","","90","","5573.82","0.18","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C14 H28 F6 N8 O8 S2 Zn -","- C14 H28 F6 N8 O8 S2 Zn -","- C112 H224 F48 N64 O64 S16 Zn8 -","8","2","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","0.71073","MoKα","","0.0489","0.042","","","0.0983","0.1023","","","","","","1.046","","","","has coordinates,has disorder","193867","2020-10-21","18:00:00",""
"7055949","11.8893","0.0013","18.4419","0.0014","7.2746","0.0007","90","","103.177","0.011","90","","1553","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H19 F3 N4 O4 S -","- C9 H19 F3 N4 O4 S -","- C36 H76 F12 N16 O16 S4 -","4","1","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","0.71073","MoKα","","0.074","0.0494","","","0.1108","0.1229","","","","","","1.055","","","","has coordinates","193867","2020-10-21","18:00:00",""
"7055950","16.7859","0.0005","8.3599","0.0002","21.9907","0.0005","90","","90.745","0.002","90","","3085.66","0.14","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H15 F3 N4 O4 S -","- C11 H15 F3 N4 O4 S -","- C88 H120 F24 N32 O32 S8 -","8","1","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","1.54184","CuKα","","0.063","0.0569","","","0.1174","0.1223","","","","","","1.032","","","","has coordinates","193867","2020-10-21","18:00:00",""
"7055951","11.955","0.002","17.5685","0.0011","15.782","0.003","90","","139.46","0.04","90","","2154.5","1.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H22 N4 O6 Zn -","- C18 H22 N4 O6 Zn -","- C72 H88 N16 O24 Zn4 -","4","1","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","0.71073","MoKα","","0.038","0.0299","","","0.0706","0.0748","","","","","","1.059","","","","has coordinates","193867","2020-10-21","18:00:00",""
"7055952","9.9101","0.0006","17.0394","0.0009","18.2463","0.0006","74.733","0.004","89.846","0.004","82.485","0.005","2945.2","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H50 F12 N8 O26 S4 Zn3 -","- C36 H50 F12 N8 O26 S4 Zn3 -","- C72 H100 F24 N16 O52 S8 Zn6 -","2","1","","Bolotin, Dmitrii S.; Il'in, Mikhail V.; Novikov, Alexander S.; Bokach, Nadezhda A.; Suslonov, Vitalii V.; Kukushkin, Vadim Yu.","Trinuclear (aminonitrone)ZnII complexes as key intermediates in zinc(ii)-mediated generation of 1,2,4-oxadiazoles from amidoximes and nitriles","New J. Chem.","2017","41","5","1940","","10.1039/C6NJ03508F","","","1.54184","CuKα","","0.1152","0.0793","","","0.2065","0.2495","","","","","","1.02","","","","has coordinates","193867","2020-10-21","18:00:00",""
"7055953","10.0651","0.0014","12.301","0.0017","16.281","0.002","90","","93.537","0.002","90","","2011.9","0.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 Cu N5 O8 -","- C18 H15 Cu N5 O8 -","- C72 H60 Cu4 N20 O32 -","4","1","","Hu, Kun; Li, Feiyan; Zhang, Zhong; Liang, Fupei","Synthesis of two potential anticancer copper(ii) complex drugs: their crystal structure, human serum albumin/DNA binding and anticancer mechanism","New J. Chem.","2017","41","5","2062","","10.1039/C6NJ02483A","","","0.71073","MoKα","","0.0432","0.0321","","","0.0864","0.0934","","","","","","1.041","","","","has coordinates,has disorder","193866","2020-10-21","18:00:00",""
"7055954","7.854","0.003","10.712","0.003","21.44","0.007","90","","97.575","0.006","90","","1788","1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 Cu N4 O5 -","- C18 H16 Cu N4 O5 -","- C72 H64 Cu4 N16 O20 -","4","1","","Hu, Kun; Li, Feiyan; Zhang, Zhong; Liang, Fupei","Synthesis of two potential anticancer copper(ii) complex drugs: their crystal structure, human serum albumin/DNA binding and anticancer mechanism","New J. Chem.","2017","41","5","2062","","10.1039/C6NJ02483A","","","0.71073","MoKα","","0.0441","0.0346","","","0.0985","0.1069","","","","","","1.073","","","","has coordinates","193866","2020-10-21","18:00:00",""
"7055955","11.3213","0.0006","11.3226","0.0006","22.7583","0.0012","76.496","0.002","84.96","0.002","60.21","0.001","2460.4","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H37 Cu2 N6 O12 -","- C14 H37 Cu2 N6 O12 -","- C56 H148 Cu8 N24 O48 -","4","2","","Sama, Farasha; Ansari, Istikhar A.; Raizada, Mukul; Ahmad, Musheer; Nagaraja, C. M.; Shahid, M.; Kumar, Abhinav; Khan, Kulsum; Siddiqi, Zafar A.","Design, structures and study of non-covalent interactions of mono-, di-, and tetranuclear complexes of a bifurcated quadridentate tripod ligand, N-(aminopropyl)-diethanolamine","New J. Chem.","2017","41","5","1959","","10.1039/C6NJ02562E","","","0.71073","MoKα","","0.0363","0.0335","","","0.0828","0.0845","","","","","","1.0562","","","","has coordinates","193869","2020-10-21","18:00:00",""
"7055956","16.48","0.0012","13.6513","0.001","14.4161","0.001","90","","115.185","0.002","90","","2934.9","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H19 N4 Ni O2.5 S2 -","- C9 H19 N4 Ni O2.5 S2 -","- C72 H152 N32 Ni8 O20 S16 -","8","2","","Sama, Farasha; Ansari, Istikhar A.; Raizada, Mukul; Ahmad, Musheer; Nagaraja, C. M.; Shahid, M.; Kumar, Abhinav; Khan, Kulsum; Siddiqi, Zafar A.","Design, structures and study of non-covalent interactions of mono-, di-, and tetranuclear complexes of a bifurcated quadridentate tripod ligand, N-(aminopropyl)-diethanolamine","New J. Chem.","2017","41","5","1959","","10.1039/C6NJ02562E","","","0.71073","MoKα","","0.1126","0.0545","","","0.0902","0.1081","","","","","","1.0759","","","","has coordinates","193869","2020-10-21","18:00:00",""
"7055957","8.6719","0.0007","10.0649","0.0007","11.3026","0.0007","89.096","0.005","79.802","0.006","65.87","0.007","884.33","0.12","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H23 N3 O5 S Zn2 -","- C11 H23 N3 O5 S Zn2 -","- C22 H46 N6 O10 S2 Zn4 -","2","1","","Sama, Farasha; Ansari, Istikhar A.; Raizada, Mukul; Ahmad, Musheer; Nagaraja, C. M.; Shahid, M.; Kumar, Abhinav; Khan, Kulsum; Siddiqi, Zafar A.","Design, structures and study of non-covalent interactions of mono-, di-, and tetranuclear complexes of a bifurcated quadridentate tripod ligand, N-(aminopropyl)-diethanolamine","New J. Chem.","2017","41","5","1959","","10.1039/C6NJ02562E","","","0.71073","MoKα","","0.0534","0.041","","","0.0964","0.1062","","","","","","1.0465","","","","has coordinates","193869","2020-10-21","18:00:00",""
"7055958","15.2182","0.0003","14.6493","0.0003","23.9361","0.0005","90","","90","","90","","5336.22","0.19","296","2","296.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H39 Co2 N7 O16 -","- C14 H39 Co2 N7 O16 -","- C112 H312 Co16 N56 O128 -","8","1","","Sama, Farasha; Ansari, Istikhar A.; Raizada, Mukul; Ahmad, Musheer; Nagaraja, C. M.; Shahid, M.; Kumar, Abhinav; Khan, Kulsum; Siddiqi, Zafar A.","Design, structures and study of non-covalent interactions of mono-, di-, and tetranuclear complexes of a bifurcated quadridentate tripod ligand, N-(aminopropyl)-diethanolamine","New J. Chem.","2017","41","5","1959","","10.1039/C6NJ02562E","","","0.71073","MoKα","","0.0496","0.0348","","","0.0829","0.0916","","","","","","1.046","","","","has coordinates","193869","2020-10-21","18:00:00",""
"7055959","8.795","0.0008","12.132","0.002","14.2294","0.0015","103.245","0.011","96.276","0.008","111.032","0.012","1348.4","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H36 Co2 N7 O8.5 S2 -","- C16 H36 Co2 N7 O8.5 S2 -","- C32 H72 Co4 N14 O17 S4 -","2","1","","Sama, Farasha; Ansari, Istikhar A.; Raizada, Mukul; Ahmad, Musheer; Nagaraja, C. M.; Shahid, M.; Kumar, Abhinav; Khan, Kulsum; Siddiqi, Zafar A.","Design, structures and study of non-covalent interactions of mono-, di-, and tetranuclear complexes of a bifurcated quadridentate tripod ligand, N-(aminopropyl)-diethanolamine","New J. Chem.","2017","41","5","1959","","10.1039/C6NJ02562E","","","0.71073","MoKα","","0.0868","0.0577","","","0.1467","0.175","","","","","","1.0777","","","","has coordinates","193869","2020-10-21","18:00:00",""
"7055960","7.0886","0.0003","11.8816","0.0006","32.9373","0.0017","90","","90","","90","","2774.1","0.2","123","2","123","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C12 H13 Ag0.87 N2 Na0.13 O6 S -","- C12 H13 Ag0.867 N2 Na0.133 O6 S -","- C96 H104 Ag6.936 N16 Na1.064 O48 S8 -","8","1","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71073","MoKα","","0.0582","0.0319","","","0.0528","0.0599","","","","","","1.02","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055961","8.3838","0.0002","9.7225","0.0003","14.934","0.0004","90","","94.352","0.002","90","","1213.78","0.06","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H9 Ag N2 O4 S -","- C12 H9 Ag N2 O4 S -","- C48 H36 Ag4 N8 O16 S4 -","4","1","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71073","MoKα","","0.0326","0.0229","","","0.0456","0.0485","","","","","","1.067","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055962","13.3362","0.0006","16.5265","0.0008","20.1331","0.0007","66.518","0.004","75.035","0.003","89.409","0.004","3910.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H35 Ag Cl4 N6 O4 -","- C42 H35 Ag Cl4 N6 O4 -","- C168 H140 Ag4 Cl16 N24 O16 -","4","2","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71075","MoKα","","0.077","0.0451","","","0.0938","0.1053","","","","","","1.017","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055963","8.12","0.0006","9.7869","0.0006","21.6736","0.0016","90","","97.433","0.007","90","","1707.9","0.2","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H15 Ag N4 O3 -","- C19 H15 Ag N4 O3 -","- C76 H60 Ag4 N16 O12 -","4","1","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71073","MoKα","","0.0339","0.0285","","","0.0664","0.0693","","","","","","1.051","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055964","11.1773","0.0004","11.6004","0.0004","12.188","0.0004","81.629","0.002","73.899","0.002","70.341","0.002","1427.43","0.09","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C27.5 H25.5 Ag Cl0.99 N6.51 O4 S -","- C27.507 H23.986 Ag Cl0.986 N6.507 O4 S -","- C55.014 H47.972 Ag2 Cl1.972 N13.014 O8 S2 -","2","1","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71073","MoKα","","0.0624","0.0392","","","0.0831","0.0917","","","","","","1.035","","","","has coordinates,has disorder","193879","2020-10-21","18:00:00",""
"7055965","7.1538","0.0005","12.9587","0.0015","13.2859","0.0014","67.835","0.01","82.451","0.007","76.606","0.008","1108.3","0.2","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H19 Ag N6 O3 -","- C25 H19 Ag N6 O3 -","- C50 H38 Ag2 N12 O6 -","2","1","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","1.5418","CuKα","","0.1149","0.1044","","","0.2873","0.2934","","","","","","1.066","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055966","6.8116","0.0001","13.5608","0.0002","28.7557","0.0006","95.438","0.002","95.833","0.002","96.716","0.002","2608.96","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26.64 H21.14 Ag Cl2.72 N5.14 O2 -","- C26.6375 H21.1375 Ag Cl2.725 N5.1375 O2 -","- C106.55 H84.55 Ag4 Cl10.9 N20.55 O8 -","4","2","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71075","MoKα","","0.0304","0.0247","","","0.0546","0.0567","","","","","","1.049","","","","has coordinates,has disorder","193879","2020-10-21","18:00:00",""
"7055967","7.1227","0.0003","11.9399","0.0002","32.5608","0.0009","90","","90","","90","","2769.11","0.15","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H13 N2 Na O6 S -","- C12 H13 N2 Na O6 S -","- C96 H104 N16 Na8 O48 S8 -","8","1","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71073","MoKα","","0.1145","0.0473","","","0.0911","0.1052","","","","","","0.991","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055968","10.0038","0.0005","13.377","0.0007","14.2918","0.0008","71.64","0.003","78.179","0.003","78.327","0.003","1757.03","0.16","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H15 Ag N4 O3 -","- C19 H15 Ag N4 O3 -","- C76 H60 Ag4 N16 O12 -","4","2","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71073","MoKα","","0.1301","0.0635","","","0.1258","0.1439","","","","","","0.982","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055969","7.1356","0.0005","14.0212","0.0011","15.4526","0.0009","109.697","0.004","101.688","0.003","98.473","0.003","1385.86","0.17","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H26 Ag N7 O4 S -","- C28 H26 Ag N7 O4 S -","- C56 H52 Ag2 N14 O8 S2 -","2","1","","Dodds, Christopher A.; Hobday, Claire L.; Kennedy, Alan R.; McKellar, Scott C.; Smillie, Katy; Walls, Aiden","Ag(i) bipyridyl coordination polymers containing functional anions","New J. Chem.","2017","41","4","1574","","10.1039/C6NJ03555H","","","0.71073","MoKα","","0.1008","0.0567","","","0.0841","0.0932","","","","","","1.052","","","","has coordinates","193879","2020-10-21","18:00:00",""
"7055970","6.7135","0.0006","6.7702","0.0006","8.1378","0.0007","80.267","0.003","76.307","0.003","74.335","0.003","343.82","0.05","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H8 N10 O10 -","- C6 H8 N10 O10 -","- C6 H8 N10 O10 -","1","0.5","","Tian, Jiawei; Xiong, Hualin; Lin, Qiuhan; Cheng, Guangbin; Yang, Hongwei","Energetic compounds featuring bi(1,3,4-oxadiazole): a new family of insensitive energetic materials","New J. Chem.","2017","41","5","1918","","10.1039/C6NJ03608B","","","0.71073","MoKα","","0.0476","0.0338","","","0.0801","0.0855","","","","","","1.083","","","","has coordinates","193871","2020-10-21","18:00:00",""
"7055971","24.125","0.003","8.0141","0.001","10.8158","0.0011","90","","90","","90","","2091.1","0.4","168","2","168","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C8 H16 N18 O10 -","- C8 H16 N18 O10 -","- C32 H64 N72 O40 -","4","0.5","","Tian, Jiawei; Xiong, Hualin; Lin, Qiuhan; Cheng, Guangbin; Yang, Hongwei","Energetic compounds featuring bi(1,3,4-oxadiazole): a new family of insensitive energetic materials","New J. Chem.","2017","41","5","1918","","10.1039/C6NJ03608B","","","0.71073","MoKα","","0.1018","0.0415","","","0.0846","0.1026","","","","","","1.016","","","","has coordinates","193871","2020-10-21","18:00:00",""
"7055972","7.6518","0.0012","7.7243","0.001","9.0083","0.0012","95.49","0.004","106.941","0.004","117.039","0.004","437.09","0.11","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H8 N14 O10 -","- C10 H8 N14 O10 -","- C10 H8 N14 O10 -","1","0.5","","Tian, Jiawei; Xiong, Hualin; Lin, Qiuhan; Cheng, Guangbin; Yang, Hongwei","Energetic compounds featuring bi(1,3,4-oxadiazole): a new family of insensitive energetic materials","New J. Chem.","2017","41","5","1918","","10.1039/C6NJ03608B","","","0.71073","MoKα","","0.0911","0.0441","","","0.083","0.0973","","","","","","1.011","","","","has coordinates","193871","2020-10-21","18:00:00",""
"7055973","9.8239","0.001","11.5351","0.0012","12.3691","0.0013","91.417","0.002","102.778","0.002","96.494","0.002","1356.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Mo4 N6 O17 Zn -","- C14 H22 Mo4 N6 O17 Zn -","- C28 H44 Mo8 N12 O34 Zn2 -","2","1","","Wang, Xiu-Li; Zhang, Shan; Wang, Xiang; Zhang, Hui-Xiu; Xu, Na; Li, Tian-Jiao","Three β-octamolybdate-based supramolecular hybrids constructed from a bis-imidazolyl-bis-amide ligand: fast and selective adsorption activities of organic dyes","New J. Chem.","2017","41","5","2178","","10.1039/C6NJ03573F","","","0.71073","MoKα","","0.0817","0.0401","","","0.0779","0.091","","","","","","0.989","","","","has coordinates","193864","2020-10-21","18:00:00",""
"7055974","9.8153","0.0005","11.6524","0.0006","12.3272","0.0006","90.58","0.001","103.212","0.001","97.069","0.001","1361.06","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H22 Co Mo4 N6 O17 -","- C14 H20 Co Mo4 N6 O17 -","- C28 H40 Co2 Mo8 N12 O34 -","2","1","","Wang, Xiu-Li; Zhang, Shan; Wang, Xiang; Zhang, Hui-Xiu; Xu, Na; Li, Tian-Jiao","Three β-octamolybdate-based supramolecular hybrids constructed from a bis-imidazolyl-bis-amide ligand: fast and selective adsorption activities of organic dyes","New J. Chem.","2017","41","5","2178","","10.1039/C6NJ03573F","","","0.71073","MoKα","","0.0272","0.0228","","","0.0632","0.0652","","","","","","1.072","","","","has coordinates","193864","2020-10-21","18:00:00",""
"7055975","10.4739","0.0008","24.6254","0.0018","21.3617","0.0016","90","","90.085","0.001","90","","5509.7","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H46 Cu2 Mo8 N12 O35 -","- C28 H35 Cu2 Mo8 N12 O35 -","- C112 H140 Cu8 Mo32 N48 O140 -","4","1","","Wang, Xiu-Li; Zhang, Shan; Wang, Xiang; Zhang, Hui-Xiu; Xu, Na; Li, Tian-Jiao","Three β-octamolybdate-based supramolecular hybrids constructed from a bis-imidazolyl-bis-amide ligand: fast and selective adsorption activities of organic dyes","New J. Chem.","2017","41","5","2178","","10.1039/C6NJ03573F","","","0.71069","MoKα","","0.0797","0.0421","","","0.0809","0.0972","","","","","","0.968","","","","has coordinates","193864","2020-10-21","18:00:00",""
"7055976","23.654","0.006","8.738","0.002","8.595","0.002","90","","90","","90","","1776.5","0.7","296","2","296","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C10 H16 Br2 Cl3 Fe N4 O -","- C10 H16 Br2 Cl3 Fe N4 O -","- C40 H64 Br8 Cl12 Fe4 N16 O4 -","4","0.5","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.0448","0.031","","","0.082","0.0889","","","","","","1.066","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055977","19.167","0.017","19.167","0.017","16.153","0.015","90","","90","","90","","5934","9","296","2","296","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C24 H28 Br8 Cl16 Fe2 N8 O -","- C24 H28 Br8 Cl16 Fe2 N8 O -","- C96 H112 Br32 Cl64 Fe8 N32 O4 -","4","0.25","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.116","0.063","","","0.1668","0.2057","","","","","","1.004","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055978","8.5983","0.0015","20.475","0.004","14.989","0.003","90","","100.778","0.002","90","","2592.3","0.9","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H24 Cl6 Fe2 N4 O2 -","- C16 H24 Cl6 Fe2 N4 O2 -","- C64 H96 Cl24 Fe8 N16 O8 -","4","0.5","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.0353","0.029","","","0.0693","0.0725","","","","","","1.023","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055979","8.595","0.0006","9.6865","0.0007","15.7769","0.0011","90","","99.35","0.001","90","","1296.06","0.16","296","2","296","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C14 H20 Cl4 Fe2 I2 N4 O2 -","- C14 H20 Cl4 Fe2 I2 N4 O2 -","- C28 H40 Cl8 Fe4 I4 N8 O4 -","2","0.5","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.0481","0.0324","","","0.0813","0.0906","","","","","","1.026","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055980","8.6395","0.0006","9.7711","0.0007","15.8621","0.0011","90","","103.665","0.001","90","","1301.13","0.16","296","2","296","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C14 H20 Br6 Fe2 N4 O2 -","- C14 H20 Br6 Fe2 N4 O2 -","- C28 H40 Br12 Fe4 N8 O4 -","2","0.5","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.0556","0.0341","","","0.0705","0.0784","","","","","","1.009","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055981","12.1777","0.0013","8.7316","0.0009","17.3452","0.0018","90","","92.407","0.001","90","","1842.7","0.3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 Br2 Cl2 Fe N4 -","- C12 H16 Br2 Cl2 Fe N4 -","- C48 H64 Br8 Cl8 Fe4 N16 -","4","1","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.0565","0.0412","","","0.0952","0.1018","","","","","","1.046","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055982","12.247","0.004","8.932","0.003","17.42","0.005","90","","91.93","0.003","90","","1904.5","1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 Br4 Fe N4 -","- C12 H16 Br4 Fe N4 -","- C48 H64 Br16 Fe4 N16 -","4","1","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.0564","0.0426","","","0.0977","0.1049","","","","","","1.036","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055983","24.487","0.003","8.7651","0.001","8.5302","0.001","90","","110.281","0.003","90","","1717.3","0.4","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","EVG042","","","- C10 H16 Cl5 Fe N4 O -","- C10 H16 Cl5 Fe N4 O -","- C40 H64 Cl20 Fe4 N16 O4 -","4","0.5","","Govor, Evgen V.; Sanakis, Yiannis; Raptis, Raphael G.","Synthesis of pyrazole (hemi)aminals via the cleavage of saturated aliphatic ether C‒O bonds in the presence of ferric halides","New J. Chem.","2017","41","6","2220","","10.1039/C6NJ03822K","","","0.71073","MoKα","","0.0503","0.0428","","","0.0848","0.0889","","","","","","1.239","","","","has coordinates","195156","2020-10-21","18:00:00",""
"7055984","7.1985","0.001","11.4552","0.0016","14.805","0.002","78.169","0.005","81.599","0.005","88.276","0.004","1182.1","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H25 B F2 N2 -","- C30 H25 B F2 N2 -","- C60 H50 B2 F4 N4 -","2","1","","Maity, Apurba; Sarkar, Anirban; Sil, Amit; B. N., Shivakiran Bhaktha; Patra, Sanjib K.","Synthesis, photophysical and concentration-dependent tunable lasing behavior of 2,6-diacetylenyl-functionalized BODIPY dyes","New J. Chem.","2017","41","6","2296","","10.1039/C6NJ03033E","","","0.71073","MoKα","","0.1355","0.0593","","","0.1379","0.1773","","","","","","1.368","","","","has coordinates","195152","2020-10-21","18:00:00",""
"7055985","9.666","0.007","9.761","0.006","14.448","0.011","104.97","0.05","108.43","0.05","91.04","0.06","1241.9","1.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H36 N6 O5 S -","- C21 H36 N6 O5 S -","- C42 H72 N12 O10 S2 -","2","1","","Ke, Ya-Ting; Chou, Wei-Tzu; Chiang, Yi-Fen; Hsieh, Chang-Chih; Horng, Yih-Chern","Efficient and selective separation of aqueous sulfate through recognition and precipitation","New J. Chem.","2017","41","6","2249","","10.1039/C6NJ03710K","","","0.71073","MoKα","","0.1682","0.0624","","","0.1818","0.2251","","","","","","0.957","","","","has coordinates","195153","2020-10-21","18:00:00",""
"7055986","12.605","0.003","16.671","0.004","13.147","0.003","90","","99.243","0.013","90","","2726.8","1.1","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H37 N7 O2 -","- C27 H37 N7 O2 -","- C108 H148 N28 O8 -","4","1","","Ke, Ya-Ting; Chou, Wei-Tzu; Chiang, Yi-Fen; Hsieh, Chang-Chih; Horng, Yih-Chern","Efficient and selective separation of aqueous sulfate through recognition and precipitation","New J. Chem.","2017","41","6","2249","","10.1039/C6NJ03710K","","","0.71073","MoKα","","0.089","0.0478","","","0.1331","0.1654","","","","","","0.941","","","","has coordinates","195153","2020-10-21","18:00:00",""
"7055987","23.541","0.004","23.541","0.004","59.81","0.03","90","","90","","120","","28705","16","150","2","150","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","","","- C50 H72 N14 O6 S -","- C50 H72 N14 O6 S -","- C900 H1296 N252 O108 S18 -","18","0.5","","Ke, Ya-Ting; Chou, Wei-Tzu; Chiang, Yi-Fen; Hsieh, Chang-Chih; Horng, Yih-Chern","Efficient and selective separation of aqueous sulfate through recognition and precipitation","New J. Chem.","2017","41","6","2249","","10.1039/C6NJ03710K","","","0.71073","MoKα","","0.1417","0.1019","","","0.2621","0.2863","","","","","","0.849","","","","has coordinates","195153","2020-10-21","18:00:00",""
"7055988","11.8851","0.001","12.1025","0.001","21.045","0.0013","82.412","0.007","76.788","0.007","60.595","0.009","2566.6","0.4","294.44","0.1","294.44","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C51 H60 Br2 O10 -","- C51 H60 Br2 O10 -","- C102 H120 Br4 O20 -","2","1","","Chen, Jin-Fa; Cheng, Xiao-Bin; Li, Hui; Lin, Qi; Yao, Hong; Zhang, You-Ming; Wei, Tai-Bao","A copillar[5]arene-based fluorescence “on‒off‒on” sensor is applied in sequential recognition of an iron cation and a fluoride anion","New J. Chem.","2017","41","5","2148","","10.1039/C6NJ03380F","","x-ray","0.71073","MoKα","","0.1668","0.1136","","","0.2945","0.3222","","","","","","1.067","","","","has coordinates","193865","2020-10-21","18:00:00",""
"7055989","8.3886","0.0007","9.0069","0.0008","14.5283","0.0013","76.634","0.008","89.729","0.007","64.661","0.008","959.66","0.17","295","2","295","2","","","","","","","","3","P 1","P 1","1","","","","- C53 H36 Br2 -","- C53 H36 Br2 -","- C53 H36 Br2 -","1","1","","Khasanov, Albert F.; Kopchuk, Dmitry S.; Kovalev, Igor S.; Taniya, Olga S.; Giri, Kousik; Slepukhin, Pavel A.; Santra, Sougata; Rahman, Matiur; Majee, Adinath; Charushin, Valery N.; Chupakhin, Oleg N.","Extended cavity pyrene-based iptycenes for the turn-off fluorescence detection of RDX and common nitroaromatic explosives","New J. Chem.","2017","41","6","2309","","10.1039/C6NJ02956F","","","0.7107","MoKα","","0.0751","0.0509","","","0.1305","0.1536","","","","","","1.006","","","","has coordinates","195150","2020-10-21","18:00:00",""
"7055990","13.0874","0.0006","15.5471","0.0012","22.686","0.002","70.666","0.007","88.978","0.008","67.069","0.006","3978.5","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C221 H140 Br8 N4 O8 -","- C221 H140 Br8 N4 O8 -","- C221 H140 Br8 N4 O8 -","1","0.5","","Khasanov, Albert F.; Kopchuk, Dmitry S.; Kovalev, Igor S.; Taniya, Olga S.; Giri, Kousik; Slepukhin, Pavel A.; Santra, Sougata; Rahman, Matiur; Majee, Adinath; Charushin, Valery N.; Chupakhin, Oleg N.","Extended cavity pyrene-based iptycenes for the turn-off fluorescence detection of RDX and common nitroaromatic explosives","New J. Chem.","2017","41","6","2309","","10.1039/C6NJ02956F","","","0.71073","MoKα","","0.1166","0.0479","","","0.0963","0.1024","","","","","","1.019","","","","has coordinates,has disorder","195150","2020-10-21","18:00:00",""
"7055991","10.6582","0.0012","11.7546","0.0012","15.703","0.0018","86.775","0.004","82.638","0.003","84.317","0.005","1939.6","0.4","173.15","","173.15","","","","","","","","","6","P -1","-P 1","2","","","","- C70 H108 Al2 Cl6 N4 O4 -","- C70 H108 Al2 Cl6 N4 O4 -","- C70 H108 Al2 Cl6 N4 O4 -","1","0.5","","Zhang, Jie; Liu, Shaofeng; Zuo, Weiwei; Ye, Hongqi; Li, Zhibo","Synthesis of dinuclear aluminum complexes bearing bis-phenolate ligand and application in ring-opening polymerization of ε-caprolactone","New J. Chem.","2017","41","6","2358","","10.1039/C6NJ03818B","","","0.71073","MoKα","","0.0729","0.0692","","","0.1865","0.19","","","","","","1.071","","","","has coordinates,has disorder","195151","2020-10-21","18:00:00",""
"7055992","22.5443","0.0001","12.9305","0.0001","25.5225","0.0001","90","","93.527","0.003","90","","7425.95","0.08","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C38 H58 Al Cl N2 O2 -","- C38 H58 Al Cl N2 O2 -","- C304 H464 Al8 Cl8 N16 O16 -","8","1","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","","1.54184","CuKα","","0.0385","0.0377","","","0.0967","0.0974","","","","","","1.021","","","","has coordinates,has disorder","193874","2020-10-21","18:00:00",""
"7055993","22.4184","0.0001","12.9111","0.0001","25.8038","0.0001","90","","93.354","0.001","90","","7456.02","0.07","150","2","150","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C38 H58 Cl Ga N2 O2 -","- C38 H58 Cl Ga N2 O2 -","- C304 H464 Cl8 Ga8 N16 O16 -","8","1","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","","1.54184","CuKα","","0.0297","0.029","","","0.0773","0.0779","","","","","","1.021","","","","has coordinates","193874","2020-10-21","18:00:00",""
"7055994","12.3467","0.0003","15.823","0.0004","19.2186","0.0005","90","","94.865","0.003","90","","3741.05","0.16","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H58 Cl In N2 O2 -","- C38 H58 Cl In N2 O2 -","- C152 H232 Cl4 In4 N8 O8 -","4","1","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","","1.54184","CuKα","","0.0214","0.0202","","","0.0497","0.0503","","","","","","1.027","","","","has coordinates","193874","2020-10-21","18:00:00",""
"7055995","33.7559","0.0005","13.9577","0.0002","17.7422","0.0003","90","","102.82","0.002","90","","8150.9","0.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38.5 H64.5 Al Cl N2 O2 -","- C38.5 H64.5 Al Cl N2 O2 -","- C308 H516 Al8 Cl8 N16 O16 -","8","1","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","","1.54184","CuKα","","0.0768","0.0746","","","0.2122","0.2142","","","","","","1.083","","","","has coordinates,has disorder","193874","2020-10-21","18:00:00",""
"7055996","32.9563","0.0006","14.0324","0.0002","17.9476","0.0002","90","","101.376","0.0015","90","","8136.9","0.2","150.01","0.1","150.01","0.1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H68 Cl Ga N2 O2 -","- C34 H54 Cl Ga N2 O2 -","- C272 H432 Cl8 Ga8 N16 O16 -","8","1","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","x-ray","1.54184","CuKα","","0.0458","0.0426","","","0.1126","0.1154","","","","","","1.02","","","","has coordinates,has disorder","193874","2020-10-21","18:00:00",""
"7055997","21.6467","0.0009","13.105","0.0007","32.3338","0.0009","90","","90","","90","","9172.5","0.7","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C48 H70 Cl In N2 O2 -","- C48 H70 Cl In N2 O2 -","- C384 H560 Cl8 In8 N16 O16 -","8","1","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","","1.54184","CuKα","","0.0346","0.0311","","","0.0774","0.0793","","","","","","1.045","","","","has coordinates","193874","2020-10-21","18:00:00",""
"7055998","12.01","0.0001","16.744","0.0002","18.8821","0.0002","90","","92.908","0.001","90","","3792.21","0.07","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H58 I In N2 O2 -","- C38 H58 I In N2 O2 -","- C152 H232 I4 In4 N8 O8 -","4","1","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","","1.54184","CuKα","","0.0251","0.023","","","0.0574","0.0586","","","","","","1.018","","","","has coordinates","193874","2020-10-21","18:00:00",""
"7055999","17.9334","0.0003","16.6462","0.0002","32.2729","0.0003","90","","99.172","0.001","90","","9511","0.2","150","2","150","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C93 H157 In2 N4 O6 -","- C93 H157 In2 N4 O6 -","- C372 H628 In8 N16 O24 -","4","0.5","","Beament, James; Mahon, Mary F.; Buchard, Antoine; Jones, Matthew D.","Salan group 13 complexes ‒ structural study and lactide polymerisation","New J. Chem.","2017","41","5","2198","","10.1039/C6NJ03844A","","","1.54184","CuKα","","0.0435","0.0383","","","0.1091","0.114","","","","","","1.04","","","","has coordinates,has disorder","193874","2020-10-21","18:00:00",""
"7056000","14.145","0.002","10.0424","0.0016","19.296","0.003","90","","93.899","0.004","90","","2734.6","0.7","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 F12 N6 P2 -","- C24 H22 F12 N6 P2 -","- C96 H88 F48 N24 P8 -","4","1","","Jana, Barun; Ghosh, Pradyut","Structural diversities in Ag(i) complexes of xylyl platform based isomeric bis-NHC ligands: effects of pyridine wingtip substituents","New J. Chem.","2017","41","5","2131","","10.1039/C6NJ03609K","","","0.71073","MoKα","","0.0721","0.0452","","","0.1304","0.155","","","","","","0.979","","","","has coordinates","193872","2020-10-21","18:00:00",""
"7056001","12.345","0.002","10.001","0.002","22.409","0.004","90","","90.856","0.005","90","","2766.4","0.9","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 F12 N6 P2 -","- C24 H22 F12 N6 P2 -","- C96 H88 F48 N24 P8 -","4","1","","Jana, Barun; Ghosh, Pradyut","Structural diversities in Ag(i) complexes of xylyl platform based isomeric bis-NHC ligands: effects of pyridine wingtip substituents","New J. Chem.","2017","41","5","2131","","10.1039/C6NJ03609K","","","0.71073","MoKα","","0.1236","0.0864","","","0.2074","0.2361","","","","","","1.01","","","","has coordinates","193872","2020-10-21","18:00:00",""
"7056002","9.3697","0.0007","15.5486","0.0013","10.1656","0.0008","90","","102.268","0.005","90","","1447.2","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 F12 N6 P2 -","- C24 H22 F12 N6 P2 -","- C48 H44 F24 N12 P4 -","2","0.5","","Jana, Barun; Ghosh, Pradyut","Structural diversities in Ag(i) complexes of xylyl platform based isomeric bis-NHC ligands: effects of pyridine wingtip substituents","New J. Chem.","2017","41","5","2131","","10.1039/C6NJ03609K","","","0.71073","MoKα","","0.0998","0.0648","","","0.1827","0.213","","","","","","1.044","","","","has coordinates","193872","2020-10-21","18:00:00",""
"7056003","24.526","0.012","18.137","0.009","14.803","0.008","90","","123.108","0.007","90","","5516","5","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H46 Ag2 F12 N14 P2 -","- C52 H46 Ag2 F12 N14 P2 -","- C208 H184 Ag8 F48 N56 P8 -","4","0.5","","Jana, Barun; Ghosh, Pradyut","Structural diversities in Ag(i) complexes of xylyl platform based isomeric bis-NHC ligands: effects of pyridine wingtip substituents","New J. Chem.","2017","41","5","2131","","10.1039/C6NJ03609K","","","0.71073","MoKα","","0.1156","0.0677","","","0.1591","0.195","","","","","","1.041","","","","has coordinates","193872","2020-10-21","18:00:00",""
"7056004","13.9881","0.0017","24.815","0.003","15.5816","0.0018","90","","90.367","0.003","90","","5408.5","1.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H46 Ag2 F12 N14 P2 -","- C52 H46 Ag2 F12 N14 P2 -","- C208 H184 Ag8 F48 N56 P8 -","4","1","","Jana, Barun; Ghosh, Pradyut","Structural diversities in Ag(i) complexes of xylyl platform based isomeric bis-NHC ligands: effects of pyridine wingtip substituents","New J. Chem.","2017","41","5","2131","","10.1039/C6NJ03609K","","","0.71073","MoKα","","0.1855","0.1224","","","0.2601","0.2889","","","","","","1.109","","","","has coordinates","193872","2020-10-21","18:00:00",""
"7056005","10.4825","0.0012","11.7243","0.0013","12.3329","0.0014","70.664","0.002","88.355","0.003","84.518","0.002","1423.7","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H24.5 Ag F6 N7.5 P -","- C27 H24.5 Ag F6 N7.5 P -","- C54 H49 Ag2 F12 N15 P2 -","2","1","","Jana, Barun; Ghosh, Pradyut","Structural diversities in Ag(i) complexes of xylyl platform based isomeric bis-NHC ligands: effects of pyridine wingtip substituents","New J. Chem.","2017","41","5","2131","","10.1039/C6NJ03609K","","","0.71073","MoKα","","0.0658","0.0467","","","0.1111","0.1222","","","","","","1.037","","","","has coordinates,has disorder","193872","2020-10-21","18:00:00",""
"7056006","17.7697","0.001","10.7634","0.0007","11.4808","0.0006","90","","103.834","0.006","90","","2132.1","0.2","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C26 H18 Cu N4 O2 -","- C26 H18 Cu N4 O2 -","- C104 H72 Cu4 N16 O8 -","4","1","","Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja","Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay","New J. Chem.","2017","41","6","2425","","10.1039/C6NJ03827A","","","0.71073","MoKα","","0.0894","0.0633","","","0.1051","0.1139","","","","","","1.05","","","","has coordinates","195148","2020-10-21","18:00:00",""
"7056007","11.3899","0.0003","7.9499","0.0002","20.1358","0.0005","90","","99.746","0.002","90","","1796.95","0.08","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Cu N3 O3 -","- C20 H18 Cu N3 O3 -","- C80 H72 Cu4 N12 O12 -","4","1","","Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja","Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay","New J. Chem.","2017","41","6","2425","","10.1039/C6NJ03827A","","","0.71073","MoKα","","0.0425","0.0378","","","0.0956","0.0985","","","","","","1.06","","","","has coordinates","195148","2020-10-21","18:00:00",""
"7056008","25.256","0.002","11.149","0.0005","25.821","0.002","90","","120.069","0.011","90","","6292.2","1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C64 H46 Cu4 N8 O18 -","- C64 H46 Cu4 N8 O18 -","- C256 H184 Cu16 N32 O72 -","4","0.5","","Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja","Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay","New J. Chem.","2017","41","6","2425","","10.1039/C6NJ03827A","","","0.71073","MoKα","","0.1311","0.1015","","","0.227","0.2413","","","","","","1.15","","","","has coordinates","195148","2020-10-21","18:00:00",""
"7056009","16.5056","0.0003","8.5024","0.00019","24.0812","0.0005","90","","93.366","0.0016","90","","3373.66","0.12","296","2","296","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C40 H32 Cu2 N6 O6 -","- C40 H32 Cu2 N6 O6 -","- C160 H128 Cu8 N24 O24 -","4","0.5","","Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja","Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay","New J. Chem.","2017","41","6","2425","","10.1039/C6NJ03827A","","","0.71073","MoKα","","0.0611","0.0405","","","0.0903","0.0991","","","","","","1.013","","","","has coordinates","195148","2020-10-21","18:00:00",""
"7056010","13.5763","0.0006","10.6885","0.0003","13.9612","0.0007","90","","116.912","0.006","90","","1806.51","0.16","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H34 Cu2 N6 O6 -","- C40 H34 Cu2 N6 O6 -","- C80 H68 Cu4 N12 O12 -","2","0.5","","Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja","Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay","New J. Chem.","2017","41","6","2425","","10.1039/C6NJ03827A","","","1.54184","CuKα","","0.0454","0.04","","","0.1178","0.1235","","","","","","1.056","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7056011","12.42","0.001","8.0353","0.0004","19.6932","0.001","90","","93.427","0.005","90","","1961.8","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 Cu2 N6 O9 -","- C40 H38 Cu2 N6 O9 -","- C80 H76 Cu4 N12 O18 -","2","0.5","","Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja","Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay","New J. Chem.","2017","41","6","2425","","10.1039/C6NJ03827A","","","0.71073","MoKα","","0.0665","0.0459","","","0.1143","0.1235","","","","","","1.047","","","","has coordinates","195148","2020-10-21","18:00:00",""
"7056012","18.5945","0.0013","10.8612","0.0005","11.6265","0.0007","90","","98.555","0.007","90","","2321.9","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H20 Cu N4 O3 -","- C27 H20 Cu N4 O3 -","- C108 H80 Cu4 N16 O12 -","4","1","","Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja","Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay","New J. Chem.","2017","41","6","2425","","10.1039/C6NJ03827A","","","0.71073","MoKα","","0.1133","0.0579","","","0.0936","0.1078","","","","","","1.015","","","","has coordinates,has disorder","211196","2020-10-21","18:00:00",""
"7056013","9.6317","0.0007","11.2106","0.0007","13.6662","0.0008","102.602","0.005","91.453","0.005","101.45","0.006","1407.79","0.16","120","0.1","120","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C62 H62 N6 Ni2 O6 P2 S2 -","- C62 H62 N6 Ni2 O6 P2 S2 -","- C62 H62 N6 Ni2 O6 P2 S2 -","1","0.5","","Kalaiarasi, G.; Jain, Ruchi; Puschman, H.; Poorna Chandrika, S.; Preethi, K.; Prabhakaran, R.","New binuclear Ni(ii) metallates containing ONS chelators: synthesis, characterisation, DNA binding, DNA cleavage, protein binding, antioxidant activity, antimicrobial and in vitro cytotoxicity","New J. Chem.","2017","41","7","2543","","10.1039/C6NJ03516G","","x-ray","0.71073","MoKα","","0.049","0.0401","","","0.0983","0.1045","","","","","","1.047","","","","has coordinates","195160","2020-10-21","18:00:00",""
"7056014","10.5619","0.0011","11.0171","0.0012","11.3222","0.0012","93.08","0.004","108.522","0.003","98.363","0.003","1228.9","0.2","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H56 N8 Ni2 O6 P2 S2 -","- C50 H56 N8 Ni2 O6 P2 S2 -","- C50 H56 N8 Ni2 O6 P2 S2 -","1","0.5","","Kalaiarasi, G.; Jain, Ruchi; Puschman, H.; Poorna Chandrika, S.; Preethi, K.; Prabhakaran, R.","New binuclear Ni(ii) metallates containing ONS chelators: synthesis, characterisation, DNA binding, DNA cleavage, protein binding, antioxidant activity, antimicrobial and in vitro cytotoxicity","New J. Chem.","2017","41","7","2543","","10.1039/C6NJ03516G","","","0.71073","MoKα","","0.0972","0.0609","","","0.1404","0.1582","","","","","","1.014","","","","has coordinates","195160","2020-10-21","18:00:00",""
"7056015","10.4365","0.0014","15.482","0.002","9.396","0.0012","90","","110.589","0.001","90","","1421.2","0.3","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H13 N5 S -","- C15 H13 N5 S -","- C60 H52 N20 S4 -","4","1","","Yutronkie, Nathan J.; Tami, Perrine; Singh, Simarpreet; Kleisath, Elizabeth; Gabidullin, Bulat M.; Davis, Rebecca; Brusso, Jaclyn L.","S-Functionalization of 3,5-bis(2-pyridyl)-1,2,4,6-thiatriazine: probing the effect of alkyl chain length in the development of tethered materials","New J. Chem.","2017","41","6","2268","","10.1039/C6NJ03721F","","","0.71073","MoKα","","0.0531","0.0418","","","0.1088","0.1157","","","","","","1.034","","","","has coordinates","195155","2020-10-21","18:00:00",""
"7056016","18.9919","0.0012","14.291","0.0008","16.4594","0.0016","90","","122.227","0.003","90","","3779.1","0.5","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 Cl4 N10 S2 -","- C36 H40 Cl4 N10 S2 -","- C144 H160 Cl16 N40 S8 -","4","0.5","","Yutronkie, Nathan J.; Tami, Perrine; Singh, Simarpreet; Kleisath, Elizabeth; Gabidullin, Bulat M.; Davis, Rebecca; Brusso, Jaclyn L.","S-Functionalization of 3,5-bis(2-pyridyl)-1,2,4,6-thiatriazine: probing the effect of alkyl chain length in the development of tethered materials","New J. Chem.","2017","41","6","2268","","10.1039/C6NJ03721F","","","0.71073","MoKα","","0.1292","0.0872","","","0.2195","0.2481","","","","","","1.079","","","","has coordinates,has disorder","195155","2020-10-21","18:00:00",""
"7056017","7.9584","0.0002","12.3934","0.0003","12.5205","0.0003","66.596","0.001","75.989","0.001","83.84","0.001","1099.51","0.05","105","","105","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H20 N4 S3 -","- C24 H20 N4 S3 -","- C48 H40 N8 S6 -","2","1","","Tremblay, Marie-Hélène; Gellé, Alexandra; Skene, W. G.","Ambipolar azomethines as potential cathodic color switching materials","New J. Chem.","2017","41","6","2287","","10.1039/C6NJ01732K","","x-ray","1.34139","GaKα","","0.0332","0.0317","","","0.0858","0.0875","","","","","","1.058","","","","has coordinates","195149","2020-10-21","18:00:00",""
"7056018","6.42","0.001","6.924","0.001","22.131","0.002","95.13","0.002","92.58","0.002","100.82","0.003","960.5","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H48 Ag2 N8 O2 -","- C38 H48 Ag2 N8 O2 -","- C38 H48 Ag2 N8 O2 -","1","0.5","","Al Abbas, Alexandre; Heinrich, Benoît; L'Her, Matthieu; Couzigné, Emilie; Welter, Richard; Douce, Laurent","Bolaamphiphilic liquid crystals based on bis-imidazolium cations","New J. Chem.","2017","41","7","2604","","10.1039/C6NJ03590F","","","0.7107","MoKα","","0.0507","0.0419","","","0.1171","0.1229","","","","","","1.047","","","","has coordinates","195163","2020-10-21","18:00:00",""
"7056019","8.84","0.0003","9.313","0.0004","24.989","0.0005","90.611","0.002","99.078","0.002","108.899","0.0013","1917.78","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H50 N8 Ni O3 -","- C38 H50 N8 Ni O3 -","- C76 H100 N16 Ni2 O6 -","2","1","","Al Abbas, Alexandre; Heinrich, Benoît; L'Her, Matthieu; Couzigné, Emilie; Welter, Richard; Douce, Laurent","Bolaamphiphilic liquid crystals based on bis-imidazolium cations","New J. Chem.","2017","41","7","2604","","10.1039/C6NJ03590F","","","0.71073","MoKα","","0.0669","0.0458","","","0.1181","0.1277","","","","","","1.043","","","","has coordinates","195163","2020-10-21","18:00:00",""
"7056020","12.386","0.0011","18.8479","0.0017","22.508","0.002","90","","95.0605","0.0013","90","","5234","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C112 H138 N10 O12 Pd2 -","- C112 H138 N10 O12 Pd2 -","- C224 H276 N20 O24 Pd4 -","2","0.5","","Morohashi, N.; Iijima, S.; Akasaka, K.; Hattori, T.","Selective extraction of Pd(ii) by p-tert-butylcalix[4]arenedicarboxylic acid","New J. Chem.","2017","41","6","2231","","10.1039/C6NJ03839E","","","0.71073","MoKα","","0.0659","0.0522","","","0.1361","0.1483","","","","","","1.067","","","","has coordinates,has disorder","195154","2020-10-21","18:00:00",""
"7056021","6.5098","0.0019","11.428","0.003","14.534","0.004","101.993","0.003","95.432","0.004","105.472","0.003","1006.3","0.5","110.15","","110.15","","","","","","","","","7","P -1","-P 1","2","","","","- C19 H18 Cl2 N2 O Ru S2 -","- C19 H18 Cl2 N2 O Ru S2 -","- C38 H36 Cl4 N4 O2 Ru2 S4 -","2","1","","Jeyalakshmi, Kumaramangalam; Haribabu, Jebiti; Balachandran, Chandrasekar; Bhuvanesh, Nattamai S. P.; Emi, Nobuhiko; Karvembu, Ramasamy","Synthesis of Ru(ii)‒benzene complexes containing aroylthiourea ligands, and their binding with biomolecules and in vitro cytotoxicity through apoptosis","New J. Chem.","2017","41","7","2672","","10.1039/C6NJ03099H","","","0.71073","MoKα","","0.0441","0.0399","","","0.1051","0.1089","","","","","","1.043","","","","has coordinates","195162","2020-10-21","18:00:00",""
"7056022","11.674","0.002","10.818","0.002","15.646","0.003","90","","99.37","0.03","90","","1949.6","0.6","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 Cl2 N2 O Ru S2 -","- C18 H16 Cl2 N2 O Ru S2 -","- C72 H64 Cl8 N8 O4 Ru4 S8 -","4","1","","Jeyalakshmi, Kumaramangalam; Haribabu, Jebiti; Balachandran, Chandrasekar; Bhuvanesh, Nattamai S. P.; Emi, Nobuhiko; Karvembu, Ramasamy","Synthesis of Ru(ii)‒benzene complexes containing aroylthiourea ligands, and their binding with biomolecules and in vitro cytotoxicity through apoptosis","New J. Chem.","2017","41","7","2672","","10.1039/C6NJ03099H","","","0.71073","MoKα","","0.024","0.0204","","","0.049","0.0509","","","","","","1.037","","","","has coordinates","195162","2020-10-21","18:00:00",""
"7056023","5.539","0.0004","8.1345","0.0006","13.8742","0.0009","94.771","0.003","98.816","0.004","93.294","0.004","614.04","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 N2 O Se -","- C14 H10 N2 O Se -","- C28 H20 N4 O2 Se2 -","2","1","","Kumar, Sanjeev; Sharma, Nidhi; Maurya, Indresh K.; Verma, Ajay; Kumar, Sangit; Bhasin, K. K.; Sharma, Rohit K.","Insights into selenylation of imidazo[1,2-a]pyridine: synthesis, structural and antimicrobial evaluation","New J. Chem.","2017","41","8","2919","","10.1039/C7NJ00338B","","x-ray","0.71073","MoKα","","0.0453","0.0303","","","0.0663","0.0719","","","","","","1.015","","","","has coordinates","196485","2020-10-21","18:00:00",""
"7056024","16.254","0.003","16.408","0.003","17.493","0.003","111.443","0.006","93.798","0.006","103.048","0.006","4172.9","1.3","100","2","100","2","","","","","","","","6","P 1","P 1","1","","","","- C167 H144.5 Cl2 Mn8 N10.5 O55.5 -","- C167 H143.5 Cl2 Mn8 N10.5 O55.5 -","- C167 H143.5 Cl2 Mn8 N10.5 O55.5 -","1","1","","Escriche-Tur, Luis; Albela, Belén; Font-Bardia, Mercè; Corbella, Montserrat","Singlet ground states in compounds with a [MnIII4O2]8+ core due to broken degeneration","New J. Chem.","2017","41","8","2934","","10.1039/C6NJ03845J","","","0.71073","MoKα","","0.0428","0.0397","","","0.106","0.1104","","","","","","1.105","","","","has coordinates","196477","2020-10-21","18:00:00",""
"7056025","23.2179","0.0007","14.1211","0.0004","30.9402","0.0008","90","","98.284","0.002","90","","10038.3","0.5","296","2","296","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C40 H110 Cu Mo36 N24 O163 P12 Sr5 -","- C40 H110 Cu1.12 Mo36 N24 O163 P12 Sr4.88 -","- C80 H220 Cu2.24 Mo72 N48 O326 P24 Sr9.76 -","2","0.5","","Wang, Wei-wei; Lv, Jing-hua; Yu, Kai; Wang, Chun-mei; Zhang, He; Wu, Chu; Zhou, Bai-bin","The basket-type dimer layers based on tetra-electron reduced heteropoly blue directed by copper/nickel and strontium linkers","New J. Chem.","2017","41","7","2687","","10.1039/C6NJ03495K","","","0.71073","MoKα","","0.1002","0.0563","","","0.15","0.1747","","","","","","1.027","","","","has coordinates","195157","2020-10-21","18:00:00",""
"7056026","23.2228","0.0004","14.1531","0.0003","30.9026","0.0005","90","","98.311","0.001","90","","10050.2","0.3","296","2","296","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","","","- C40 H107.5 Mo36 N24 Ni O161.5 P12 Sr5 -","- C40 H107.4 Mo36 N24 Ni1.1 O161.7 P12 Sr4.9 -","- C80 H214.8 Mo72 N48 Ni2.2 O323.4 P24 Sr9.8 -","2","0.5","","Wang, Wei-wei; Lv, Jing-hua; Yu, Kai; Wang, Chun-mei; Zhang, He; Wu, Chu; Zhou, Bai-bin","The basket-type dimer layers based on tetra-electron reduced heteropoly blue directed by copper/nickel and strontium linkers","New J. Chem.","2017","41","7","2687","","10.1039/C6NJ03495K","","","0.71073","MoKα","","0.1015","0.0865","","","0.1465","0.169","","","","","","1.211","","","","has coordinates,has disorder","195157","2020-10-21","18:00:00",""
"7056027","7.7557","0.0004","10.0442","0.0005","10.1321","0.0005","78.38","0.004","78.554","0.005","68.519","0.005","712.65","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H18 Cu N4 O4 -","- C12 H18 Cu N4 O4 -","- C24 H36 Cu2 N8 O8 -","2","1","","Noshiranzadeh, Nader; Emami, Marzieh; Bikas, Rahman; Kozakiewicz, Anna","Green click synthesis of β-hydroxy-1,2,3-triazoles in water in the presence of a Cu(ii)‒azide catalyst: a new function for Cu(ii)‒azide complexes","New J. Chem.","2017","41","7","2658","","10.1039/C6NJ03865D","","","0.71073","MoKα","","0.0444","0.0354","","","0.1026","0.1056","","","","","","1.118","","","","has coordinates","195158","2020-10-21","18:00:00",""
"7056028","14.685","0.003","5.545","0.001","16.85","0.003","90","","100.38","0.03","90","","1349.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H15 N3 O -","- C16 H15 N3 O -","- C64 H60 N12 O4 -","4","1","","Noshiranzadeh, Nader; Emami, Marzieh; Bikas, Rahman; Kozakiewicz, Anna","Green click synthesis of β-hydroxy-1,2,3-triazoles in water in the presence of a Cu(ii)‒azide catalyst: a new function for Cu(ii)‒azide complexes","New J. Chem.","2017","41","7","2658","","10.1039/C6NJ03865D","","","0.71073","MoKα","","0.2969","0.0984","","","0.2496","0.3598","","","","","","0.99","","","","has coordinates","195158","2020-10-21","18:00:00",""
"7056029","28.22","0.011","7.03","0.003","8.168","0.003","90","","95.038","0.008","90","","1614.2","1.1","296","2","296.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 N2 O4 -","- C18 H16 N2 O4 -","- C72 H64 N8 O16 -","4","0.5","","Wang, Ning; Yang, Jin-Chuang; Chen, Li-Dong; Li, Jia; An, Yue; Lü, Cheng-Wei; Tian, Yun-Qi","Efficient synthesis of diethyl benzo[c]cinoline-3,8-dicarboxylate for fluorescence quenching materials","New J. Chem.","2017","41","7","2786","","10.1039/C6NJ03989H","","","0.71073","MoKα","","0.1497","0.0576","","","0.1525","0.1969","","","","","","0.98","","","","has coordinates,has disorder","195159","2020-10-21","18:00:00",""
"7056030","8.2607","0.0015","14.168","0.003","27.7","0.005","90","","90","","90","","3241.9","1.1","296.15","","296.15","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C18 H16 N2 O5 -","- C18 H16 N2 O5 -","- C144 H128 N16 O40 -","8","1","","Wang, Ning; Yang, Jin-Chuang; Chen, Li-Dong; Li, Jia; An, Yue; Lü, Cheng-Wei; Tian, Yun-Qi","Efficient synthesis of diethyl benzo[c]cinoline-3,8-dicarboxylate for fluorescence quenching materials","New J. Chem.","2017","41","7","2786","","10.1039/C6NJ03989H","","","0.71073","MoKα","","0.1385","0.0651","","","0.1498","0.1885","","","","","","1.032","","","","has coordinates,has disorder","195159","2020-10-21","18:00:00",""
"7056031","9.222","0.003","12.461","0.004","13.128","0.004","90","","100.199","0.005","90","","1484.8","0.8","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 Cl N O Pd S -","- C16 H12 Cl N O Pd S -","- C64 H48 Cl4 N4 O4 Pd4 S4 -","4","1","","Kumar, Satyendra; Saleem, Fariha; Mishra, Manish Kumar; Singh, Ajai K.","Oxine based unsymmetrical (O−, N, S/Se) pincer ligands and their palladium(ii) complexes: synthesis, structural aspects and applications as a catalyst in amine and copper-free Sonogashira coupling","New J. Chem.","2017","41","7","2745","","10.1039/C7NJ00067G","","","0.71073","MoKα","","0.0861","0.0485","","","0.1031","0.1162","","","","","","0.974","","","","has coordinates","195161","2020-10-21","18:00:00",""
"7056032","19.823","0.003","15.375","0.002","22.92","0.003","90","","90","","90","","6985.5","1.7","298","2","298","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C16 H12 Cl N O Pd Se -","- C16 H12 Cl N O Pd Se -","- C256 H192 Cl16 N16 O16 Pd16 Se16 -","16","2","","Kumar, Satyendra; Saleem, Fariha; Mishra, Manish Kumar; Singh, Ajai K.","Oxine based unsymmetrical (O−, N, S/Se) pincer ligands and their palladium(ii) complexes: synthesis, structural aspects and applications as a catalyst in amine and copper-free Sonogashira coupling","New J. Chem.","2017","41","7","2745","","10.1039/C7NJ00067G","","","0.71073","MoKα","","0.0543","0.0407","","","0.1049","0.1109","","","","","","1.033","","","","has coordinates","195161","2020-10-21","18:00:00",""
"7056033","10.874","0.003","10.652","0.003","11.473","0.004","90","","90.624","0.006","90","","1328.8","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 N O S -","- C16 H13 N O S -","- C64 H52 N4 O4 S4 -","4","1","","Kumar, Satyendra; Saleem, Fariha; Mishra, Manish Kumar; Singh, Ajai K.","Oxine based unsymmetrical (O−, N, S/Se) pincer ligands and their palladium(ii) complexes: synthesis, structural aspects and applications as a catalyst in amine and copper-free Sonogashira coupling","New J. Chem.","2017","41","7","2745","","10.1039/C7NJ00067G","","","0.71073","MoKα","","0.1166","0.0649","","","0.1762","0.2072","","","","","","1.022","","","","has coordinates","195161","2020-10-21","18:00:00",""
"7056034","19.372","0.002","12.2295","0.001","11.3742","0.0014","90","","124.421","0.008","90","","2222.8","0.5","291","2","291","","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","Methylbiquinoxen","N,N'-dimethyl-3,3'-biquinoxalinium bis tetrafluroborate, acetonitrile","","- C20 H16 B2 F8 N5 -","- C20 H16 B2 F8 N5 -","- C80 H64 B8 F32 N20 -","4","0.5","","Leblanc, Nicolas; Sproules, Stephen; Powell, Annie K.","An alternative method to access diverse N,N′-diquaternised-3,3′-biquinoxalinium “biquinoxen” dications","New J. Chem.","2017","41","8","2949","","10.1039/C7NJ00531H","","","0.71073","MoKα","","0.0759","0.0617","","","0.1964","0.2111","","","","","","1.132","","","","has coordinates","196480","2020-10-21","18:00:00",""
"7056035","8.663","0.001","8.781","0.001","22.282","0.002","90","","95.376","0.006","90","","1687.5","0.3","291","2","291","","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","Benzylbiquinoxen bis (tetrafluoroborate), bis (acetonitrile)","N,N'-dibenzyl-3,3'-biquinoxalinium bis(tetrafluoroborate), bis (acetonitrile)","","- C34 H30 B2 F8 N6 -","- C34 H30 B2 F8 N6 -","- C68 H60 B4 F16 N12 -","2","0.5","","Leblanc, Nicolas; Sproules, Stephen; Powell, Annie K.","An alternative method to access diverse N,N′-diquaternised-3,3′-biquinoxalinium “biquinoxen” dications","New J. Chem.","2017","41","8","2949","","10.1039/C7NJ00531H","","","0.71073","MoKα","","0.0874","0.0595","","","0.1801","0.1985","","","","","","1.071","","","","has coordinates","196480","2020-10-21","18:00:00",""
"7056036","13.6499","0.0005","10.6491","0.0004","16.0789","0.0006","90","","106.365","0.001","90","","2242.53","0.14","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H18 Co N6 O7 -","- C24 H18 Co N6 O7 -","- C96 H72 Co4 N24 O28 -","4","1","","Sharma, Surbhi; Toupet, Loic; Arjmand, Farukh","De novo design of a hydrolytic DNA cleavage agent, mono nitratobis(phen)cobalt(ii) aqua nitrate complex","New J. Chem.","2017","41","8","2883","","10.1039/C7NJ00563F","","","0.71073","MoKα","","0.0457","0.0376","","","0.0994","0.1042","","","","","","1.073","","","","has coordinates","196483","2020-10-21","18:00:00",""
"7056037","10.5833","0.0004","24.6297","0.0008","15.5661","0.0005","90","","102.349","0.001","90","","3963.6","0.2","296","2","296.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H19 F12 Ir N6 O S -","- C38 H19 F12 Ir N6 O S -","- C152 H76 F48 Ir4 N24 O4 S4 -","4","1","","Jing, Yi-Ming; Zheng, You-Xuan","Photoluminescence and electroluminescence of an iridium(iii) complex with 2′,6′-bis(trifluoromethyl)-2,4′-bipyridine and 2-(5-phenyl-1,3,4-thiadiazol-2-yl)phenol ligands","New J. Chem.","2017","41","8","3029","","10.1039/C7NJ00163K","","","0.71073","MoKα","","0.0358","0.0286","","","0.0686","0.0707","","","","","","1.057","","","","has coordinates","196476","2020-10-21","18:00:00",""
"7056038","7.3139","0.0007","9.6308","0.0009","11.2039","0.001","73.572","0.002","78.457","0.002","73.711","0.002","720.31","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H18 N8 O12 U -","- C32 H18 N8 O12 U -","- C32 H18 N8 O12 U -","1","0.5","","Li, Shuang; Sun, Li Xian; Ni, Jue Chen; Shi, Zhan; Xing, Yong Heng; Shang, Di; Bai, Feng Ying","Two uranyl heterocyclic carboxyl compounds with fluorescent properties as high sensitivity and selectivity optical detectors for nitroaromatics","New J. Chem.","2017","41","8","3073","","10.1039/C6NJ03933B","","","0.71073","MoKα","","0.0394","0.0312","","","0.0614","0.0657","","","","","","1.006","","","","has coordinates,has disorder","196479","2020-10-21","18:00:00",""
"7056039","9.2837","0.0006","25.2187","0.0017","7.4546","0.0005","90","","95.478","0.001","90","","1737.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H24 N10 O6 U -","- C40 H24 N10 O6 U -","- C80 H48 N20 O12 U2 -","2","0.5","","Li, Shuang; Sun, Li Xian; Ni, Jue Chen; Shi, Zhan; Xing, Yong Heng; Shang, Di; Bai, Feng Ying","Two uranyl heterocyclic carboxyl compounds with fluorescent properties as high sensitivity and selectivity optical detectors for nitroaromatics","New J. Chem.","2017","41","8","3073","","10.1039/C6NJ03933B","","","0.71073","MoKα","","0.0671","0.031","","","0.0589","0.067","","","","","","1.009","","","","has coordinates","196479","2020-10-21","18:00:00",""
"7056040","19.8753","0.0012","13.6546","0.0008","23.5872","0.0014","90","","108.782","0.001","90","","6060.4","0.6","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C130 H129 F6 N12 O13 P4 Ru2 S2 -","- C130 H129 F6 N12 O13 P4 Ru2 S2 -","- C260 H258 F12 N24 O26 P8 Ru4 S4 -","2","0.5","","Dai, Zengjin; Luo, Qi; Cong, Hengjiang; Zhang, Jing; Peng, Tianyou","New Ru(ii) N′NN′-type pincer complexes: synthesis, characterization and the catalytic hydrogenation of CO2 or bicarbonates to formate salts","New J. Chem.","2017","41","8","3055","","10.1039/C6NJ03855G","","","0.71073","MoKα","","0.0514","0.0402","","","0.1028","0.111","","","","","","1.046","","","","has coordinates,has disorder","196484","2020-10-21","18:00:00",""
"7056041","11.2021","0.0006","8.9266","0.0005","19.0001","0.001","90","","90.03","0.002","90","","1899.95","0.18","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 N P Pt S -","- C20 H22 N P Pt S -","- C80 H88 N4 P4 Pt4 S4 -","4","1","","Polo, A.; Duran, J.; Juanola, R.; Real, J.; Benet-Buchholz, J.; Solà, M.; Poater, A.","Tuning diastereoisomerism in platinum(ii) phosphino- and aminothiolato hydrido complexes","New J. Chem.","2017","41","8","3015","","10.1039/C6NJ04042J","","","0.71073","MoKα","","0.0583","0.0411","","","0.0909","0.0968","","","","","","0.981","","","","has coordinates","196490","2020-10-21","18:00:00",""
"7056042","9.2097","0.0015","9.9559","0.0017","13.363","0.002","75.392","0.006","87.912","0.008","63.361","0.006","1055.6","0.3","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H24 N O2 P Pt S -","- C22 H24 N O2 P Pt S -","- C44 H48 N2 O4 P2 Pt2 S2 -","2","1","","Polo, A.; Duran, J.; Juanola, R.; Real, J.; Benet-Buchholz, J.; Solà, M.; Poater, A.","Tuning diastereoisomerism in platinum(ii) phosphino- and aminothiolato hydrido complexes","New J. Chem.","2017","41","8","3015","","10.1039/C6NJ04042J","","","0.71073","MoKα","","0.1177","0.0601","","","0.1086","0.1231","","","","","","0.853","","","","has coordinates,has disorder","196490","2020-10-21","18:00:00",""
"7056043","9.304","0.0002","10.1733","0.0002","13.5601","0.0003","73.671","0.001","87.586","0.001","63.534","0.001","1097.46","0.04","153","2","153","2","","","","","","","","7","P 1","P 1","1","","","","- C23 H26 N O2 P Pt S -","- C23 H26 N O2 P Pt S -","- C46 H52 N2 O4 P2 Pt2 S2 -","2","2","","Polo, A.; Duran, J.; Juanola, R.; Real, J.; Benet-Buchholz, J.; Solà, M.; Poater, A.","Tuning diastereoisomerism in platinum(ii) phosphino- and aminothiolato hydrido complexes","New J. Chem.","2017","41","8","3015","","10.1039/C6NJ04042J","","","0.71073","MoKα","","0.0513","0.0471","","","0.119","0.1214","","","","","","1.037","","","","has coordinates","196490","2020-10-21","18:00:00",""
"7056044","9.6068","0.0003","29.7785","0.0011","10.3464","0.0004","90","","111.467","0.002","90","","2754.53","0.17","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 P2 Pt S -","- C32 H30 P2 Pt S -","- C128 H120 P8 Pt4 S4 -","4","1","","Polo, A.; Duran, J.; Juanola, R.; Real, J.; Benet-Buchholz, J.; Solà, M.; Poater, A.","Tuning diastereoisomerism in platinum(ii) phosphino- and aminothiolato hydrido complexes","New J. Chem.","2017","41","8","3015","","10.1039/C6NJ04042J","","","0.71073","MoKα","","0.0799","0.054","","","0.1382","0.151","","","","","","1.036","","","","has coordinates,has disorder","196490","2020-10-21","18:00:00",""
"7056045","13.894","0.0004","13.894","0.0004","28.8987","0.001","90","","90","","90","","5578.7","0.3","203","2","203","2","","","","","","","","5","I 41 c d","I 4bw -2c","110","","","","- C27 H28 N4 O10 Zn2 -","- C27 H28 N4 O10 Zn2 -","- C216 H224 N32 O80 Zn16 -","8","0.5","","Altaf, Muhammad; Mansha, Muhammad; Sohail, Manzar; Isab, Anvarhusein A.; Ullah, Nisar; Khan, Safyan A.; Sher, Muhammad; Stoeckli-Evans, Helen","Synthesis, structures and photoluminescence properties of mixed ligand divalent metal‒organic frameworks","New J. Chem.","2017","41","8","2980","","10.1039/C7NJ00188F","","","0.71073","MoKα","","0.0234","0.0211","","","0.049","0.0496","","","","","","1.04","","","","has coordinates","196487","2020-10-21","18:00:00",""
"7056046","14.1991","0.001","13.4825","0.0008","14.6649","0.0011","90","","117.027","0.005","90","","2500.8","0.3","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 Cu N4 O10 -","- C19 H32 Cu N4 O10 -","- C76 H128 Cu4 N16 O40 -","4","1","","Altaf, Muhammad; Mansha, Muhammad; Sohail, Manzar; Isab, Anvarhusein A.; Ullah, Nisar; Khan, Safyan A.; Sher, Muhammad; Stoeckli-Evans, Helen","Synthesis, structures and photoluminescence properties of mixed ligand divalent metal‒organic frameworks","New J. Chem.","2017","41","8","2980","","10.1039/C7NJ00188F","","","0.71073","MoKα","","0.0571","0.0321","","","0.0582","0.0621","","","","","","0.879","","","","has coordinates","196487","2020-10-21","18:00:00",""
"7056047","18.3638","0.0012","10.9135","0.0004","18.8942","0.0011","90","","108.374","0.005","90","","3593.6","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H38 Co2 N6 O10 -","- C33 H38 Co2 N6 O10 -","- C132 H152 Co8 N24 O40 -","4","1","","Altaf, Muhammad; Mansha, Muhammad; Sohail, Manzar; Isab, Anvarhusein A.; Ullah, Nisar; Khan, Safyan A.; Sher, Muhammad; Stoeckli-Evans, Helen","Synthesis, structures and photoluminescence properties of mixed ligand divalent metal‒organic frameworks","New J. Chem.","2017","41","8","2980","","10.1039/C7NJ00188F","","","0.71073","MoKα","","0.0793","0.0419","","","0.081","0.088","","","","","","0.95","","","","has coordinates","196487","2020-10-21","18:00:00",""
"7056048","8.3612","0.0007","10.4096","0.0009","14.7569","0.0011","95.769","0.007","97.078","0.006","94.544","0.007","1262.68","0.18","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H24 Ag N4 O4 P -","- C26 H24 Ag N4 O4 P -","- C52 H48 Ag2 N8 O8 P2 -","2","1","","Durini, Sara; Ardizzoia, G. Attilio; Therrien, Bruno; Brenna, Stefano","Tuning the fluorescence emission in mononuclear heteroleptic trigonal silver(i) complexes","New J. Chem.","2017","41","8","3006","","10.1039/C6NJ04058F","","","0.71073","MoKα","","0.0465","0.0281","","","0.0549","0.0572","","","","","","0.816","","","","has coordinates","196488","2020-10-21","18:00:00",""
"7056049","30.9447","0.0016","9.9074","0.0003","21.4664","0.0011","90","","108.445","0.004","90","","6243.1","0.5","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H28 Ag N4 O4 P -","- C36 H28 Ag N4 O4 P -","- C288 H224 Ag8 N32 O32 P8 -","8","1","","Durini, Sara; Ardizzoia, G. Attilio; Therrien, Bruno; Brenna, Stefano","Tuning the fluorescence emission in mononuclear heteroleptic trigonal silver(i) complexes","New J. Chem.","2017","41","8","3006","","10.1039/C6NJ04058F","","","0.71073","MoKα","","0.0411","0.026","","","0.0509","0.0533","","","","","","0.928","","","","has coordinates,has disorder","196488","2020-10-21","18:00:00",""
"7056050","19.5618","0.0005","8.2302","0.0011","20.9709","0.0011","90","","112.52","","90","","3118.8","0.5","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H40 Ag N4 O4 P -","- C30 H40 Ag N4 O4 P -","- C120 H160 Ag4 N16 O16 P4 -","4","1","","Durini, Sara; Ardizzoia, G. Attilio; Therrien, Bruno; Brenna, Stefano","Tuning the fluorescence emission in mononuclear heteroleptic trigonal silver(i) complexes","New J. Chem.","2017","41","8","3006","","10.1039/C6NJ04058F","","","0.71073","MoKα","","0.0623","0.0408","","","0.0922","0.0977","","","","","","0.906","","","","has coordinates","196488","2020-10-21","18:00:00",""
"7056051","9.3609","0.0004","13.7302","0.0007","26.0386","0.001","90","","100.355","0.001","90","","3292.2","0.3","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 Ag N4 O7 P -","- C36 H28 Ag N4 O7 P -","- C144 H112 Ag4 N16 O28 P4 -","4","1","","Durini, Sara; Ardizzoia, G. Attilio; Therrien, Bruno; Brenna, Stefano","Tuning the fluorescence emission in mononuclear heteroleptic trigonal silver(i) complexes","New J. Chem.","2017","41","8","3006","","10.1039/C6NJ04058F","","","0.71073","MoKα","","0.0276","0.0216","","","0.0543","0.0554","","","","","","1.004","","","","has coordinates","196488","2020-10-21","18:00:00",""
"7056052","13.662","0.003","15.906","0.003","17.705","0.003","88.86","0.03","88.67","0.03","64.87","0.03","3482.1","1.4","113","","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H44 Co Dy F30 N6 O14 -","- C49 H37 Co Dy F30 N6 O14 -","- C98 H74 Co2 Dy2 F60 N12 O28 -","2","1","","Wang, Xiufeng; Li, Hongdao; Sun, Juan; Yang, Meng; Li, Cun; Li, Licun","LnIII‒CoII heterometallic chains based on pyridine substituted nitronyl nitroxides","New J. Chem.","2017","41","8","2973","","10.1039/C6NJ03849B","","","0.71073","MoKα","","0.1152","0.085","","","0.2183","0.2432","","","","","","1.048","","","","has coordinates,has disorder","196489","2020-10-21","18:00:00",""
"7056053","13.704","0.003","15.792","0.003","17.496","0.003","89.55","0.03","89.03","0.03","64.43","0.03","3415","1.4","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H44 Co F30 N6 O14 Y -","- C49 H37 Co F30 N6 O14 Y -","- C98 H74 Co2 F60 N12 O28 Y2 -","2","1","","Wang, Xiufeng; Li, Hongdao; Sun, Juan; Yang, Meng; Li, Cun; Li, Licun","LnIII‒CoII heterometallic chains based on pyridine substituted nitronyl nitroxides","New J. Chem.","2017","41","8","2973","","10.1039/C6NJ03849B","","","0.71073","MoKα","","0.1433","0.0933","","","0.2217","0.2543","","","","","","1.023","","","","has coordinates,has disorder","196489","2020-10-21","18:00:00",""
"7056054","13.649","0.003","15.974","0.003","17.707","0.003","88.65","0.03","88.66","0.03","64.82","0.03","3492.4","1.5","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C49 H37 Co F30 Gd N6 O14 -","- C49 H37 Co F30 Gd N6 O14 -","- C98 H74 Co2 F60 Gd2 N12 O28 -","2","1","","Wang, Xiufeng; Li, Hongdao; Sun, Juan; Yang, Meng; Li, Cun; Li, Licun","LnIII‒CoII heterometallic chains based on pyridine substituted nitronyl nitroxides","New J. Chem.","2017","41","8","2973","","10.1039/C6NJ03849B","","","0.71073","MoKα","","0.1023","0.0693","","","0.151","0.1707","","","","","","1.066","","","","has coordinates,has disorder","196489","2020-10-21","18:00:00",""
"7056055","12.549","0.006","22.609","0.01","25.655","0.01","90","","106.736","0.018","90","","6971","5","113","2","113","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C52 H37 Co Dy F30 N6 O14 -","- C52 H37 Co Dy F30 N6 O14 -","- C208 H148 Co4 Dy4 F120 N24 O56 -","4","1","","Wang, Xiufeng; Li, Hongdao; Sun, Juan; Yang, Meng; Li, Cun; Li, Licun","LnIII‒CoII heterometallic chains based on pyridine substituted nitronyl nitroxides","New J. Chem.","2017","41","8","2973","","10.1039/C6NJ03849B","","","0.71073","MoKα","","0.0996","0.088","","","0.2293","0.2381","","","","","","1.13","","","","has coordinates,has disorder","196489","2020-10-21","18:00:00",""
"7056056","7.50613","0.00016","14.4909","0.0004","12.0626","0.0003","90","","96.839","0.002","90","","1302.72","0.06","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H27 N O12 S -","- C24 H27 N O12 S -","- C48 H54 N2 O24 S2 -","2","1","","Luque-Agudo, V.; Albarrán-Velo, J.; Fernández-Bolaños, J. G.; López, O.; Light, M. E.; Padrón, J. M.; Lagunes, I.; Román, E.; Serrano, J. A.; Gil, M. V.","Synthesis and antiproliferative activity of sulfa-Michael adducts and thiochromenes derived from carbohydrates","New J. Chem.","2017","41","8","3154","","10.1039/C6NJ03940E","","x-ray","1.54184","CuKα","","0.0392","0.0373","","","0.0956","0.0971","","","","","","1.097","","","","has coordinates","196481","2020-10-21","18:00:00",""
"7056057","7.47001","0.00014","17.3307","0.0003","10.39519","0.00018","90","","102.89","0.0018","90","","1311.85","0.04","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H31 N O14 S -","- C21 H31 N O14 S -","- C42 H62 N2 O28 S2 -","2","1","","Luque-Agudo, V.; Albarrán-Velo, J.; Fernández-Bolaños, J. G.; López, O.; Light, M. E.; Padrón, J. M.; Lagunes, I.; Román, E.; Serrano, J. A.; Gil, M. V.","Synthesis and antiproliferative activity of sulfa-Michael adducts and thiochromenes derived from carbohydrates","New J. Chem.","2017","41","8","3154","","10.1039/C6NJ03940E","","x-ray","0.71073","MoKα","","0.0316","0.0292","","","0.0734","0.0747","","","","","","1.031","","","","has coordinates","196481","2020-10-21","18:00:00",""
"7056058","16.714","0.002","19.114","0.002","19.356","0.003","90","","108.853","0.003","90","","5851.9","1.3","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C63 H48 Cl3 Hf N14 Ni O7 -","- C63 H48 Cl3 Hf N14 Ni O7 -","- C252 H192 Cl12 Hf4 N56 Ni4 O28 -","4","1","","Dudkin, Semyon V.; Belov, Alexander S.; Nelyubina, Yulia V.; Savchuk, Anastasia V.; Pavlov, Alexander A.; Novikov, Valentin V.; Voloshin, Yan Z.","Synthesis, X-ray structure and electrochemical properties of hybrid binuclear metallophthalocyaninate-capped tris-pyridineoximates","New J. Chem.","2017","41","9","3251","","10.1039/C7NJ00131B","","","0.71073","MoKα","","0.0813","0.0486","","","0.0887","0.1013","","","","","","1.067","","","","has coordinates,has disorder","196492","2020-10-21","18:00:00",""
"7056059","12.7726","0.0016","12.7063","0.0016","29.868","0.004","90","","100.255","0.002","90","","4769.9","1.1","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C53 H37 Cl Fe N14 O7 Zr -","- C53 H37 Cl Fe N14 O7 Zr -","- C212 H148 Cl4 Fe4 N56 O28 Zr4 -","4","1","","Dudkin, Semyon V.; Belov, Alexander S.; Nelyubina, Yulia V.; Savchuk, Anastasia V.; Pavlov, Alexander A.; Novikov, Valentin V.; Voloshin, Yan Z.","Synthesis, X-ray structure and electrochemical properties of hybrid binuclear metallophthalocyaninate-capped tris-pyridineoximates","New J. Chem.","2017","41","9","3251","","10.1039/C7NJ00131B","","","0.71073","MoKα","","0.1614","0.1076","","","0.2301","0.2488","","","","","","1.558","","","","has coordinates","196492","2020-10-21","18:00:00",""
"7056060","12.1688","0.0019","13.742","0.002","15.64","0.002","79.198","0.003","81.175","0.003","89.104","0.004","2538.4","0.6","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C53 H37 Cl Fe Hf N14 O7 -","- C53 H37 Cl Fe Hf N14 O7 -","- C106 H74 Cl2 Fe2 Hf2 N28 O14 -","2","1","","Dudkin, Semyon V.; Belov, Alexander S.; Nelyubina, Yulia V.; Savchuk, Anastasia V.; Pavlov, Alexander A.; Novikov, Valentin V.; Voloshin, Yan Z.","Synthesis, X-ray structure and electrochemical properties of hybrid binuclear metallophthalocyaninate-capped tris-pyridineoximates","New J. Chem.","2017","41","9","3251","","10.1039/C7NJ00131B","","","0.71073","MoKα","","0.0962","0.071","","","0.1653","0.1807","","","","","","1.002","","","","has coordinates","196492","2020-10-21","18:00:00",""
"7056061","12.3075","0.0016","13.6996","0.0018","16.041","0.002","76.481","0.003","79.763","0.003","87.948","0.003","2587.8","0.6","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C53 H37 Cl N14 Ni O7 Zr -","- C53 H37 Cl N14 Ni O7 Zr -","- C106 H74 Cl2 N28 Ni2 O14 Zr2 -","2","1","","Dudkin, Semyon V.; Belov, Alexander S.; Nelyubina, Yulia V.; Savchuk, Anastasia V.; Pavlov, Alexander A.; Novikov, Valentin V.; Voloshin, Yan Z.","Synthesis, X-ray structure and electrochemical properties of hybrid binuclear metallophthalocyaninate-capped tris-pyridineoximates","New J. Chem.","2017","41","9","3251","","10.1039/C7NJ00131B","","","0.71073","MoKα","","0.0931","0.0583","","","0.135","0.1487","","","","","","1.019","","","","has coordinates","196492","2020-10-21","18:00:00",""
"7056062","12.9295","0.0006","12.9295","0.0006","31.955","0.003","90","","90","","120","","4626.3","0.5","120","2","120","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C27 H36 Cl N6 Ni O7 Sb -","- C27 H36 Cl N6 Ni O7 Sb -","- C162 H216 Cl6 N36 Ni6 O42 Sb6 -","6","0.333333","","Dudkin, Semyon V.; Belov, Alexander S.; Nelyubina, Yulia V.; Savchuk, Anastasia V.; Pavlov, Alexander A.; Novikov, Valentin V.; Voloshin, Yan Z.","Synthesis, X-ray structure and electrochemical properties of hybrid binuclear metallophthalocyaninate-capped tris-pyridineoximates","New J. Chem.","2017","41","9","3251","","10.1039/C7NJ00131B","","","0.71073","MoKα","","0.0467","0.0377","","","0.1185","0.1279","","","","","","1.015","","","","has coordinates,has disorder","196492","2020-10-21","18:00:00",""
"7056063","9.1099","0.0018","11.433","0.002","13.749","0.003","104.98","0.03","103.14","0.03","109.24","0.03","1227","0.7","100","","100","","","","","","","","","5","P -1","-P 1","2","","5-bromo-N-(3,4-dimethoxyphenethyl)-2-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)imidazo[1,2-a]pyridin-3-amine","","- C29 H31 Br N4 O2 -","- C29 H31 Br N4 O2 -","- C58 H62 Br2 N8 O4 -","2","1","","Basavanag, Unnamatla M. V.; Islas-Jácome, Alejandro; Rentería-Gómez, Angel; Conejo, Alaín S.; Kurva, Mahanandaiah; Jiménez-Halla, J. Oscar C.; Velusamy, Jayaramakrishnan; Ramos-Ortíz, Gabriel; Gámez-Montaño, Rocío","Synthesis of 2-julolidin-imidazo[1,2-a]pyridines via Groebke‒Blackburn‒Bienaymé reaction and studies of optical properties","New J. Chem.","2017","41","9","3450","","10.1039/C6NJ04044F","","","0.71073","MoKα","","0.0392","0.0289","","","0.0681","0.0713","","","","","","1.052","","","","has coordinates","196497","2020-10-21","18:00:00",""
"7056066","37.5699","0.0007","37.5699","0.0007","5.3064","0.0001","90","","90","","90","","7490","0.2","293","0.1","293","0.1","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C42 H40 N2 S4 -","- C42 H40 N2 S4 -","- C336 H320 N16 S32 -","8","1","","Croué, V.; Krykun, S.; Allain, M.; Morille, Y.; Aubriet, F.; Carré, V.; Voitenko, Z.; Goeb, S.; Sallé, M.","A self-assembled M2L4 cage incorporating electron-rich 9-(1,3-dithiol-2-ylidene)fluorene units","New J. Chem.","2017","41","9","3238","","10.1039/C7NJ00062F","","x-ray","1.54184","CuKα","","0.0944","0.0727","","","0.205","0.2286","","","","","","1.057","","","","has coordinates","196498","2020-10-21","18:00:00",""
"7056067","17.4676","0.0007","17.8158","0.0006","20.064","0.001","74.016","0.004","67.644","0.004","89.049","0.003","5524","0.5","120","1","120","2","","","","","","","","8","P -1","-P 1","2","","","","- C100 H128 B2 F8 N4 O8 Pd S16 -","- C82 H73 B2 F8 N4 Pd S8 -","- C164 H146 B4 F16 N8 Pd2 S16 -","2","1","","Croué, V.; Krykun, S.; Allain, M.; Morille, Y.; Aubriet, F.; Carré, V.; Voitenko, Z.; Goeb, S.; Sallé, M.","A self-assembled M2L4 cage incorporating electron-rich 9-(1,3-dithiol-2-ylidene)fluorene units","New J. Chem.","2017","41","9","3238","","10.1039/C7NJ00062F","","x-ray","0.67221","synchrotron","","0.2912","0.0908","","","0.2262","0.2725","","","","","","0.708","","","","has coordinates","196498","2020-10-21","18:00:00",""
"7056069","15.71","0.06","8.7","0.03","13.25","0.04","90","","90","","90","","1811","11","203","2","203","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C12 H11 Co N8 O S2 -","- C12 H11 Co N8 O S2 -","- C48 H44 Co4 N32 O4 S8 -","4","1","","Liu, Yu-Ling; Wu, De-Hong; Wang, Zhongxia; Zhang, Yi","Switchings of dielectric constant, second harmonic generation and polarization in a polar hybrid cyanometallate crystal","New J. Chem.","2017","41","8","3211","","10.1039/C6NJ03973A","","","0.71073","MoKα","","0.1365","0.1198","","","0.3049","0.3222","","","","","","1.095","","","","has coordinates","196482","2020-10-21","18:00:00",""
"7056070","15.033","0.014","8.92","0.01","13.208","0.012","90","","90","","90","","1771","3","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C12 H11 Co N8 O S2 -","- C12 H11 Co N8 O S2 -","- C48 H44 Co4 N32 O4 S8 -","4","1","","Liu, Yu-Ling; Wu, De-Hong; Wang, Zhongxia; Zhang, Yi","Switchings of dielectric constant, second harmonic generation and polarization in a polar hybrid cyanometallate crystal","New J. Chem.","2017","41","8","3211","","10.1039/C6NJ03973A","","","0.71073","MoKα","","0.1095","0.0955","","","0.2817","0.2975","","","","","","1.153","","","","has coordinates,has disorder","196482","2020-10-21","18:00:00",""
"7056071","9.1597","0.0007","10.5684","0.0007","9.9433","0.0007","90","","101.11","0.007","90","","944.51","0.12","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5-trinitromethyl-3-nitraminotriazole","5-trinitromethyl-3-nitraminotriazole","","- C3 H2 N8 O8 -","- C3 H2 N8 O8 -","- C12 H8 N32 O32 -","4","1","","Hermann, Tobias S.; Klapötke, Thomas M.; Krumm, Burkhard; Stierstorfer, Jörg","The energetic 3-trinitromethyl-5-nitramino-1H-1,2,4-triazole and nitrogen-rich salts","New J. Chem.","2017","41","8","3068","","10.1039/C7NJ00695K","","x-ray","0.71073","MoKα","","0.0373","0.0327","","","0.0794","0.0836","","","","","","1.068","","","","has coordinates","196478","2020-10-21","18:00:00",""
"7056072","6.3932","0.0007","9.4219","0.001","10.9116","0.0011","64.711","0.007","80.374","0.008","73.543","0.007","569.13","0.11","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- Mg5 Na7 O28 P8 -","- Mg4.5 Na7 O28 P8 -","- Mg4.5 Na7 O28 P8 -","1","0.5","","Ma, Ruru; Yang, Yun; Pan, Shilie; Sun, Yanzhou; Yang, Zhihua","Structure comparison and optical properties of Na7Mg4.5(P2O7)4: a sodium magnesium phosphate with isolated P2O7 units","New J. Chem.","2017","41","9","3399","","10.1039/C6NJ03986C","","","0.71073","MoKα","","0.0632","0.0426","","","0.0888","0.0976","","","","","","1.017","","","","has coordinates","196495","2020-10-21","18:00:00",""
"7056073","8.9692","0.0004","9.814","0.0004","20.2915","0.0007","90","","101.814","0.002","90","","1748.3","0.12","150","2","150.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 Cl2 N6 Ni O10 -","- C30 H48 Cl2 N6 Ni O10 -","- C60 H96 Cl4 N12 Ni2 O20 -","2","0.5","","Panja, Anangamohan; Jana, Narayan Ch.; Adak, Sarmistha; Brandão, Paula; Dlháň, Lubor; Titiš, Ján; Boča, Roman","The structure and magnetism of mono- and di-nuclear Ni(ii) complexes derived from {N3O}-donor Schiff base ligands","New J. Chem.","2017","41","8","3143","","10.1039/C7NJ00158D","","","0.71073","MoKα","","0.0616","0.0448","","","0.1095","0.1216","","","","","","1.056","","","","has coordinates,has disorder","196486","2020-10-21","18:00:00",""
"7056074","8.0642","0.0002","15.454","0.0004","17.5161","0.0006","90","","101.744","0.001","90","","2137.23","0.11","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 N3 Ni O3 -","- C22 H29 N3 Ni O3 -","- C88 H116 N12 Ni4 O12 -","4","1","","Panja, Anangamohan; Jana, Narayan Ch.; Adak, Sarmistha; Brandão, Paula; Dlháň, Lubor; Titiš, Ján; Boča, Roman","The structure and magnetism of mono- and di-nuclear Ni(ii) complexes derived from {N3O}-donor Schiff base ligands","New J. Chem.","2017","41","8","3143","","10.1039/C7NJ00158D","","","0.71073","MoKα","","0.0436","0.0312","","","0.0699","0.075","","","","","","1.026","","","","has coordinates","196486","2020-10-21","18:00:00",""
"7056075","10.8271","0.0007","15.8847","0.001","19.015","0.0013","90","","90.578","0.002","90","","3270.1","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H48 N8 Ni2 O4 -","- C32 H48 N8 Ni2 O4 -","- C128 H192 N32 Ni8 O16 -","4","1","","Panja, Anangamohan; Jana, Narayan Ch.; Adak, Sarmistha; Brandão, Paula; Dlháň, Lubor; Titiš, Ján; Boča, Roman","The structure and magnetism of mono- and di-nuclear Ni(ii) complexes derived from {N3O}-donor Schiff base ligands","New J. Chem.","2017","41","8","3143","","10.1039/C7NJ00158D","","","0.71073","MoKα","","0.1143","0.0669","","","0.1603","0.1972","","","","","","1.035","","","","has coordinates","196486","2020-10-21","18:00:00",""
"7056076","10.8625","0.0003","12.3213","0.0003","15.8254","0.0004","90","","104.349","0.001","90","","2052","0.09","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H50 N10 Ni2 O3 S4 -","- C35 H50 N10 Ni2 O3 S4 -","- C70 H100 N20 Ni4 O6 S8 -","2","0.5","","Panja, Anangamohan; Jana, Narayan Ch.; Adak, Sarmistha; Brandão, Paula; Dlháň, Lubor; Titiš, Ján; Boča, Roman","The structure and magnetism of mono- and di-nuclear Ni(ii) complexes derived from {N3O}-donor Schiff base ligands","New J. Chem.","2017","41","8","3143","","10.1039/C7NJ00158D","","","0.71073","MoKα","","0.0518","0.036","","","0.0773","0.0849","","","","","","1.064","","","","has coordinates","196486","2020-10-21","18:00:00",""
"7056077","10.8264","0.0006","15.9223","0.0008","19.0138","0.0011","90","","90.451","0.002","90","","3277.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 N12 Ni2 O2 -","- C30 H48 N12 Ni2 O2 -","- C120 H192 N48 Ni8 O8 -","4","1","","Panja, Anangamohan; Jana, Narayan Ch.; Adak, Sarmistha; Brandão, Paula; Dlháň, Lubor; Titiš, Ján; Boča, Roman","The structure and magnetism of mono- and di-nuclear Ni(ii) complexes derived from {N3O}-donor Schiff base ligands","New J. Chem.","2017","41","8","3143","","10.1039/C7NJ00158D","","","0.71073","MoKα","","0.1132","0.0775","","","0.1799","0.1988","","","","","","1.18","","","","has coordinates","196486","2020-10-21","18:00:00",""
"7056082","8.291","0.0017","30.783","0.006","7.4857","0.0015","90","","111.19","0.03","90","","1781.3","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 Cl N2 Pd -","- C19 H23 Cl N2 Pd -","- C76 H92 Cl4 N8 Pd4 -","4","1","","Zeng, Yanning; Mahmood, Qaiser; Liang, Tongling; Sun, Wen-Hua","(Co-)polymerization of methylacrylate with NBE/1-hexene by (8-arylimino-5,6,7-trihydroquinolyl)(methyl)palladium chlorides: an approaching mechanism and the polymeric microstructures","New J. Chem.","2017","41","9","3653","","10.1039/C6NJ04019E","","","0.71073","MoKα","","0.0371","0.0352","","","0.0746","0.0789","","","","","","1.011","","","","has coordinates","196496","2020-10-21","18:00:00",""
"7056083","10.871","0.002","29.16","0.006","13.427","0.003","90","","97.44","0.03","90","","4220.5","1.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H29 Cl N2 Pd -","- C22 H29 Cl N2 Pd -","- C176 H232 Cl8 N16 Pd8 -","8","2","","Zeng, Yanning; Mahmood, Qaiser; Liang, Tongling; Sun, Wen-Hua","(Co-)polymerization of methylacrylate with NBE/1-hexene by (8-arylimino-5,6,7-trihydroquinolyl)(methyl)palladium chlorides: an approaching mechanism and the polymeric microstructures","New J. Chem.","2017","41","9","3653","","10.1039/C6NJ04019E","","","0.71073","MoKα","","0.094","0.087","","","0.2369","0.2565","","","","","","1.014","","","","has coordinates","196496","2020-10-21","18:00:00",""
"7056087","15.885","0.005","14.941","0.005","16.117","0.005","90","","110.875","0.005","90","","3574","2","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C86 H64 Cu4 N10 O19 -","- C80 H48 Cu4 N8 O17 -","- C160 H96 Cu8 N16 O34 -","2","0.5","","Yang, Liu; Li, Xiao; Sun, Chun-Yi; Wu, Han; Wang, Chun-Gang; Su, Zhong-Min","A stable pillared-layer Cu(ii) metal‒organic framework with magnetic properties for dye adsorption and separation","New J. Chem.","2017","41","9","3661","","10.1039/C7NJ00389G","","","0.71069","MoKα","","0.0956","0.0563","","","0.119","0.1355","","","","","","0.998","","","","has coordinates","196493","2020-10-21","18:00:00",""
"7056088","12.6563","0.001","17.4377","0.0017","23.663","0.003","90","","102.451","0.011","90","","5099.5","0.9","173","2","173.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C57 H57 Cl3 O12 -","- C57 H57 Cl3 O12 -","- C228 H228 Cl12 O48 -","4","0.5","","Boinski, Tomasz; Szumna, Agnieszka","Hybrid[4]arenes with anthracene units and tuneable cavities","New J. Chem.","2017","41","9","3387","","10.1039/C7NJ00039A","","","1.54184","CuKα","","0.1737","0.1234","","","0.3838","0.4288","","","","","","1.345","","","","has coordinates,has disorder","196494","2020-10-21","18:00:00",""
"7056089","8.2328","0.0003","13.6539","0.0006","10.9324","0.0005","90","","102.002","0.002","90","","1202.05","0.09","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H9 Au Cl3 N -","- C9 H9 Au Cl3 N -","- C36 H36 Au4 Cl12 N4 -","4","1","","Anisimova, Tatyana B.; Kinzhalov, Mikhail A.; Guedes da Silva, M. Fátima C.; Novikov, Alexander S.; Kukushkin, Vadim Yu.; Pombeiro, Armando J. L.; Luzyanin, Konstantin V.","Addition of N-nucleophiles to gold(iii)-bound isocyanides leading to short-lived gold(iii) acyclic diaminocarbene complexes","New J. Chem.","2017","41","9","3246","","10.1039/C7NJ00529F","","","0.71073","MoKα","","0.0378","0.0301","","","0.0703","0.0731","","","","","","1.117","","","","has coordinates","196491","2020-10-21","18:00:00",""
"7056090","8.9036","0.0005","21.1337","0.0013","26.6726","0.0016","90","","90","","90","","5018.9","0.5","150","2","150","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C16 H24 Au Cl5 N2 -","- C16 H24 Au Cl5 N2 -","- C128 H192 Au8 Cl40 N16 -","8","1","","Anisimova, Tatyana B.; Kinzhalov, Mikhail A.; Guedes da Silva, M. Fátima C.; Novikov, Alexander S.; Kukushkin, Vadim Yu.; Pombeiro, Armando J. L.; Luzyanin, Konstantin V.","Addition of N-nucleophiles to gold(iii)-bound isocyanides leading to short-lived gold(iii) acyclic diaminocarbene complexes","New J. Chem.","2017","41","9","3246","","10.1039/C7NJ00529F","","","0.71073","MoKα","","0.0834","0.053","","","0.1278","0.142","","","","","","1.013","","","","has coordinates","196491","2020-10-21","18:00:00",""
"7056091","10.0454","0.001","14.1896","0.0012","19.4905","0.0018","90","","93.721","0.005","90","","2772.3","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 Au Cl6 N3 -","- C23 H22 Au Cl6 N3 -","- C92 H88 Au4 Cl24 N12 -","4","1","","Anisimova, Tatyana B.; Kinzhalov, Mikhail A.; Guedes da Silva, M. Fátima C.; Novikov, Alexander S.; Kukushkin, Vadim Yu.; Pombeiro, Armando J. L.; Luzyanin, Konstantin V.","Addition of N-nucleophiles to gold(iii)-bound isocyanides leading to short-lived gold(iii) acyclic diaminocarbene complexes","New J. Chem.","2017","41","9","3246","","10.1039/C7NJ00529F","","","0.71073","MoKα","","0.0499","0.0312","","","0.0608","0.0661","","","","","","1.012","","","","has coordinates","196491","2020-10-21","18:00:00",""
"7056139","9.371","0.004","14.361","0.007","15.685","0.006","90","","101.28","0.03","90","","2070.1","1.6","180","2","180","","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","Ethylbiquinoxen","N,N'-diethyl-3,3'-biquinoxalinium bis(tetrafluoroborate)","","- C20 H20 B2 F8 N4 -","- C20 H20 B2 F8 N4 -","- C80 H80 B8 F32 N16 -","4","0.5","","Leblanc, Nicolas; Sproules, Stephen; Powell, Annie K.","An alternative method to access diverse N,N′-diquaternised-3,3′-biquinoxalinium “biquinoxen” dications","New J. Chem.","2017","41","8","2949","","10.1039/C7NJ00531H","","","0.71073","MoKα","","0.0486","0.0389","","","0.0981","0.1082","","","","","","1.071","","","","has coordinates","196246","2020-10-21","18:00:00",""
"7056140","5.6408","0.0008","10.3136","0.001","12.233","0.002","74.13","0.005","89.422","0.006","86.861","0.006","683.52","0.16","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 N O2 -","- C17 H15 N O2 -","- C34 H30 N2 O4 -","2","1","","Dawange, Monali; Parekh, Nikita; Kumbhar, Avinash; Dehaen, Wim; Kusurkar, Radhika","A synthetic route towards 3,4-disubstituted pyrrolidin-2-ones via a Michael addition and reductive ring closing strategy","New J. Chem.","2017","41","9","3612","","10.1039/C6NJ04051A","","","1.54178","CuKα","","0.0966","0.0806","","","0.24","0.2647","","","","","","1.021","","","","has coordinates","196247","2020-10-21","18:00:00",""
"7056141","5.2152","0.00007","9.8984","0.00014","23.0406","0.0003","90","","94.557","0.0005","90","","1185.65","0.03","250","2","250","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 N O3 -","- C13 H15 N O3 -","- C52 H60 N4 O12 -","4","1","","Dawange, Monali; Parekh, Nikita; Kumbhar, Avinash; Dehaen, Wim; Kusurkar, Radhika","A synthetic route towards 3,4-disubstituted pyrrolidin-2-ones via a Michael addition and reductive ring closing strategy","New J. Chem.","2017","41","9","3612","","10.1039/C6NJ04051A","","","0.71073","MoKα","","0.0501","0.0449","","","0.1212","0.1264","","","","","","1.043","","","","has coordinates,has disorder","196247","2020-10-21","18:00:00",""
"7056142","6.42","0.0005","8.6707","0.0007","12.9072","0.001","85.11","0.007","88.215","0.006","83.692","0.006","711.37","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","CuTECP","5,10,15,20-tetra-(ethoxylcarbonyl)porphyrin copper(II)","","- C32 H28 Cu N4 O8 -","- C32 H28 Cu N4 O8 -","- C32 H28 Cu N4 O8 -","1","0.5","","Wang, Hua-Hua; Wen, Wei-Hong; Zou, Huai-Bo; Cheng, Fan; Ali, Atif; Shi, Lei; Liu, Hai-Yang; Chang, Chi-Kwong","Copper porphyrin catalyzed esterification of C(sp3)‒H via a cross-dehydrogenative coupling reaction","New J. Chem.","2017","41","9","3508","","10.1039/C6NJ03876J","","","1.54184","CuKα","","0.043","0.038","","","0.0957","0.1016","","","","","","1.041","","","","has coordinates","196248","2020-10-21","18:00:00",""
"7056143","10.5522","0.0012","11.3163","0.0018","13.8002","0.0013","90","","104.277","0.004","90","","1597","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 I N3 O Pd -","- C15 H18 I N3 O Pd -","- C60 H72 I4 N12 O4 Pd4 -","4","1","","Pandiri, Hanumanprasad; Soni, Vineeta; Gonnade, Rajesh G.; Punji, Benudhar","Development of (quinolinyl)amido-based pincer palladium complexes: a robust and phosphine-free catalyst system for C‒H arylation of benzothiazoles","New J. Chem.","2017","41","9","3543","","10.1039/C7NJ00452D","","","0.71073","MoKα","","0.0253","0.0195","","","0.0379","0.0392","","","","","","1.19","","","","has coordinates","196249","2020-10-21","18:00:00",""
"7056144","10.8321","0.0004","23.7645","0.0008","6.9558","0.0002","90","","103.107","0.002","90","","1743.91","0.1","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H23 N3 O4 Pd -","- C17 H23 N3 O4 Pd -","- C68 H92 N12 O16 Pd4 -","4","1","","Pandiri, Hanumanprasad; Soni, Vineeta; Gonnade, Rajesh G.; Punji, Benudhar","Development of (quinolinyl)amido-based pincer palladium complexes: a robust and phosphine-free catalyst system for C‒H arylation of benzothiazoles","New J. Chem.","2017","41","9","3543","","10.1039/C7NJ00452D","","","0.71073","MoKα","","0.0742","0.0621","","","0.1062","0.1099","","","","","","1.3","","","","has coordinates","196249","2020-10-21","18:00:00",""
"7056145","14.7945","0.0006","13.148","0.0005","16.0956","0.0007","90","","102.202","0.002","90","","3060.2","0.2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C15 H18 Cl N3 O Pd -","- C15 H18 Cl N3 O Pd -","- C120 H144 Cl8 N24 O8 Pd8 -","8","1","","Pandiri, Hanumanprasad; Soni, Vineeta; Gonnade, Rajesh G.; Punji, Benudhar","Development of (quinolinyl)amido-based pincer palladium complexes: a robust and phosphine-free catalyst system for C‒H arylation of benzothiazoles","New J. Chem.","2017","41","9","3543","","10.1039/C7NJ00452D","","","0.71073","MoKα","","0.0187","0.0181","","","0.042","0.0423","","","","","","1.101","","","","has coordinates","196249","2020-10-21","18:00:00",""
"7056146","9.6605","0.0006","22.2522","0.0014","11.3772","0.0007","90","","106.976","0.002","90","","2339.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H15 N O8 Zn2 -","- C24 H15 N O8 Zn2 -","- C96 H60 N4 O32 Zn8 -","4","1","","Lu, Lu; Wang, Jun; Xie, Bin; Liu, Jian-Qiang; Yadav, Reena; Singh, Amita; Kumar, Abhinav","Fluorescence sensing of nitro-aromatics by Zn(ii) and Cd(ii) based coordination polymers having the 5-[bis(4-carboxybenzyl)-amino]isophthalic acid ligand","New J. Chem.","2017","41","9","3537","","10.1039/C7NJ00183E","","","0.71073","MoKα","","0.0374","0.03","","","0.0791","0.0823","","","","","","1.084","","","","has coordinates","196250","2020-10-21","18:00:00",""
"7056147","25.448","0.015","15.151","0.008","11.157","0.007","90","","108.613","0.01","90","","4077","4","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C48 H35 N5 O10 Zn2 -","- C48 H35 N5 O10 Zn2 -","- C192 H140 N20 O40 Zn8 -","4","1","","Lu, Lu; Wang, Jun; Xie, Bin; Liu, Jian-Qiang; Yadav, Reena; Singh, Amita; Kumar, Abhinav","Fluorescence sensing of nitro-aromatics by Zn(ii) and Cd(ii) based coordination polymers having the 5-[bis(4-carboxybenzyl)-amino]isophthalic acid ligand","New J. Chem.","2017","41","9","3537","","10.1039/C7NJ00183E","","","0.71073","MoKα","","0.0668","0.0455","","","0.096","0.1235","","","","","","1.013","","","","has coordinates","196250","2020-10-21","18:00:00",""
"7056148","14.915","0.0009","15.7739","0.0009","16.032","0.0009","100.659","0.0007","112.209","0.0006","107.228","0.0007","3141.7","0.3","100","2","100.15","","","","","","","","","6","P -1","-P 1","2","","","","- C48 H32 Cd3 N2 Na2 O26 -","- C48 H32 Cd3 N2 Na2 O26 -","- C96 H64 Cd6 N4 Na4 O52 -","2","1","","Lu, Lu; Wang, Jun; Xie, Bin; Liu, Jian-Qiang; Yadav, Reena; Singh, Amita; Kumar, Abhinav","Fluorescence sensing of nitro-aromatics by Zn(ii) and Cd(ii) based coordination polymers having the 5-[bis(4-carboxybenzyl)-amino]isophthalic acid ligand","New J. Chem.","2017","41","9","3537","","10.1039/C7NJ00183E","","","0.71073","MoKα","","0.0721","0.0587","","","0.1633","0.1778","","","","","","1.026","","","","has coordinates,has disorder","196250","2020-10-21","18:00:00",""
"7056149","7.3373","0.0003","10.1984","0.0005","12.8665","0.0007","94.353","0.003","105.694","0.003","101.173","0.003","900.89","0.08","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 I N4 Pt -","- C15 H17 I N4 Pt -","- C30 H34 I2 N8 Pt2 -","2","1","","Ghosh, Biswa Nath; Schlecht, Sabine; Bauzá, Antonio; Frontera, Antonio","Mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of 3-substituted pyridines","New J. Chem.","2017","41","9","3498","","10.1039/C7NJ00337D","","","0.71073","MoKα","","0.0348","0.0295","","","0.0665","0.0692","","","","","","1.066","","","","has coordinates","196251","2020-10-21","18:00:00",""
"7056150","13.06443","0.00014","10.05977","0.00012","13.11539","0.00014","90","","92.2805","0.001","90","","1722.33","0.03","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 I N4 Pt -","- C15 H17 I N4 Pt -","- C60 H68 I4 N16 Pt4 -","4","1","","Ghosh, Biswa Nath; Schlecht, Sabine; Bauzá, Antonio; Frontera, Antonio","Mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of 3-substituted pyridines","New J. Chem.","2017","41","9","3498","","10.1039/C7NJ00337D","","","0.71073","MoKα","","0.0244","0.0227","","","0.0571","0.0581","","","","","","1.07","","","","has coordinates","196251","2020-10-21","18:00:00",""
"7056151","7.74628","0.00016","30.9134","0.0008","9.8163","0.0002","90","","93.4459","0.0018","90","","2346.4","0.09","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H26 I2 N4 Pt2 -","- C18 H26 I2 N4 Pt2 -","- C72 H104 I8 N16 Pt8 -","4","1","","Ghosh, Biswa Nath; Schlecht, Sabine; Bauzá, Antonio; Frontera, Antonio","Mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of 3-substituted pyridines","New J. Chem.","2017","41","9","3498","","10.1039/C7NJ00337D","","","0.71073","MoKα","","0.0374","0.0346","","","0.0806","0.0826","","","","","","1.131","","","","has coordinates","196251","2020-10-21","18:00:00",""
"7056152","14.7578","0.0015","7.6872","0.0009","17.2104","0.0018","90","","113.803","0.011","90","","1786.4","0.4","193","2","193","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C15 H23 I N2 O2 Pt -","- C15 H23 I N2 O2 Pt -","- C60 H92 I4 N8 O8 Pt4 -","4","1","","Ghosh, Biswa Nath; Schlecht, Sabine; Bauzá, Antonio; Frontera, Antonio","Mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of 3-substituted pyridines","New J. Chem.","2017","41","9","3498","","10.1039/C7NJ00337D","","","0.71073","MoKα","","0.029","0.0245","","","0.0638","0.065","","","","","","1.012","","","","has coordinates","196251","2020-10-21","18:00:00",""
"7056153","8.24465","0.00015","13.0479","0.0002","11.24762","0.00019","90","","95.0865","0.0019","90","","1205.2","0.04","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 Br2 I2 N2 Pt2 -","- C16 H26 Br2 I2 N2 Pt2 -","- C32 H52 Br4 I4 N4 Pt4 -","2","0.5","","Ghosh, Biswa Nath; Schlecht, Sabine; Bauzá, Antonio; Frontera, Antonio","Mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of 3-substituted pyridines","New J. Chem.","2017","41","9","3498","","10.1039/C7NJ00337D","","","0.71073","MoKα","","0.0203","0.019","","","0.0443","0.045","","","","","","1.044","","","","has coordinates","196251","2020-10-21","18:00:00",""
"7056154","10.5118","0.0005","13.8528","0.0008","19.5175","0.0006","98.402","0.004","90.407","0.003","90.95","0.004","2811.1","0.2","130","1","130","1","","","","","","","","4","P -1","-P 1","2","","","","- C50 H46 O14 Si10 -","- C50 H46 O14 Si10 -","- C100 H92 O28 Si20 -","2","1","","Walczak, M.; Januszewski, R.; Majchrzak, M.; Kubicki, M.; Dudziec, B.; Marciniec, B.","Unusual cis and trans architecture of dihydrofunctional double-decker shaped silsesquioxane and synthesis of its ethyl bridged π-conjugated arene derivatives","New J. Chem.","2017","41","9","3290","","10.1039/C7NJ00255F","","","0.7107","MoKα","","0.0725","0.0472","","","0.125","0.1361","","","","","","1.064","","","","has coordinates,has disorder","196252","2020-10-21","18:00:00",""
"7056155","8.2968","0.0003","11.2161","0.0005","27.6291","0.001","90","","97.453","0.003","90","","2549.38","0.17","130","2","130","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,3-dicyano-5,6-bis-4-(benzyloxy)phenyl pyrazine","","- C32 H22 N4 O2 -","- C32 H22 N4 O2 -","- C128 H88 N16 O8 -","4","1","","Tillo, Adam; Mlynarczyk, Dariusz T.; Popenda, Lukasz; Wicher, Barbara; Kryjewski, Michal; Szczolko, Wojciech; Jurga, Stefan; Mielcarek, Jadwiga; Gdaniec, Maria; Goslinski, Tomasz; Tykarska, Ewa","Synthesis and singlet oxygen generation of pyrazinoporphyrazines containing dendrimeric aryl substituents","New J. Chem.","2017","41","9","3586","","10.1039/C6NJ03886G","","","0.71073","MoKα","","0.0741","0.0461","","","0.0859","0.0973","","","","","","1.042","","","","has coordinates","196253","2020-10-21","18:00:00",""
"7056156","23.8249","0.0007","15.5643","0.0004","16.2565","0.0004","90","","117.473","0.003","90","","5348.4","0.3","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,3-Dicyano-5,6-bis-4-[3,5-bis(benzyloxy)benzyloxy]phenyl pyrazine","","- C62 H50 Cl4 N4 O6 -","- C62 H50 Cl4 N4 O6 -","- C248 H200 Cl16 N16 O24 -","4","0.5","","Tillo, Adam; Mlynarczyk, Dariusz T.; Popenda, Lukasz; Wicher, Barbara; Kryjewski, Michal; Szczolko, Wojciech; Jurga, Stefan; Mielcarek, Jadwiga; Gdaniec, Maria; Goslinski, Tomasz; Tykarska, Ewa","Synthesis and singlet oxygen generation of pyrazinoporphyrazines containing dendrimeric aryl substituents","New J. Chem.","2017","41","9","3586","","10.1039/C6NJ03886G","","","1.54184","CuKα","","0.0888","0.0804","","","0.2337","0.2487","","","","","","1.053","","","","has coordinates","196253","2020-10-21","18:00:00",""
"7059091","7.5472","0.0014","7.8647","0.0015","11.259","0.002","77.095","0.003","84.024","0.003","79.049","0.003","638.2","0.2","296","2","296.15","","","","","","","","","4","P -1","-P 1","2","","2,6-dibromo-9-selenabicyclo[3.3.1]nonane dibromine","","- C8 H12 Br4 Se -","- C8 H12 Br4 Se -","- C16 H24 Br8 Se2 -","2","1","","Torubaev, Yury V.; Skabitskiy, Ivan V.; Pavlova, Alina V.; Pasynskii, Alexander A.","First structural evidence of a Se‒Br‒Br halogen-bonded molecular complex","New Journal of Chemistry","2017","41","9","3606","","10.1039/C6NJ04096A","","","0.71073","MoKα","","0.1059","0.0843","","","0.2644","0.2999","","","","","","1.2306","","","","has coordinates","234775","2020-10-21","18:00:00",""
"7059092","7.66","0.003","11.291","0.004","13.427","0.005","90","","91.695","0.007","90","","1160.8","0.8","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2,6-Dibromo-9-selenabicyclo[3.3.1]nonan-9-yl)-dibromo-selenium","","- C16 H24 Br6 Se3 -","- C16 H24 Br6 Se3 -","- C32 H48 Br12 Se6 -","2","0.5","","Torubaev, Yury V.; Skabitskiy, Ivan V.; Pavlova, Alina V.; Pasynskii, Alexander A.","First structural evidence of a Se‒Br‒Br halogen-bonded molecular complex","New Journal of Chemistry","2017","41","9","3606","","10.1039/C6NJ04096A","","","0.71073","MoKα","","0.105","0.054","","","0.0966","0.1115","","","","","","0.9052","","","","has coordinates","234775","2020-10-21","18:00:00",""
"7059093","13.3579","0.0007","10.2925","0.0005","7.8592","0.0004","90","","96.667","0.001","90","","1073.22","0.09","143","2","143.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2,6-diiodo-9-selenabicyclo[3.3.1]nonane","","- C8 H12 I2 Se -","- C8 H12 I2 Se -","- C32 H48 I8 Se4 -","4","0.5","","Torubaev, Yury V.; Skabitskiy, Ivan V.; Pavlova, Alina V.; Pasynskii, Alexander A.","First structural evidence of a Se‒Br‒Br halogen-bonded molecular complex","New Journal of Chemistry","2017","41","9","3606","","10.1039/C6NJ04096A","","","0.71073","MoKα","","0.0197","0.0186","","","0.0464","0.0469","","","","","","1.0418","","","","has coordinates","234775","2020-10-21","18:00:00",""
"7059094","7.503","0.003","10.107","0.004","18.967","0.007","90","","99.587","0.005","90","","1418.2","1","296","2","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,6-dibromo-9-selenabicyclo[3.3.1]nonane diiodine","","- C8 H12 Br2 I2 Se -","- C8 H12 Br2 I2 Se -","- C32 H48 Br8 I8 Se4 -","4","1","","Torubaev, Yury V.; Skabitskiy, Ivan V.; Pavlova, Alina V.; Pasynskii, Alexander A.","First structural evidence of a Se‒Br‒Br halogen-bonded molecular complex","New Journal of Chemistry","2017","41","9","3606","","10.1039/C6NJ04096A","","","0.71073","MoKα","","0.047","0.031","","","0.0675","0.0745","","","","","","1.01","","","","has coordinates","234775","2020-10-21","18:00:00",""
"7059095","16.44","0.002","14.832","0.002","13.006","0.0019","90","","92.048","0.002","90","","3169.3","0.7","296","2","296.15","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","?2,6-dibromo-9-selenabicyclo[3.3.1]nonanebromide pentabromide","","- C8 H12 Br6.5 Se -","- C8 H12 Br6.5 Se -","- C64 H96 Br52 Se8 -","8","1","","Torubaev, Yury V.; Skabitskiy, Ivan V.; Pavlova, Alina V.; Pasynskii, Alexander A.","First structural evidence of a Se‒Br‒Br halogen-bonded molecular complex","New Journal of Chemistry","2017","41","9","3606","","10.1039/C6NJ04096A","","","0.71073","MoKα","","0.073","0.0374","","","0.0716","0.0825","","","","","","0.991","","","","has coordinates","234775","2020-10-21","18:00:00",""
"7059096","7.7674","0.0008","10.2154","0.001","18.8296","0.0019","90","","101.236","0.002","90","","1465.4","0.3","296","2","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-diiodo-9-selenabicyclo[3.3.1]nonane diiodine ?","","- C8 H12 I4 Se -","- C8 H12 I4 Se -","- C32 H48 I16 Se4 -","4","1","","Torubaev, Yury V.; Skabitskiy, Ivan V.; Pavlova, Alina V.; Pasynskii, Alexander A.","First structural evidence of a Se‒Br‒Br halogen-bonded molecular complex","New Journal of Chemistry","2017","41","9","3606","","10.1039/C6NJ04096A","","","0.71073","MoKα","","0.041","0.0271","","","0.0475","0.0512","","","","","","1.007","","","","has coordinates","234775","2020-10-21","18:00:00",""
"7059097","9.6743","0.0003","5.6824","0.0002","30.9646","0.0009","90","","91.293","0.002","90","","1701.79","0.09","294","","294","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C40 H36 N2 Ni O7 -","- C40 H36 N2 Ni O7 -","- C80 H72 N4 Ni2 O14 -","2","1","","Totta, Xanthippi; Hatzidimitriou, Antonios G.; Papadopoulos, Athanasios N.; Psomas, George","Nickel(ii)‒naproxen mixed-ligand complexes: synthesis, structure, antioxidant activity and interaction with albumins and calf-thymus DNA","New Journal of Chemistry","2017","41","11","4478","","10.1039/C7NJ00257B","","x-ray","0.71073","MoKα","","0.0468","0.0349","","0.0787","0.0734","0.0734","","","","","","1.0736","","","","has coordinates","235697","2020-10-21","18:00:00",""
"7059098","9.226","0.0007","5.9603","0.0005","30.784","0.003","90","","91.522","0.005","90","","1692.2","0.3","295","","295","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C39 H38 N2 Ni O7 -","- C39 H38 N2 Ni O7 -","- C78 H76 N4 Ni2 O14 -","2","1","","Totta, Xanthippi; Hatzidimitriou, Antonios G.; Papadopoulos, Athanasios N.; Psomas, George","Nickel(ii)‒naproxen mixed-ligand complexes: synthesis, structure, antioxidant activity and interaction with albumins and calf-thymus DNA","New Journal of Chemistry","2017","41","11","4478","","10.1039/C7NJ00257B","","x-ray","0.71073","MoKα","","0.1366","0.0588","","0.0866","0.0717","0.0717","","","","","","0.9916","","","","has coordinates","235697","2020-10-21","18:00:00",""
"7059099","11.885","0.003","11.937","0.003","12.243","0.003","113.592","0.003","107.578","0.003","91.012","0.003","1498.2","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H80 Cu4 N12 O14 -","- C52 H80 Cu4 N12 O14 -","- C52 H80 Cu4 N12 O14 -","1","0.5","","Mandal, Leena; Mandal, Shuvankar; Mohanta, Sasankasekhar","Syntheses, crystal structures, magnetochemistry and catechol oxidase activity of a tetracopper(ii) compound and a new type of dicopper(ii)-based 1D coordination polymer","New Journal of Chemistry","2017","41","11","4689","","10.1039/C7NJ00286F","","","0.71073","MoKα","","0.0859","0.0505","","","0.128","0.1492","","","","","","0.964","","","","has coordinates","235700","2020-10-21","18:00:00",""
"7059100","17.743","0.002","22.098","0.003","7.8443","0.001","90","","95.24","0.002","90","","3062.8","0.7","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H37 Cu2 N13 O3 -","- C24 H37 Cu2 N13 O3 -","- C96 H148 Cu8 N52 O12 -","4","1","","Mandal, Leena; Mandal, Shuvankar; Mohanta, Sasankasekhar","Syntheses, crystal structures, magnetochemistry and catechol oxidase activity of a tetracopper(ii) compound and a new type of dicopper(ii)-based 1D coordination polymer","New Journal of Chemistry","2017","41","11","4689","","10.1039/C7NJ00286F","","","0.71073","MoKα","","0.0527","0.0362","","","0.1006","0.1102","","","","","","1.004","","","","has coordinates","235700","2020-10-21","18:00:00",""
"7059101","7.795","0.0007","8.6094","0.0009","9.4837","0.0009","99.166","0.008","91.628","0.008","114.355","0.009","569.27","0.11","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C5 H14 Cl2 N2 O2 Pt S -","- C5 H14 Cl2 N2 O2 Pt S -","- C10 H28 Cl4 N4 O4 Pt2 S2 -","2","1","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","","0.71073","MoKα","","0.0342","0.0311","","","0.0657","0.0679","","","","","","1.038","","","","has coordinates,has disorder","235707","2020-10-21","18:00:00",""
"7059102","7.1487","0.0004","8.918","0.0005","13.5059","0.0009","82.385","0.005","87.679","0.005","66.909","0.006","785","0.09","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C10 H13 Cl2 F3 N2 O2 Pt S -","- C10 H13 Cl2 F3 N2 O2 Pt S -","- C20 H26 Cl4 F6 N4 O4 Pt2 S2 -","2","1","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","","0.71073","MoKα","","0.027","0.0222","","","0.045","0.0461","","","","","","1.025","","","","has coordinates","235707","2020-10-21","18:00:00",""
"7059103","7.0238","0.0003","9.0811","0.0004","12.9083","0.0003","91.147","0.003","94.584","0.003","111.834","0.004","760.73","0.05","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C9 H13 Cl2 N3 O4 Pt S -","- C9 H13 Cl2 N3 O4 Pt S -","- C18 H26 Cl4 N6 O8 Pt2 S2 -","2","1","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","","0.71073","MoKα","","0.0224","0.0209","","","0.0439","0.0445","","","","","","1.058","","","","has coordinates","235707","2020-10-21","18:00:00",""
"7059104","9.325","0.0008","18.8767","0.0015","17.497","0.002","90","","90","","90","","3079.9","0.5","100","2","100","2","","","","","","","","6","C m c e","-C 2ac 2","64","","","","- C9 H22 N2 O3 Pt S2 -","- C9 H22 N2 O3 Pt S2 -","- C72 H176 N16 O24 Pt8 S16 -","8","0.5","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","","0.71073","MoKα","","0.0282","0.0245","","","0.0598","0.0616","","","","","","1.124","","","","has coordinates","235707","2020-10-21","18:00:00",""
"7059105","8.0458","0.0006","11.8336","0.0007","12.242","0.0015","90","","112.759","0.008","90","","1074.82","0.18","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Cl2 N2 O2 Pt S -","- C4 H12 Cl2 N2 O2 Pt S -","- C16 H48 Cl8 N8 O8 Pt4 S4 -","4","1","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","","0.71073","MoKα","","0.0376","0.0273","","","0.0505","0.0546","","","","","","1.018","","","","has coordinates","235707","2020-10-21","18:00:00",""
"7059106","8.7261","0.0002","10.2167","0.0003","18.8842","0.0004","74.48","0.002","80.247","0.002","87.869","0.002","1598.67","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H17 N3 O5 Pt S2 -","- C11 H17 N3 O5 Pt S2 -","- C44 H68 N12 O20 Pt4 S8 -","4","2","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","x-ray","1.54184","CuKα","","0.0377","0.0313","","","0.076","0.0812","","","","","","1.084","","","","has coordinates","235707","2020-10-21","18:00:00",""
"7059107","7.7751","0.0002","15.9278","0.0005","13.8379","0.0004","90","","103.11","0.003","90","","1669.02","0.09","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 Cl2 N2 O3 Pt S -","- C10 H18 Cl2 N2 O3 Pt S -","- C40 H72 Cl8 N8 O12 Pt4 S4 -","4","1","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","","0.71073","MoKα","","0.0313","0.0252","","","0.0477","0.05","","","","","","1.064","","","","has coordinates","235707","2020-10-21","18:00:00",""
"7059108","6.5859","0.0002","19.2634","0.0007","12.796","0.0005","90","","116.115","0.003","90","","1457.66","0.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 Cl3 N2 O2 Pt S -","- C7 H19 Cl3 N2 O2 Pt S -","- C28 H76 Cl12 N8 O8 Pt4 S4 -","4","1","","Bolotin, Dmitrii S.; Demakova, Marina Ya.; Legin, Anton A.; Suslonov, Vitaliy V.; Nazarov, Alexey A.; Jakupec, Michael A.; Keppler, Bernhard K.; Kukushkin, Vadim Yu.","Amidoxime platinum(ii) complexes: pH-dependent highly selective generation and cytotoxic activity","New Journal of Chemistry","2017","41","14","6840","","10.1039/C7NJ00982H","","","0.71073","MoKα","","0.0292","0.0234","","","0.0444","0.0462","","","","","","1.05","","","","has coordinates","235707","2020-10-21","18:00:00",""
"7059109","22.391","0.005","34.918","0.008","16.505","0.004","90","","90","","90","","12904","5","298","2","298.03","","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C32 H40 Cu N10 -","- C32 H40 Cu N10 -","- C512 H640 Cu16 N160 -","16","1","","Jana, Oishi; Mani, Ganesan","New types of Cu and Ag clusters supported by the pyrrole-based NNN-pincer type ligand","New Journal of Chemistry","2017","41","17","9361","","10.1039/C7NJ01009E","","","0.71073","MoKα","","0.0373","0.0281","","","0.0667","0.0716","","","","","","1.047","","","","has coordinates,has disorder","235710","2020-10-21","18:00:00",""
"7059110","15.1031","0.0018","17.648","0.002","13.8061","0.0016","90","","90","","90","","3679.9","0.7","100","2","100","2","","","","","","","","5","A e a 2","A 2 -2ab","41","","","","- C32 H40 Cu4 I2 N10 -","- C32 H40 Cu4 I2 N10 -","- C128 H160 Cu16 I8 N40 -","4","0.5","","Jana, Oishi; Mani, Ganesan","New types of Cu and Ag clusters supported by the pyrrole-based NNN-pincer type ligand","New Journal of Chemistry","2017","41","17","9361","","10.1039/C7NJ01009E","","","0.71073","MoKα","","0.0172","0.017","","","0.0457","0.0458","","","","","","1.071","","","","has coordinates","235710","2020-10-21","18:00:00",""
"7059111","18.092","0.005","18.092","0.005","21.761","0.008","90","","90","","90","","7123","4","100","2","100.15","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C32 H42 Cu2 I2 N10 -","- C32 H42 Cu2 I2 N10 -","- C256 H336 Cu16 I16 N80 -","8","1","","Jana, Oishi; Mani, Ganesan","New types of Cu and Ag clusters supported by the pyrrole-based NNN-pincer type ligand","New Journal of Chemistry","2017","41","17","9361","","10.1039/C7NJ01009E","","","0.71073","MoKα","","0.0747","0.0504","","","0.141","0.1629","","","","","","1.035","","","","has coordinates","235710","2020-10-21","18:00:00",""
"7059112","23.0203","0.0008","23.0203","0.0008","16.4877","0.0012","90","","90","","120","","7566.8","0.7","299","2","299","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C48 H60 Ag3 N15 -","- C48 H60 Ag3 N15 -","- C288 H360 Ag18 N90 -","6","0.333333","","Jana, Oishi; Mani, Ganesan","New types of Cu and Ag clusters supported by the pyrrole-based NNN-pincer type ligand","New Journal of Chemistry","2017","41","17","9361","","10.1039/C7NJ01009E","","","0.71073","MoKα","","0.0827","0.0385","","","0.0575","0.0664","","","","","","0.959","","","","has coordinates","235710","2020-10-21","18:00:00",""
"7059113","12.6363","0.0014","13.8451","0.0015","14.632","0.0017","90","","101.824","0.002","90","","2505.6","0.5","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 Ag Cl2 F3 N5 O3 S -","- C18 H23 Ag Cl2 F3 N5 O3 S -","- C72 H92 Ag4 Cl8 F12 N20 O12 S4 -","4","1","","Jana, Oishi; Mani, Ganesan","New types of Cu and Ag clusters supported by the pyrrole-based NNN-pincer type ligand","New Journal of Chemistry","2017","41","17","9361","","10.1039/C7NJ01009E","","","0.71073","MoKα","","0.0569","0.0464","","","0.1419","0.1495","","","","","","1.074","","","","has coordinates","235710","2020-10-21","18:00:00",""
"7059114","19.356","0.008","10.206","0.004","17.726","0.008","90","","93.422","0.014","90","","3495","3","100","2","100.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H42 Br2 Cu2 N10 -","- C32 H42 Br2 Cu2 N10 -","- C128 H168 Br8 Cu8 N40 -","4","0.5","","Jana, Oishi; Mani, Ganesan","New types of Cu and Ag clusters supported by the pyrrole-based NNN-pincer type ligand","New Journal of Chemistry","2017","41","17","9361","","10.1039/C7NJ01009E","","","0.71073","MoKα","","0.0804","0.0448","","","0.114","0.1327","","","","","","1.032","","","","has coordinates,has disorder","235710","2020-10-21","18:00:00",""
"7059115","12.6849","0.0019","8.1184","0.0012","20.797","0.003","90","","105.296","0.003","90","","2065.8","0.5","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C3 H8 N8 O9 -","- C3 H8 N8 O9 -","- C24 H64 N64 O72 -","8","1","","Huang, Haifeng; Li, Ying; Yang, Jun; Pan, Renming; Lin, Xiangyang","Materials with good energetic properties resulting from the smart combination of nitramino and dinitromethyl group with furazan","New Journal of Chemistry","2017","41","15","7697","","10.1039/C7NJ01417A","","","0.71073","MoKα","","0.0378","0.0335","","","0.0905","0.0937","","","","","","1.011","","","","has coordinates","235714","2020-10-21","18:00:00",""
"7059116","7.588","0.002","7.666","0.002","10.104","0.003","105.941","0.006","91.695","0.006","114.65","0.005","506.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C3 H8 N8 O7 -","- C3 H8 N8 O7 -","- C6 H16 N16 O14 -","2","1","","Huang, Haifeng; Li, Ying; Yang, Jun; Pan, Renming; Lin, Xiangyang","Materials with good energetic properties resulting from the smart combination of nitramino and dinitromethyl group with furazan","New Journal of Chemistry","2017","41","15","7697","","10.1039/C7NJ01417A","","","0.71073","MoKα","","0.0653","0.0493","","","0.1154","0.1246","","","","","","1.074","","","","has coordinates","235714","2020-10-21","18:00:00",""
"7059117","21.595","0.006","18.986","0.006","7.676","0.002","90","","90","","90","","3147.2","1.6","293","2","293","2","","","","","","","","4","A e a 2","A 2 -2ab","41","","","","- C5 H14 N14 O7 -","- C5 H14 N14 O7 -","- C40 H112 N112 O56 -","8","1","","Huang, Haifeng; Li, Ying; Yang, Jun; Pan, Renming; Lin, Xiangyang","Materials with good energetic properties resulting from the smart combination of nitramino and dinitromethyl group with furazan","New Journal of Chemistry","2017","41","15","7697","","10.1039/C7NJ01417A","","","0.71073","MoKα","","0.0753","0.0576","","","0.1338","0.144","","","","","","1.018","","","","has coordinates","235714","2020-10-21","18:00:00",""
"7059118","7.5563","0.0003","9.6115","0.0005","23.9913","0.0011","90","","90","","90","","1742.43","0.14","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H22 Cl N O4 -","- C20 H22 Cl N O4 -","- C80 H88 Cl4 N4 O16 -","4","1","","Zhang, Yunan; Zhang, Dajun; Zhang, Yu; Liu, Lixin; Zhang, Xuesong; Zhang, Lei; Zhang, Yunjie; Chang, Liang; Fan, Qiushuang; Zhang, Yongbiao; Xi, Jiaming; Zhang, Qiang","Improving solubility and avoiding hygroscopicity of tetrahydroberberine by forming hydrochloride salts by introducing solvents: [HTHB]Cl, [HTHB]Cl·CH3OH and [HTHB]Cl·CH3COOH","New Journal of Chemistry","2017","41","22","13268","","10.1039/C7NJ02423A","","","0.71073","MoKα","","0.0496","0.0407","","","0.0884","0.0933","","","","","","1.036","","","","has coordinates","235716","2020-10-21","18:00:00",""
"7059119","35.9919","0.0019","7.463","0.0005","16.1702","0.0011","90","","90","","90","","4343.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H26 Cl N O6 -","- C22 H26 Cl N O6 -","- C176 H208 Cl8 N8 O48 -","8","2","","Zhang, Yunan; Zhang, Dajun; Zhang, Yu; Liu, Lixin; Zhang, Xuesong; Zhang, Lei; Zhang, Yunjie; Chang, Liang; Fan, Qiushuang; Zhang, Yongbiao; Xi, Jiaming; Zhang, Qiang","Improving solubility and avoiding hygroscopicity of tetrahydroberberine by forming hydrochloride salts by introducing solvents: [HTHB]Cl, [HTHB]Cl·CH3OH and [HTHB]Cl·CH3COOH","New Journal of Chemistry","2017","41","22","13268","","10.1039/C7NJ02423A","","","0.71073","MoKα","","0.1472","0.1427","","","0.3547","0.3563","","","","","","1.063","","","","has coordinates","235716","2020-10-21","18:00:00",""
"7059120","7.261","0.0004","15.3853","0.0008","36.6862","0.0019","90","","90","","90","","4098.3","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H26 Cl N O5 -","- C21 H26 Cl N O5 -","- C168 H208 Cl8 N8 O40 -","8","1","","Zhang, Yunan; Zhang, Dajun; Zhang, Yu; Liu, Lixin; Zhang, Xuesong; Zhang, Lei; Zhang, Yunjie; Chang, Liang; Fan, Qiushuang; Zhang, Yongbiao; Xi, Jiaming; Zhang, Qiang","Improving solubility and avoiding hygroscopicity of tetrahydroberberine by forming hydrochloride salts by introducing solvents: [HTHB]Cl, [HTHB]Cl·CH3OH and [HTHB]Cl·CH3COOH","New Journal of Chemistry","2017","41","22","13268","","10.1039/C7NJ02423A","","","0.71073","MoKα","","0.089","0.0627","","","0.181","0.2256","","","","","","1.093","","","","has coordinates","235716","2020-10-21","18:00:00",""