# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-05-19T20:59:53+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 'Nouveau Journal de Chimie') 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
"1000191","5.892","0.003","10.632","0.004","6.745","0.004","90","","105.88","0.04","90","","406.4","","","","","","","","","","","","","4","P 1 2/a 1","-P 2ya","13","","Silver chromium phosphorus sulfide (.5/.5/1/3)","","- Ag0.5 Cr0.5 P S3 -","- Ag0.5001 Cr0.5 P S3 -","- Ag2.0004 Cr2 P4 S12 -","4","1","","Colombet, P; Leblanc, A; Danot, M; Rouxel, J","Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~","Nouveau Journal de Chimie","1983","7","","333","338","","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1000192","5.892","0.003","10.632","0.004","6.745","0.004","90","","105.88","0.04","90","","406.4","","","","","","","","","","","","","4","P 1 2/a 1","-P 2ya","13","","Silver chromium phosphorus sulfide (.5/.5/1/3)","","- Ag0.5 Cr0.5 P S3 -","- Ag0.5 Cr0.5 P S3 -","- Ag2 Cr2 P4 S12 -","4","1","","Colombet, P; Leblanc, A; Danot, M; Rouxel, J","Coordinance inhabituelle de l'argent dans un sufur lamellaire a sous- reseau magnetique 1D: le compose Ag~.5~ Cr~.5~ P S~3~","Nouveau Journal de Chimie","1983","7","","333","338","","","","","","","0.038","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008258","3.796","0.003","3.796","0.003","12.447","0.005","90","","90","","90","","179.4","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","STRONTIUM LANTHANUM COBALT(III) OXIDE","","- Co La O4 Sr -","- Co La O4 Sr -","- Co2 La2 O8 Sr2 -","2","0.0625","","Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A","Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent","Nouveau Journal de Chimie","1979","3","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008259","3.799","0.003","3.799","0.003","12.454","0.005","90","","90","","90","","179.7","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","STRONTIUM LANTHANUM COBALT(III) OXIDE","","- Co La O4 Sr -","- Co La O4 Sr -","- Co2 La2 O8 Sr2 -","2","0.0625","","Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A","Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent","Nouveau Journal de Chimie","1979","3","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008260","3.806","0.003","3.806","0.003","12.5","0.005","90","","90","","90","","181.1","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","STRONTIUM LANTHANUM COBALT(III) OXIDE","","- Co La O4 Sr -","- Co La O4 Sr -","- Co2 La2 O8 Sr2 -","2","0.0625","","Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A","Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent","Nouveau Journal de Chimie","1979","3","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008261","3.807","0.003","3.807","0.003","12.52","0.005","90","","90","","90","","181.5","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","STRONTIUM LANTHANUM COBALT(III) OXIDE","","- Co La O4 Sr -","- Co La O4 Sr -","- Co2 La2 O8 Sr2 -","2","0.0625","","Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A","Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent","Nouveau Journal de Chimie","1979","3","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008262","3.811","0.003","3.811","0.003","12.554","0.005","90","","90","","90","","182.3","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","STRONTIUM LANTHANUM(III) COBALT(III) oxide","","- Co La O4 Sr -","- Co La O4 Sr -","- Co2 La2 O8 Sr2 -","2","0.0625","","Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A","Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent","Nouveau Journal de Chimie","1979","3","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008263","3.817","0.003","3.817","0.003","12.6","0.005","90","","90","","90","","183.6","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","STRONTIUM LANTHANUM TETRAOXOCOBALTATE","","- Co La O4 Sr -","- Co La O4 Sr -","- Co2 La2 O8 Sr2 -","2","0.0625","","Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A","Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent","Nouveau Journal de Chimie","1979","3","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008264","3.824","0.003","3.824","0.003","12.659","0.005","90","","90","","90","","185.1","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","STRONTIUM LANTHANUM TETRAOXOCOBALTATE","","- Co La O4 Sr -","- Co La O4 Sr -","- Co2 La2 O8 Sr2 -","2","0.0625","","Demazeau, G; Courbin, P; le, Flem G; Pouchard, M; Hagenmueller, P; Soubeyroux, J L; Main, I G; Robins, G A","Proprietes structurales et magnetiques de Sr La Co O~4~. Une discussion de la structure electronique du cobalt trivalent","Nouveau Journal de Chimie","1979","3","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1523388","24.666","","15.974","","45.271","","90","","90","","90","","17837.4","","","","","","","","","","","","","3","F m m m","-F 2 2","69","","","","- Ga19.56 Li3 Na5 -","- Ga19.5395 Li3 Na5 -","- Ga625.264 Li96 Na160 -","32","1","","Charbonnel, M.; Belin, C.","Synthesis and crystal structure of the new nonstoichiometric phase Li3 Na5 Ga19.56","Nouveau Journal de Chimie","1984","8","","595","599","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1530543","29.14","","5.574","","14.22","","90","","91.4","","90","","2309.01","","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","Na3 Nd (V O4)2","","- Na3 Nd O8 V2 -","- Na3 Nd O8 V2 -","- Na36 Nd12 O96 V24 -","12","3","","Parent, C.; Fava, J.; Lemaitre-Blaise, M.; Vlasse, M.; le Flem, G.; Salmon, R.; Hagenmuller, P.; Caro, P.; Antic-Fidancev, E.","Les vanadates Na3 Ln (V O4)2 (Ln = Pr, Nd, Sm, Eu, Gd, Tb)","Nouveau Journal de Chimie","1979","3","","523","527","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1543977","32.117","0.002","13.8184","0.0004","26.7619","0.0012","90","","110.83","0.006","90","","11100.8","1","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C20 H86 N2 Na6 O95 Ru2 Te2 W20 -","- C20 H36 N2 Na6 O97 Ru2 Te2 W20 -","- C80 H144 N8 Na24 O388 Ru8 Te8 W80 -","4","0.5","","Zheng, Da-Ming; Wang, Rui-Qiang; Du, Yu; Hou, Guang-Feng; Wu, Li-Xin; Bi, Li-Hua","A new organo-ruthenium substituted tungstotellurate: synthesis, structural characterization and catalytic properties","New J. Chem.","2016","40","10","8829","","10.1039/C6NJ01914E","","","0.71073","MoKα","","0.0866","0.0624","","","0.1294","0.145","","","","","","1.061","","","","has coordinates","187163","2020-10-21","18:00:00",""
"1544068","11.09","0.002","11.32","0.002","16.243","0.003","74.94","0.03","82.76","0.03","75.06","0.03","1898.7","0.7","113.15","","113.15","","","","","","","","","5","P -1","-P 1","2","","","","- C32 H35 N5 Nd2 O18 -","- C32 H35 N5 Nd2 O18 -","- C64 H70 N10 Nd4 O36 -","2","1","","Du, Pei-Yao; Gu, Wen; Liu, Xin","A three-dimensional Nd(iii)-based metal‒organic framework as a smart drug carrier","New J. Chem.","2016","40","11","9017","","10.1039/C6NJ02221A","","","0.71073","MoKα","","0.1055","0.0801","","","0.2135","0.2344","","","","","","1.082","","","","has coordinates,has disorder","188261","2020-10-21","18:00:00",""
"1544069","7.1366","0.0003","16.9882","0.0006","9.441","0.0004","90","","112.008","0.002","90","","1061.2","0.08","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H8 N6 O -","- C11 H8 N6 O -","- C44 H32 N24 O4 -","4","1","","Cai, Jiawei; Li, Zhixin; Qiu, Yanxuan; OuYang, Zhijian; Lin, Wenning; Yang, Liu; Feng, Weijin; Yu, Xinwei; Dong, Wen","The syntheses, structures and azo‒hydrazone tautomeric studies of three triazole/tetrazole azo dyes","New J. Chem.","2016","40","11","9370","","10.1039/C5NJ02539G","","","0.71073","MoKα","","0.0682","0.0394","","","0.0917","0.1051","","","","","","1.017","","","","has coordinates","188270","2020-10-21","18:00:00",""
"1544070","3.7787","0.0003","15.4361","0.0013","17.0098","0.0014","90","","92.735","0.006","90","","991.02","0.14","296","2","296.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 N5 O -","- C12 H7 N5 O -","- C48 H28 N20 O4 -","4","1","","Cai, Jiawei; Li, Zhixin; Qiu, Yanxuan; OuYang, Zhijian; Lin, Wenning; Yang, Liu; Feng, Weijin; Yu, Xinwei; Dong, Wen","The syntheses, structures and azo‒hydrazone tautomeric studies of three triazole/tetrazole azo dyes","New J. Chem.","2016","40","11","9370","","10.1039/C5NJ02539G","","","0.71073","MoKα","","0.1305","0.0505","","","0.1083","0.14","","","","","","0.986","","","","has coordinates","188270","2020-10-21","18:00:00",""
"1544071","6.734","0.004","12.536","0.006","9.12","0.005","90","","118.622","0.01","90","","675.8","0.6","173","2","173.15","","","","","","","","","5","C 1 m 1","C -2y","8","","","","- C10 H7 Ag2 Fe N7 -","- C10 H7 Ag2 Fe N7 -","- C20 H14 Ag4 Fe2 N14 -","2","0.5","","Gural'skiy, Il'ya A.; Shylin, Sergii I.; Golub, Bohdan O.; Ksenofontov, Vadim; Fritsky, Igor O.; Tremel, Wolfgang","High temperature spin crossover in [Fe(pyrazine){Ag(CN)2}2] and its solvate","New J. Chem.","2016","40","11","9012","","10.1039/C6NJ01472K","","","0.71073","MoKα","","0.0459","0.0389","","","0.0776","0.0791","","","","","","1.044","","","","has coordinates,has disorder","188272","2020-10-21","18:00:00",""
"1544180","6.4138","0.0006","7.6858","0.0007","15.2182","0.0014","90","","99.722","0.003","90","","739.41","0.12","299","2","299.43","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H18 N2 O2 S -","- C16 H18 N2 O2 S -","- C32 H36 N4 O4 S2 -","2","1","","Aillerie, Alexandre; Lemau de Talencé, Vincent; Dumont, Clément; Pellegrini, Sylvain; Capet, Frédéric; Bousquet, Till; Pélinski, Lydie","Enantioselective transfer hydrogenation, a key step for the synthesis of 3-aminotetrahydroquinolines","New J. Chem.","2016","40","11","9034","","10.1039/C6NJ02249A","","","0.71073","MoKα","","0.0422","0.0359","","","0.0863","0.0903","","","","","","1.02","","","","has coordinates","188264","2020-10-21","18:00:00",""
"1544181","9.2335","0.0005","11.214","0.0005","25.4777","0.0013","90","","90","","90","","2638.1","0.2","150","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H33 Fe N2 O8 -","- C26 H33 Fe N2 O8 -","- C104 H132 Fe4 N8 O32 -","4","1","","Srinivas, Palabindela; Prabhakar, Sunchu; Chevallier, Floris; Nassar, Ekhlass; Erb, William; Dorcet, Vincent; Jouikov, Viatcheslav; Radha Krishna, Palakodety; Mongin, Florence","Synthesis of ferrocene amides and esters from aminoferrocene and 2-substituted ferrocenecarboxylic acid and properties thereof","New J. Chem.","2016","40","11","9441","","10.1039/C6NJ02018F","","x-ray","0.71073","MoKα","","0.1327","0.1015","","","0.2636","0.2942","","","","","","1.037","","","","has coordinates","188265","2020-10-21","18:00:00",""
"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",""
"1548057","9.9639","0.0017","10.7932","0.0018","23.575","0.004","96.641","0.004","90.839","0.004","90.018","0.004","2518","0.7","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Perfluorooctanoic acid","pentadecafluorooctanoic acid","","- C8 H F15 O2 -","- C8 H F15 O2 -","- C64 H8 F120 O16 -","8","4","","Omorodion, Harrison; Palenzuela, Miguel; Ruether, Manuel; Twamley, Brendan; Platts, James A.; Baker, Robert J.","A rationally designed perfluorinated host for the extraction of PFOA from water utilising non-covalent interactions","New Journal of Chemistry","2018","42","10","7956","","10.1039/C7NJ03026F","","","0.71073","MoKα","","0.1549","0.0971","","","0.25","0.2831","","","","","","1.045","","","","has coordinates","230199","2020-10-21","18:00:00",""
"1549205","16.0265","0.0005","18.9031","0.0005","14.5969","0.0004","90","","107.211","0.003","90","","4224.1","0.2","293.21","0.1","293.21","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H21 Cl N P Pt -","- C26 H21 Cl N P Pt -","- C208 H168 Cl8 N8 P8 Pt8 -","8","2","","Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Pfitzner, Arno; Rashidi, Mehdi","Influence of ancillary ligands on the photophysical properties of cyclometalated organoplatinum(ii) complexes","New Journal of Chemistry","2018","42","11","8661","","10.1039/C7NJ04888B","","x-ray","1.54184","CuKα","","0.0223","0.0186","","","0.0438","0.046","","","","1.1","1.1","1.1","","","","has coordinates","230542","2020-10-21","18:00:00",""
"1549206","10.8604","0.0003","9.7288","0.0003","21.8042","0.0006","90","","92.492","0.002","90","","2301.62","0.11","296.17","0.1","296.17","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 N P Pt -","- C28 H26 N P Pt -","- C112 H104 N4 P4 Pt4 -","4","1","","Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Pfitzner, Arno; Rashidi, Mehdi","Influence of ancillary ligands on the photophysical properties of cyclometalated organoplatinum(ii) complexes","New Journal of Chemistry","2018","42","11","8661","","10.1039/C7NJ04888B","","x-ray","1.54184","CuKα","","0.0197","0.0165","","","0.0399","0.0414","","","","1.23","1.23","1.2","","","","has coordinates","230542","2020-10-21","18:00:00",""
"1549207","10.8827","0.0003","11.0853","0.0004","11.3916","0.0002","95.334","0.002","100.076","0.0018","99.549","0.002","1323.75","0.07","122.99","0.1","122.99","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H28 N P Pt -","- C33 H28 N P Pt -","- C66 H56 N2 P2 Pt2 -","2","1","","Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Pfitzner, Arno; Rashidi, Mehdi","Influence of ancillary ligands on the photophysical properties of cyclometalated organoplatinum(ii) complexes","New Journal of Chemistry","2018","42","11","8661","","10.1039/C7NJ04888B","","x-ray","0.71073","MoKα","","0.0208","0.0177","","","0.0449","0.0459","","","","1.34","1.34","1.33","","","","has coordinates","230542","2020-10-21","18:00:00",""
"1549208","7.7445","0.0003","7.536","0.0003","9.9477","0.0004","90","","92.123","0.004","90","","580.17","0.04","150","1","150","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H16 O5 S -","- C9 H16 O5 S -","- C18 H32 O10 S2 -","2","1","","Pisareva, A. V.; Shilov, G. V.; Karelin, A. I.; Pisarev, R. V.; Shilova, I. A.; Dobrovolsky, Yu A.; Aldoshin, S. M.","Synthesis, structure and proton conductivity of 2,4,5-trimethylbenzenesulfonic acid dihydrate","New Journal of Chemistry","2018","42","9","7428","","10.1039/C7NJ05068B","","","0.7107","MoKα","","0.0337","0.0323","","","0.0789","0.0809","","","","","","1.094","","","","has coordinates","230440","2020-10-21","18:00:00",""
"1549209","25.144","0.0014","13.56","0.0006","17.3063","0.0009","90","","112.785","0.007","90","","5440.2","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H66 Fe2 N6 O5 -","- C56 H66 Fe2 N6 O5 -","- C224 H264 Fe8 N24 O20 -","4","0.5","","Safaei, Elham; Alaji, Zahra; Panahi, Farhad; Wojtczak, Andrzej; Jagličić, Janez Zvonko","Synthesis and characterization of a novel oxo-bridged binuclear iron(iii) complex: its catalytic application in the synthesis of benzoxazoles using benzyl alcohol in water","New Journal of Chemistry","2018","42","9","7230","","10.1039/C8NJ00921J","","","0.71073","MoKα","","0.0653","0.0416","","","0.1114","0.1234","","","","","","0.998","","","","has coordinates","230436","2020-10-21","18:00:00",""
"1549210","9.994","0.002","10.991","0.002","13.402","0.003","94.44","0.03","111.73","0.03","106.35","0.03","1284.7","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H28 N2 Pt -","- C30 H28 N2 Pt -","- C60 H56 N4 Pt2 -","2","1","","Fereidoonnezhad, Masood; Shahsavari, Hamid R.; Abedanzadeh, Sedigheh; Nezafati, Ali; Khazali, Ali; Mastrorilli, Piero; Babaghasabha, Mojgan; Webb, James; Faghih, Zeinab; Faghih, Zahra; Bahemmat, Samira; Beyzavi, M. Hassan","Synthesis, structural characterization, biological evaluation and molecular docking studies of new platinum(ii) complexes containing isocyanides","New Journal of Chemistry","2018","42","11","8681","","10.1039/C7NJ04819J","","","0.71073","MoKα","","0.0684","0.0568","","","0.1255","0.1299","","","","","","1.012","","","","has coordinates","230520","2020-10-21","18:00:00",""
"1549211","21.288","0.01","10.071","0.005","26.44","0.013","90","","112.811","0.018","90","","5225","4","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 Al N O3 -","- C27 H38 Al N O3 -","- C216 H304 Al8 N8 O24 -","8","2","","Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee","Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone","New Journal of Chemistry","2018","42","11","8374","","10.1039/C8NJ00937F","","","0.71073","MoKα","","0.0779","0.053","","","0.1354","0.1485","","","","","","1.041","","","","has coordinates","230534","2020-10-21","18:00:00",""
"1549212","18.3409","0.0019","6.4457","0.0006","38.253","0.003","90","","95.468","0.007","90","","4501.7","0.7","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H33 N O3 -","- C25 H33 N O3 -","- C200 H264 N8 O24 -","8","1","","Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee","Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone","New Journal of Chemistry","2018","42","11","8374","","10.1039/C8NJ00937F","","","0.71073","MoKα","","0.0847","0.0785","","","0.1605","0.1634","","","","","","1.09","","","","has coordinates","230534","2020-10-21","18:00:00",""
"1549213","21.164","0.003","10.0463","0.0013","26.332","0.003","90","","112.398","0.004","90","","5176.3","1.2","133","","133","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H35 Al Cl N O3 -","- C26 H35 Al Cl N O3 -","- C208 H280 Al8 Cl8 N8 O24 -","8","2","","Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee","Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone","New Journal of Chemistry","2018","42","11","8374","","10.1039/C8NJ00937F","","","0.71073","MoKα","","0.0758","0.0524","","","0.1235","0.1362","","","","","","1.054","","","","has coordinates,has disorder","230534","2020-10-21","18:00:00",""
"1549214","10.098","0.005","10.771","0.004","14.599","0.008","105.627","0.016","97.16","0.02","96.551","0.013","1499","1.3","150","2","150","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H44 Al N O4 -","- C30.0024 H44.0072 Al N O4 -","- C60.0048 H88.0144 Al2 N2 O8 -","2","1","","Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee","Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone","New Journal of Chemistry","2018","42","11","8374","","10.1039/C8NJ00937F","","","0.71073","MoKα","","0.0587","0.0514","","","0.1293","0.1343","","","","","","1.028","","","","has coordinates,has disorder","230534","2020-10-21","18:00:00",""
"1549220","9.6247","0.0005","15.2549","0.0008","12.526","0.0009","90","","95.154","0.005","90","","1831.68","0.19","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 N S -","- C25 H18 N S -","- C100 H72 N4 S4 -","4","1","","Ponram, Marimuthu; Balijapalli, Umamahesh; Sambath, Baskaran; Iyer, Sathiyanarayanan Kulathu; B, Venkatachalapathy; Cingaram, Ravichandran; Natesan Sundaramurthy, Karthikeyan","Development of paper-based chemosensor for the detection of mercury ions using mono- and tetra-sulfur bearing phenanthridines","New Journal of Chemistry","2018","42","11","8530","","10.1039/C8NJ00760H","","","1.54184","CuKα","","0.1067","0.0853","","","0.224","0.2635","","","","","","0.97","","","","has coordinates","230539","2020-10-21","18:00:00",""
"1549395","10.5005","0.001","10.5156","0.001","11.1246","0.001","83.611","0.002","66.854","0.002","74.875","0.002","1090.31","0.18","296","2","296","2","","","","","","","","6","P 1","P 1","1","","","","- C47 H36 Dy F9 N2 O6 -","- C47 H36 Dy F9 N2 O6 -","- C47 H36 Dy F9 N2 O6 -","1","1","","Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming","A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties","New Journal of Chemistry","2018","42","13","10906","","10.1039/C8NJ01659C","","","0.71073","MoKα","","0.0282","0.0279","","","0.0761","0.0835","","","","","","1.021","","","","has coordinates","230393","2020-10-21","18:00:00",""
"1549396","10.4994","0.001","10.5083","0.001","11.1201","0.001","83.608","0.002","66.819","0.001","74.881","0.002","1088.75","0.18","296","2","296","2","","","","","","","","6","P 1","P 1","1","","","","- C47 H36 Dy F9 N2 O6 -","- C47 H36 Dy F9 N2 O6 -","- C47 H36 Dy F9 N2 O6 -","1","1","","Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming","A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties","New Journal of Chemistry","2018","42","13","10906","","10.1039/C8NJ01659C","","","0.71073","MoKα","","0.0293","0.0275","","","0.0756","0.0966","","","","","","1.045","","","","has coordinates","230393","2020-10-21","18:00:00",""
"1550821","10.4191","0.0005","11.0485","0.0005","13.1357","0.0005","87.451","0.002","81.029","0.001","75.138","0.002","1443.64","0.11","122","2","122","2","","","","","","","","3","P -1","-P 1","2","","","","- C72 H74 O4 -","- C72 H74 O4 -","- C72 H74 O4 -","1","0.5","","Kapf, Andreas; Eslahi, Hassan; Blanke, Meik; Saccone, Marco; Giese, Michael; Albrecht, Marcel","Alkyloxy modified pyrene fluorophores with tunable photophysical and crystalline properties","New Journal of Chemistry","2019","43","16","6361","","10.1039/C9NJ00652D","","","0.71073","MoKα","","0.0993","0.0493","","","0.1139","0.1407","","","","","","1.004","","","","has coordinates","224843","2020-10-21","18:00:00",""
"1550822","9.701","0.003","12.944","0.004","17.212","0.005","76.316","0.009","80.633","0.008","74.795","0.009","2014.7","1.1","122","2","122","2","","","","","","","","3","P -1","-P 1","2","","","","- C96 H122 O4 -","- C96 H122 O4 -","- C96 H122 O4 -","1","0.5","","Kapf, Andreas; Eslahi, Hassan; Blanke, Meik; Saccone, Marco; Giese, Michael; Albrecht, Marcel","Alkyloxy modified pyrene fluorophores with tunable photophysical and crystalline properties","New Journal of Chemistry","2019","43","16","6361","","10.1039/C9NJ00652D","","","0.71073","MoKα","","0.2736","0.07","","","0.1197","0.1838","","","","","","0.86","","","","has coordinates,has disorder","224843","2020-10-21","18:00:00",""
"1551241","16.375","0.003","12.327","0.003","17.399","0.004","90","","102.25","0.03","90","","3432.1","1.4","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C26 H20 B2 F8 Fe N8 -","- C26 H20 B2 F8 Fe N8 -","- C104 H80 B8 F32 Fe4 N32 -","4","0.5","","Sánchez-Viveros, José Manuel; Bucio-Ortega, Job; Ortiz-Pastrana, Naytzé; Olguín, Juan","Mononuclear complexes of FeII, CoII and CoIII containing imine-based ligands of 8-aminoquinoline and 7-aminoindazole: spin state tuning of FeII complexes in solution","New Journal of Chemistry","2019","43","25","9776","","10.1039/C9NJ01622H","","","0.71073","MoKα","","0.1046","0.0587","","","0.157","0.1812","","","","","","1.037","","","","has coordinates","224857","2020-10-21","18:00:00",""
"1551242","21.699","0.009","12.54","0.004","15.873","0.008","90","","119.63","0.02","90","","3754","3","166","2","166","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H66 B4 Co2 F16 N16 O5 -","- C60 H66 B4 Co2 F16 N16 O5 -","- C120 H132 B8 Co4 F32 N32 O10 -","2","0.25","","Sánchez-Viveros, José Manuel; Bucio-Ortega, Job; Ortiz-Pastrana, Naytzé; Olguín, Juan","Mononuclear complexes of FeII, CoII and CoIII containing imine-based ligands of 8-aminoquinoline and 7-aminoindazole: spin state tuning of FeII complexes in solution","New Journal of Chemistry","2019","43","25","9776","","10.1039/C9NJ01622H","","","0.71073","MoKα","","0.0692","0.054","","","0.1564","0.1683","","","","","","1.038","","","","has coordinates,has disorder","224857","2020-10-21","18:00:00",""
"1551243","12.1427","0.0007","15.5443","0.0009","19.5164","0.0012","90","","106.57","0.002","90","","3530.7","0.4","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31 H25 B2 Co F8 N6 O -","- C31 H25 B2 Co F8 N6 O -","- C124 H100 B8 Co4 F32 N24 O4 -","4","1","","Sánchez-Viveros, José Manuel; Bucio-Ortega, Job; Ortiz-Pastrana, Naytzé; Olguín, Juan","Mononuclear complexes of FeII, CoII and CoIII containing imine-based ligands of 8-aminoquinoline and 7-aminoindazole: spin state tuning of FeII complexes in solution","New Journal of Chemistry","2019","43","25","9776","","10.1039/C9NJ01622H","","","0.71073","MoKα","","0.084","0.062","","","0.1709","0.1892","","","","","","0.971","","","","has coordinates,has disorder","224857","2020-10-21","18:00:00",""
"1551256","6.6329","0.0004","9.5423","0.0006","13.8849","0.0009","85.573","0.002","89.691","0.002","87.1","0.002","875.07","0.1","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","bis(3-hydroxy-1-methyl-4-pyridinecarboxylato)-monoaqua-copper(II) trihydrate","","- C14 H20 Cu N2 O10 -","- C14 H20 Cu N2 O10 -","- C28 H40 Cu2 N4 O20 -","2","1","","May, Nóra V.; Gál, G. Tamás; Szentendrei, Zsolt; Korecz, László; May, Zoltán; Ferlin, Maria Grazia; Dean, Annalisa; Bombicz, Petra; Di Marco, Valerio B.","Relationship between solid state structure and solution stability of copper(ii)‒hydroxypyridinecarboxylate complexes","New Journal of Chemistry","2019","43","27","10699","","10.1039/C9NJ01469A","","","0.71073","MoKα","","0.0341","0.0307","","","0.0789","0.0826","","","","","","1.12","","","","has coordinates","224716","2020-10-21","18:00:00",""
"1551257","12.1956","0.0004","12.4877","0.0004","12.6185","0.0005","98.978","0.001","91.071","0.001","113.119","0.001","1738.97","0.11","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","""'bis(μ2-4-hydroxy-1-(2-hydroxyethyl)-6-methyl-3-pyridinecarboxylato)-bis(μ2-4-hydroxy-1-(2-hydroxyethyl)-6-methyl-3-pyridinecarboxylato)-bis(μ2-4-hydroxy-1-(2-hydroxyethyl)-6-methyl-3-pyridinecarboxylato)-tri-copper(II) nonahydrate'""","","- C54 H88 Cu3 N6 O42 -","- C54 H88 Cu3 N6 O42 -","- C54 H88 Cu3 N6 O42 -","1","0.5","","May, Nóra V.; Gál, G. Tamás; Szentendrei, Zsolt; Korecz, László; May, Zoltán; Ferlin, Maria Grazia; Dean, Annalisa; Bombicz, Petra; Di Marco, Valerio B.","Relationship between solid state structure and solution stability of copper(ii)‒hydroxypyridinecarboxylate complexes","New Journal of Chemistry","2019","43","27","10699","","10.1039/C9NJ01469A","","","0.71073","MoKα","","0.0508","0.0415","","","0.1063","0.1168","","","","","","1.088","","","","has coordinates","224716","2020-10-21","18:00:00",""
"1551258","7.9481","0.0004","8.7896","0.0004","11.4208","0.0006","90.722","0.003","106.939","0.003","104.188","0.003","736.93","0.07","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","'bis(μ2-4-hydroxy-1-methyl-3-pyridinecarboxylato)-bis(μ2-4-hydroxy-1-methyl-3-pyridinecarboxylato)-di-copper(II) tetrahydrate'","","- C14 H16 Cu N2 O8 -","- C14 H16 Cu N2 O8 -","- C28 H32 Cu2 N4 O16 -","2","1","","May, Nóra V.; Gál, G. Tamás; Szentendrei, Zsolt; Korecz, László; May, Zoltán; Ferlin, Maria Grazia; Dean, Annalisa; Bombicz, Petra; Di Marco, Valerio B.","Relationship between solid state structure and solution stability of copper(ii)–hydroxypyridinecarboxylate complexes","New Journal of Chemistry","2019","43","27","10699","","10.1039/C9NJ01469A","","","1.54187","CuKα","","0.0701","0.0612","","","0.1561","0.1761","","","","","","1.166","","","","has coordinates","277994","2022-09-20","08:32:41",""
"1551259","9.486","0.0004","11.1725","0.0005","12.3239","0.0005","98.487","0.001","102.339","0.001","106.545","0.001","1192.43","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","'bis(μ2-3-hydroxy-1,2,6-trimethyl-4-pyridinecarboxylato)-di-copper(II) hexahydrate'","","- C36 H61 Cu2 N4 O24 -","- C36 H61 Cu2 N4 O24 -","- C36 H61 Cu2 N4 O24 -","1","0.5","","May, Nóra V.; Gál, G. Tamás; Szentendrei, Zsolt; Korecz, László; May, Zoltán; Ferlin, Maria Grazia; Dean, Annalisa; Bombicz, Petra; Di Marco, Valerio B.","Relationship between solid state structure and solution stability of copper(ii)‒hydroxypyridinecarboxylate complexes","New Journal of Chemistry","2019","43","27","10699","","10.1039/C9NJ01469A","","","0.71073","MoKα","","0.0442","0.0377","","","0.1021","0.1064","","","","","","1.109","","","","has coordinates","224716","2020-10-21","18:00:00",""
"1551260","13.5554","0.0008","12.9227","0.0006","10.2747","0.0005","90","","90","","90","","1799.84","0.16","103","2","103","2","","","","","","","","5","P n a 21","P 2c -2n","33","","catena-(bis(μ2-4-hydroxy-1,6-dimethyl-3-pyridinecarboxylato)-copper(II) trihydrate","","- C16 H22 Cu N2 O9 -","- C16 H22 Cu N2 O9 -","- C64 H88 Cu4 N8 O36 -","4","1","","May, Nóra V.; Gál, G. Tamás; Szentendrei, Zsolt; Korecz, László; May, Zoltán; Ferlin, Maria Grazia; Dean, Annalisa; Bombicz, Petra; Di Marco, Valerio B.","Relationship between solid state structure and solution stability of copper(ii)‒hydroxypyridinecarboxylate complexes","New Journal of Chemistry","2019","43","27","10699","","10.1039/C9NJ01469A","","","0.71073","MoKα","","0.0298","0.027","","","0.0559","0.0578","","","","","","1.093","","","","has coordinates","224716","2020-10-21","18:00:00",""
"1551261","14.2076","0.0008","12.707","0.0006","15.2817","0.0009","90","","92.703","0.005","90","","2755.8","0.3","294","2","294.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Sulfamethoxazole bromide","","- C10 H12 Br N3 O3 S -","- C10 H12 Br N3 O3 S -","- C80 H96 Br8 N24 O24 S8 -","8","1","","de Moura Oliveira, Carlos H.; C. de Melo, Cristiane; Doriguetto, Antonio C.","Sulfamethoxazole salts: crystal structures, conformations and solubility","New Journal of Chemistry","2019","43","26","10250","","10.1039/C9NJ00586B","","","0.71073","MoKα","","0.0536","0.037","","","0.0826","0.0908","","","","","","1.029","","","","has coordinates","224795","2020-10-21","18:00:00",""
"1551262","5.3927","0.0004","31.353","0.002","7.8011","0.0006","90","","99.399","0.008","90","","1301.28","0.16","292.44","0.11","292.44","0.11","","","","","","","","5","P 1 21 1","P 2yb","4","","Sulfamethoxazole nitrate","","- C10 H12 N4 O6 S -","- C10 H12 N4 O6 S -","- C40 H48 N16 O24 S4 -","4","2","","de Moura Oliveira, Carlos H.; C. de Melo, Cristiane; Doriguetto, Antonio C.","Sulfamethoxazole salts: crystal structures, conformations and solubility","New Journal of Chemistry","2019","43","26","10250","","10.1039/C9NJ00586B","","x-ray","0.71073","MoKα","","0.0565","0.0503","","","0.1307","0.1364","","","","","","1.075","","","","has coordinates","224795","2020-10-21","18:00:00",""
"1557795","11.4485","0.0007","9.3218","0.0006","23.3115","0.0014","90","","92.268","0.002","90","","2485.9","0.3","273","2","273.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H21 F Ir N3 O -","- C31 H21 F Ir N3 O -","- C124 H84 F4 Ir4 N12 O4 -","4","1","","Qin, Li-Qin; Zou, Bi-Qun; Qin, Qi-Pin; Wang, Zhen-Feng; Yang, Lin; Tan, Ming-Xiong; Liang, Chun-Jie; Liang, Hong","Highly cytotoxic, cyclometalated iridium(iii)-5-fluoro-8-quinolinol complexes as cancer cell mitochondriotropic agents","New Journal of Chemistry","2020","44","19","7832","7837","10.1039/D0NJ00465K","","","0.71073","MoKα","","0.0434","0.028","","","0.0663","0.0796","","","","","","1.134","","","","has coordinates","257764","2020-10-21","18:00:00",""
"1557796","10.7444","0.0008","22.9897","0.0012","10.6487","0.0006","90","","96.221","0.006","90","","2614.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H27 F Ir N5 O3 -","- C29 H27 F Ir N5 O3 -","- C116 H108 F4 Ir4 N20 O12 -","4","1","","Qin, Li-Qin; Zou, Bi-Qun; Qin, Qi-Pin; Wang, Zhen-Feng; Yang, Lin; Tan, Ming-Xiong; Liang, Chun-Jie; Liang, Hong","Highly cytotoxic, cyclometalated iridium(iii)-5-fluoro-8-quinolinol complexes as cancer cell mitochondriotropic agents","New Journal of Chemistry","2020","44","19","7832","7837","10.1039/D0NJ00465K","","x-ray","0.71073","MoKα","","0.0746","0.0435","","","0.0853","0.0972","","","","","","0.995","","","","has coordinates","257764","2020-10-21","18:00:00",""
"1557797","21.5039","0.0006","16.6692","0.0005","14.8357","0.0004","90","","101.136","0.003","90","","5217.8","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H21 F Ir N3 O -","- C35 H21 F Ir N3 O -","- C280 H168 F8 Ir8 N24 O8 -","8","1","","Qin, Li-Qin; Zou, Bi-Qun; Qin, Qi-Pin; Wang, Zhen-Feng; Yang, Lin; Tan, Ming-Xiong; Liang, Chun-Jie; Liang, Hong","Highly cytotoxic, cyclometalated iridium(iii)-5-fluoro-8-quinolinol complexes as cancer cell mitochondriotropic agents","New Journal of Chemistry","2020","44","19","7832","7837","10.1039/D0NJ00465K","","x-ray","0.71073","MoKα","","0.0966","0.0448","","","0.0516","0.0624","","","","","","0.999","","","","has coordinates","257764","2020-10-21","18:00:00",""
"1557798","20.4836","0.0017","16.3026","0.0014","15.6214","0.0013","90","","100.056","0.003","90","","5136.4","0.7","273","2","273.15","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H25 F Ir N3 O -","- C33 H25 F Ir N3 O -","- C264 H200 F8 Ir8 N24 O8 -","8","1","","Qin, Li-Qin; Zou, Bi-Qun; Qin, Qi-Pin; Wang, Zhen-Feng; Yang, Lin; Tan, Ming-Xiong; Liang, Chun-Jie; Liang, Hong","Highly cytotoxic, cyclometalated iridium(iii)-5-fluoro-8-quinolinol complexes as cancer cell mitochondriotropic agents","New Journal of Chemistry","2020","44","19","7832","7837","10.1039/D0NJ00465K","","","0.71073","MoKα","","0.0309","0.021","","","0.0476","0.0513","","","","","","1.044","","","","has coordinates","257764","2020-10-21","18:00:00",""
"1558147","11.1251","0.0014","7.5242","0.0007","11.194","0.0012","90","","115.098","0.015","90","","848.55","0.19","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 N3 S -","- C8 H7 N3 S -","- C32 H28 N12 S4 -","4","1","","Manna, Amit Kumar; Chowdhury, Shubhamoy; Patra, Goutam K.","Combined experimental and theoretical studies on a phenyl thiadiazole-based novel turn-on fluorescent colorimetric Schiff base chemosensor for the selective and sensitive detection of Al3+","New Journal of Chemistry","2020","44","26","10819","10832","10.1039/D0NJ01954B","","","0.71073","MoKα","","0.0548","0.0385","","","0.0982","0.1084","","","","","","1.0017","","","","has coordinates","257716","2020-10-21","18:00:00",""
"1558158","8.5365","0.0003","12.2999","0.0003","16.448","0.0005","90","","90","","90","","1727.01","0.09","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H28 O2 -","- C20 H28 O2 -","- C80 H112 O8 -","4","1","","Seijo, Lorenzo; Ondet, Pierrick; Olivero, Sandra; Duñach, Elisabet","Heterogeneous catalysis for the tandem cyclisation of unsaturated alcohols","New Journal of Chemistry","2020","44","25","10479","10483","10.1039/D0NJ01857K","","x-ray","1.54184","CuKα","","0.0426","0.04","","","0.1049","0.1076","","","","","","1.099","","","","has coordinates","257786","2020-10-21","18:00:00",""
"1558783","12.143","0.0005","7.3397","0.0003","9.2655","0.0005","90","","90","","90","","825.8","0.07","143","2","143","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","(Fluoromethyl)trimethylphosphonium iodide","","- C4 H11 F I P -","- C4 H11 F I P -","- C16 H44 F4 I4 P4 -","4","0.5","","Reichel, Marco; Unger, Cornelia; Dubovnik, Sviatlana; Roidl, Andreas; Kornath, Andreas; Karaghiosoff, Konstantin","Synthesis, structural and toxicological investigations of quarternary phosphonium salts containing the P-bonded bioisosteric CH2F moiety","New Journal of Chemistry","2020","44","33","14306","14315","10.1039/D0NJ02310H","","","0.71073","MoKα","","0.0313","0.0223","","","0.046","0.0504","","","","","","1.102","","","","has coordinates,has disorder","257700","2020-10-21","18:00:00",""
"1558784","10.0648","0.0003","10.1439","0.0005","18.6453","0.0008","93.292","0.004","92.58","0.003","90.104","0.003","1898.53","0.14","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","Tris(diethylamino)fluoromethylphosphonium iodide","","- C13 H32 F I N3 P -","- C13 H32 F I N3 P -","- C52 H128 F4 I4 N12 P4 -","4","2","","Reichel, Marco; Unger, Cornelia; Dubovnik, Sviatlana; Roidl, Andreas; Kornath, Andreas; Karaghiosoff, Konstantin","Synthesis, structural and toxicological investigations of quarternary phosphonium salts containing the P-bonded bioisosteric CH2F moiety","New Journal of Chemistry","2020","44","33","14306","14315","10.1039/D0NJ02310H","","","0.71073","MoKα","","0.0826","0.043","","","0.0717","0.086","","","","","","1.013","","","","has coordinates","257700","2020-10-21","18:00:00",""
"1558785","11.5552","0.0017","13.7077","0.0016","17.2666","0.0011","69.635","0.009","78.081","0.009","65.391","0.013","2325","0.5","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","(fluoromethyl)diphenylphosphine oxide","","- C13 H12 F O P -","- C13 H12 F O P -","- C104 H96 F8 O8 P8 -","8","4","","Reichel, Marco; Unger, Cornelia; Dubovnik, Sviatlana; Roidl, Andreas; Kornath, Andreas; Karaghiosoff, Konstantin","Synthesis, structural and toxicological investigations of quarternary phosphonium salts containing the P-bonded bioisosteric CH2F moiety","New Journal of Chemistry","2020","44","33","14306","14315","10.1039/D0NJ02310H","","","0.71073","MoKα","","0.0929","0.0489","","","0.1157","0.1424","","","","","","1.016","","","","has coordinates","257700","2020-10-21","18:00:00",""
"1558786","8.7566","0.0002","9.3257","0.0003","17.2049","0.0005","90","","100.741","0.002","90","","1380.36","0.07","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tris(2-cyanoethyl)(fluoromethyl)phosphonium iodide","","- C10 H14 F I N3 P -","- C10 H14 F I N3 P -","- C40 H56 F4 I4 N12 P4 -","4","1","","Reichel, Marco; Unger, Cornelia; Dubovnik, Sviatlana; Roidl, Andreas; Kornath, Andreas; Karaghiosoff, Konstantin","Synthesis, structural and toxicological investigations of quarternary phosphonium salts containing the P-bonded bioisosteric CH2F moiety","New Journal of Chemistry","2020","44","33","14306","14315","10.1039/D0NJ02310H","","","0.71073","MoKα","","0.0351","0.0241","","","0.0497","0.0547","","","","","","1.021","","","","has coordinates","257700","2020-10-21","18:00:00",""
"1558787","11.3894","0.0004","13.0313","0.0006","13.4302","0.0004","64.227","0.004","66.641","0.003","68.195","0.004","1599.41","0.12","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H30.57 F I O1.28 P2 -","- C37 H30.568 F I O1.284 P2 -","- C74 H61.136 F2 I2 O2.568 P4 -","2","1","","Reichel, Marco; Unger, Cornelia; Dubovnik, Sviatlana; Roidl, Andreas; Kornath, Andreas; Karaghiosoff, Konstantin","Synthesis, structural and toxicological investigations of quarternary phosphonium salts containing the P-bonded bioisosteric CH2F moiety","New Journal of Chemistry","2020","44","33","14306","14315","10.1039/D0NJ02310H","","","0.71073","MoKα","","0.0555","0.041","","","0.0929","0.102","","","","","","1.041","","","","has coordinates","257700","2020-10-21","18:00:00",""
"1561780","8.984","0.008","17.472","0.003","12.48","0.003","90","","99.44","0.01","90","","1932.4","1.8","293","2","293","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C17 H22 Cu N4 O6.5 -","- C17 H22 Cu N4 O6.5 -","- C68 H88 Cu4 N16 O26 -","4","2","","Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel","Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes","New Journal of Chemistry","2021","45","18","8118","8124","10.1039/D1NJ01194D","","","0.71073","MoKα","","0.1886","0.0427","","","0.0927","0.1204","","","","","","0.972","","","","has coordinates","275434","2022-05-16","05:31:58",""
"1561781","9.1526","0.0004","13.794","0.0006","15.1145","0.0006","107.493","0.002","92.096","0.002","102.376","0.002","1767.2","0.13","150","","150","","","","","","","","synthesis as described","3","P -1","-P 1","2","","","","- C38 H32 O8 -","- C38 H32 O8 -","- C76 H64 O16 -","2","1","","Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel","Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes","New Journal of Chemistry","2021","45","18","8118","8124","10.1039/D1NJ01194D","","x-ray","0.71073","MoKα","","0.0574","0.0443","","","0.1474","0.165","","","","","","1.073","","","","has coordinates","266145","2021-06-05","19:22:23",""
"1561782","9.4795","0.0009","13.3263","0.0011","26.101","0.003","94.943","0.003","98.261","0.004","98.981","0.003","3203.1","0.5","150","2","150","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C41 H37 N O6 -","- C41 H37 N O6 -","- C164 H148 N4 O24 -","4","2","","Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel","Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes","New Journal of Chemistry","2021","45","18","8118","8124","10.1039/D1NJ01194D","","x-ray","0.71073","MoKα","","0.0721","0.0456","","","0.1031","0.1159","","","","","","1.014","","","","has coordinates","266145","2021-06-05","19:22:23",""
"1561783","9.7076","0.0004","11.8242","0.0004","12.4785","0.0004","87.701","0.001","78.041","0.001","89.185","0.001","1400.1","0.09","150","2","150","2","","","","","","","synthesis as described","3","P -1","-P 1","2","","","","- C38 H28 O8 -","- C38 H28 O8 -","- C76 H56 O16 -","2","1","","Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel","Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes","New Journal of Chemistry","2021","45","18","8118","8124","10.1039/D1NJ01194D","","x-ray","0.71073","MoKα","","0.0539","0.0396","","","0.1014","0.1098","","","","","","1.04","","","","has coordinates","266145","2021-06-05","19:22:23",""
"1561784","13.107","0.002","13.566","0.002","32.525","0.006","90","","90.549","0.008","90","","5783","1.6","150","","150","","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C38 H30 O8 -","- C38 H30 O8 -","- C304 H240 O64 -","8","2","","Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel","Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes","New Journal of Chemistry","2021","45","18","8118","8124","10.1039/D1NJ01194D","","x-ray","0.71073","MoKα","","0.2878","0.2032","","","0.4287","0.4658","","","","","","1.112","","","","has coordinates","266145","2021-06-05","19:22:23",""
"1561785","12.2704","0.0011","12.9162","0.001","14.0637","0.0011","105.461","0.003","91.247","0.003","115.181","0.003","1920.6","0.3","150","","150","","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C45 H37 Cl2 O6 P S -","- C45 H37 Cl2 O6 P S -","- C90 H74 Cl4 O12 P2 S2 -","2","1","","Mokrai, Réka; Szűcs, Rózsa; Duffy, Matthew P.; Dorcet, Vincent; Roisnel, Thierry; Benkő, Zoltán; Nyulászi, László; Bouit, Pierre-Antoine; Hissler, Muriel","Topologically diverse polycyclic aromatic hydrocarbons from pericyclic reactions with polyaromatic phospholes","New Journal of Chemistry","2021","45","18","8118","8124","10.1039/D1NJ01194D","","x-ray","0.71073","MoKα","","0.0818","0.0542","","","0.1235","0.1359","","","","","","1.088","","","","has coordinates,has disorder","266145","2021-06-05","19:22:23",""
"1567140","28.3729","0.0011","6.5464","0.0002","7.3531","0.0003","90","","97.1","0.004","90","","1355.29","0.09","293","","293","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C12 H12 N4 Ni O4 S -","- C12 H12 N4 Ni O4 S -","- C48 H48 N16 Ni4 O16 S4 -","4","1","","González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław","Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates","New Journal of Chemistry","2022","46","31","14786","14792","10.1039/D2NJ01188C","powder diffraction","x-ray","1.5418","CuKα","","0.0461","0.0461","","0.0604","0.0604","","","","5.06","","","","","","","has coordinates","277676","2022-09-06","10:13:43",""
"1567141","23.012","0.003","6.0848","0.0009","10.6386","0.0013","90","","91.194","0.009","90","","1489.3","0.3","293","","293","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C12 H16 N4 Ni O4 S -","- C12 H16 N4 Ni O4 S -","- C48 H64 N16 Ni4 O16 S4 -","4","0.5","","González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław","Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates","New Journal of Chemistry","2022","46","31","14786","14792","10.1039/D2NJ01188C","powder diffraction","x-ray","1.5418","CuKα","","0.0555","0.0555","","0.0656","0.0656","","","","3.7","","","","","","","has coordinates","277676","2022-09-06","10:13:43",""
"1567142","6.476","0.0006","7.2221","0.0007","16.615","0.002","90","","90","","90","","777.09","0.14","293","","293","","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C6 H8 N2 Ni O4 S -","- C6 H8 N2 Ni O4 S -","- C24 H32 N8 Ni4 O16 S4 -","4","0.25","","González Guillén, Anabel B.; Konieczny, Piotr; Luberda-Durnaś, Katarzyna; Oszajca, Marcin; Kozieł, Marcin; Łasocha, Wiesław","Tuning magnetic properties by crystal engineering in a family of coordination polymers based on Ni(ii) sulphates","New Journal of Chemistry","2022","46","31","14786","14792","10.1039/D2NJ01188C","powder diffraction","x-ray","1.5418","CuKα","","0.027","0.027","","0.0359","0.0359","","","","3.18","","","","","","","has coordinates","277676","2022-09-06","10:13:43",""
"1567719","9.6609","0.0007","6.3361","0.0005","19.6298","0.0014","90","","96.172","0.003","90","","1194.62","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 N O S -","- C14 H11 N O S -","- C56 H44 N4 O4 S4 -","4","1","","Dhara, Samiran; Saha, Moumita; Das, Asish R.","Ligand-free access to benzisothiazolones and benzisoselenazolones through NiFe <sub>2</sub> O <sub>4</sub> catalyzed concomitant annulation of 2-halobenzanilides with chalcogens and their late-stage transformations","New Journal of Chemistry","2022","46","40","19501","19513","10.1039/D2NJ04326B","","","0.71073","MoKα","","0.0677","0.0645","","","0.1727","0.1767","","","","","","1.04","","","","has coordinates","282777","2023-04-20","11:56:53",""
"1569258","8.0518","0.0002","17.65","0.0004","26.8891","0.0006","90","","90","","90","","3821.32","0.15","150","0.1","150","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C21 H20 F N3 O S -","- C21 H20 F N3 O S -","- C168 H160 F8 N24 O8 S8 -","8","1","","Zhang, Wen-Hui; Chen, Zi-Yue; Liu, Ren-Ming; Liu, Xiong-Wei; Pan, Bo-Wen; Zhou, Jian; Zhou, Ying; Tian, You-Ping; Liu, Xiong-Li","Trimethylindolenines as C–N synthons for the assembly of spiro[oxindole-thioxoimidazolidine-indoline] hybrids in formal [3+2] cycloadditions","New Journal of Chemistry","2023","47","26","12296","12303","10.1039/D3NJ00901G","","x-ray","1.54178","CuKα","","0.0542","0.0512","","","0.1384","0.1418","","","","","","1.036","","","","has coordinates","284941","2023-07-05","10:34:47",""
"1573391","19.927","0.003","21.694","0.003","34.974","0.006","90","","104.466","0.005","90","","14640","4","200","2","200","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C87 H81 B Cu F4 N4 O2.5 P2 -","- C81 H66 B Cu F4 N4 O P2 -","- C648 H528 B8 Cu8 F32 N32 O8 P16 -","8","1","","Wang, Xinwei; Li, Weijun; Li, Xiao; Hou, Chenlu; Wei, Sanyue; Lei, Wenxin; Chen, Xu-Lin","TADF-emitting copper(i) and silver(i) complexes featuring intra-ligand charge transfer based on a donor–acceptor–donor ligand","New Journal of Chemistry","2025","49","3","755","760","10.1039/D4NJ04193C","","","0.71073","MoKα","","0.1146","0.0779","","","0.2148","0.2459","","","","","","1.04","","","","has coordinates,has disorder","299050","2025-04-05","03:53:52",""
"1573392","19.2498","0.0002","25.6897","0.0003","31.4864","0.0004","77.9013","0.001","78.6755","0.001","89.8003","0.0009","14916.9","0.3","113","20","113","20","","","","","","","","8","P -1","-P 1","2","","","","- C85 H76 Ag B F4 N4 O2 P2 -","- C85 H75.625 Ag B F4 N4 O2 P2 -","- C680 H605 Ag8 B8 F32 N32 O16 P16 -","8","4","","Wang, Xinwei; Li, Weijun; Li, Xiao; Hou, Chenlu; Wei, Sanyue; Lei, Wenxin; Chen, Xu-Lin","TADF-emitting copper(i) and silver(i) complexes featuring intra-ligand charge transfer based on a donor–acceptor–donor ligand","New Journal of Chemistry","2025","49","3","755","760","10.1039/D4NJ04193C","","x-ray","1.54184","CuKα","","0.0759","0.0696","","","0.1899","0.1939","","","","","","1.065","","","","has coordinates,has disorder","299050","2025-04-05","03:53:52",""
"1573393","10.556","0.002","5.7279","0.0012","21.606","0.005","90","","97.049","0.008","90","","1296.5","0.5","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 N7 O5 -","- C9 H7 N7 O5 -","- C36 H28 N28 O20 -","4","1","","Cai, Ziwu; Shi, Junhao; Yu, Qian; Jiang, Tianyu; Zhang, Wenquan","4-Amino-1,2,3-triazine 2-oxide: a promising structural unit for the design and synthesis of novel energetic materials with good thermal stability and low impact sensitivity","New Journal of Chemistry","2025","49","1","302","310","10.1039/D4NJ04219K","","","0.71073","MoKα","","0.1126","0.0565","","","0.1249","0.1587","","","","","","1.018","","","","has coordinates","298994","2025-04-05","03:40:08",""
"1573394","5.8169","0.0003","10.8115","0.0005","15.0344","0.0008","90","","90","","90","","945.5","0.08","102","","102","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C7 H5 N7 O5 -","- C7 H5 N7 O5 -","- C28 H20 N28 O20 -","4","1","","Cai, Ziwu; Shi, Junhao; Yu, Qian; Jiang, Tianyu; Zhang, Wenquan","4-Amino-1,2,3-triazine 2-oxide: a promising structural unit for the design and synthesis of novel energetic materials with good thermal stability and low impact sensitivity","New Journal of Chemistry","2025","49","1","302","310","10.1039/D4NJ04219K","","","0.71073","MoKα","","0.0562","0.0389","","","0.0844","0.0939","","","","","","1.037","","","","has coordinates","298994","2025-04-05","03:40:09",""
"1573395","9.1158","0.001","9.8374","0.0013","25.365","0.003","90","","90","","90","","2274.6","0.5","149.99","0.1","149.99","0.1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H13 N O -","- C14 H13 N O -","- C112 H104 N8 O8 -","8","1","","Qin, Chang-Qing; Liu, Xin-Ni; Gu, Man-Zhen; Xu, Yi-Bing; Chen, Guo-Shu; Liu, Yun-Lin","DBU-mediated synthesis of amides from carbodiimides and unstrained 1,3-diketones","New Journal of Chemistry","2025","49","2","366","370","10.1039/D4NJ04537H","","x-ray","1.54184","CuKα","","0.1071","0.0771","","","0.209","0.2623","","","","","","1.111","","","","has coordinates","299012","2025-04-05","03:43:51",""
"1573726","8.029","0.0003","12.7021","0.0004","13.0187","0.0004","90","","93.446","0.003","90","","1325.31","0.08","169.99","0.1","169.99","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 N3 O3 -","- C16 H13 N3 O3 -","- C64 H52 N12 O12 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0489","0.0409","","","0.1104","0.1157","","","","","","1.062","","","","has coordinates","299000","2025-04-05","03:41:37",""
"1573727","11.4544","0.0006","15.8163","0.0008","7.4627","0.0004","90","","103.569","0.006","90","","1314.25","0.12","294.98","0.13","294.98","0.13","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 N3 O -","- C16 H13 N3 O -","- C64 H52 N12 O4 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0649","0.0564","","","0.1072","0.1118","","","","","","1.047","","","","has coordinates","299000","2025-04-05","03:41:38",""
"1573728","3.9386","0.0001","29.5669","0.0007","11.7999","0.0002","90","","96.592","0.002","90","","1365.04","0.05","294.98","0.11","294.98","0.11","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2","3-{(E)-[(2,4-dihydroxyphenyl)methylidene]amino}-2-methylquinazolin-4(3H)-one","","- C16 H13 N3 O3 -","- C16 H13 N3 O3 -","- C64 H52 N12 O12 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","1.54184","CuKα","","0.0535","0.0442","","","0.1192","0.1275","","","","","","1.066","","","","has coordinates","299000","2025-04-05","03:41:38",""
"1573729","7.9879","0.0003","13.1032","0.0004","14.7678","0.0006","71.525","0.003","76.046","0.003","81.964","0.003","1419.4","0.09","294.99","0.12","294.99","0.12","","","","","","","","5","P -1","-P 1","2","","","","- C16 H12 Cl N3 O -","- C16 H12 Cl N3 O -","- C64 H48 Cl4 N12 O4 -","4","2","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0638","0.0477","","","0.1321","0.1415","","","","","","1.039","","","","has coordinates","299000","2025-04-05","03:41:38",""
"1573730","8.7501","0.001","8.951","0.0007","21.2255","0.0013","90","","97.446","0.008","90","","1648.4","0.3","294.98","0.11","294.98","0.11","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 N3 O4 -","- C17 H17 N3 O4 -","- C68 H68 N12 O16 -","4","1","","Korica, Milenko; Komar, Mario; Molnar, Maja; Nemec, Vinko; Cinčić, Dominik; Balić, Tomislav","Structural and thermal properties of 3-substituted quinazolinone Schiff base conjugates","New Journal of Chemistry","2025","49","8","3067","3077","10.1039/D4NJ04028G","","","0.71073","MoKα","","0.0959","0.0652","","","0.1633","0.1817","","","","","","1.024","","","","has coordinates","299000","2025-04-05","03:41:38",""
"5000184","5.28","0.002","12.972","0.005","16.707","0.007","90","","90","","90","","1144.3","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","","","- C18 H12 -","- C18 H12 -","- C72 H48 -","4","1","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1:1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","","","","","","","","","","","","","","","","","","","has coordinates","175430","2020-10-21","18:00:00",""
"5000291","21.4753","0.0007","8.8416","0.0003","13.4685","0.0004","90","","90","","90","","2557.35","0.14","153","2","153","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C22 H50 Cl N P2 Ru -","- C22 H50 Cl N P2 Ru -","- C88 H200 Cl4 N4 P8 Ru4 -","4","0.5","","Ferrando-Miguel, German; Coalter, III, Joseph N.; Gérard, Hélène; Huffman, John C.; Eisenstein, Odile; Caulton, Kenneth G.","Geminal Dehydrogenation of Ether and Amine C(sp^3^)H~2~ Groups by Electron-Rich Ru(II) and Os","New Journal of Chemistry","2002","26","6","687","700","10.1039/b200168n","","","0.71073","MoKα","","","0.0276","","","","0.0307","","","","","","0.8602","","","","has coordinates,has disorder","178195","2020-10-21","18:00:00",""
"7050000","9.121","0.0008","11.469","0.001","13.561","0.0012","90","","104.623","0.002","90","","1372.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H11 N8 Ni2 O -","- C8 H9 N8 Ni2 O -","- C32 H36 N32 Ni8 O4 -","4","1","","Colacio, Enrique; Lloret, Francesc; Navarrete, Miguel; Romerosa, Antonio; Stoeckli-Evans, Helen; Suarez-Varela, José","2D and 3D coordination polymers based on 2,2′-bipyrimidine and cyanide bridging ligands incorporating coordinated and guest ammonia molecules. Synthesis, crystal structures, magnetic properties and thermal analysis of {[Ni(CN)4]2[(Ni(NH3)2)2(bpym)]·2H2O}n and {[Cu2(CN)2(bpym)]·NH3}n","New Journal of Chemistry","2005","29","9","1189","","10.1039/b507136d","","","0.71069","MoKα","","0.0559","0.0363","","","0.0731","0.0767","","","","","","0.877","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050001","5.8736","0.0012","17.266","0.003","12.983","0.003","90","","93.4","0.02","90","","1314.3","0.5","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H9 Cu2 N7 -","- C10 H6 Cu2 N7 -","- C40 H24 Cu8 N28 -","4","0.5","","Colacio, Enrique; Lloret, Francesc; Navarrete, Miguel; Romerosa, Antonio; Stoeckli-Evans, Helen; Suarez-Varela, José","2D and 3D coordination polymers based on 2,2′-bipyrimidine and cyanide bridging ligands incorporating coordinated and guest ammonia molecules. Synthesis, crystal structures, magnetic properties and thermal analysis of {[Ni(CN)4]2[(Ni(NH3)2)2(bpym)]·2H2O}n and {[Cu2(CN)2(bpym)]·NH3}n","New Journal of Chemistry","2005","29","9","1189","","10.1039/b507136d","","","0.71073","MoKα","","0.1331","0.0743","","","0.1702","0.1897","","","","","","0.827","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050002","8.406","0.0003","10.5093","0.0003","11.5318","0.0005","64.758","0.002","86.923","0.002","72.444","0.002","875.22","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","EDO-EDT-TTF-Py","","","- C15 H11 N O2 S6 -","- C15 H11 N O2 S6 -","- C30 H22 N2 O4 S12 -","2","1","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Cador, Olivier; Yoshida, Yukihiro; Saito, Gunzi","Paramagnetic transition metal complexes with a redox-active ligand: M(hfac)2(EDO-EDT-TTF-py)n; [M = CuII, n= 1, 2; M = MnII, n= 2]","New Journal of Chemistry","2005","29","9","1135","","10.1039/b507163a","","","0.71073","MoKα","","0.0715","0.0502","","","0.1236","0.1381","","","","","","1.044","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050003","7.1085","0.0004","11.121","0.0007","16.3628","0.0011","91.682","0.002","91.014","0.003","93.547","0.002","1290.26","0.14","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Cu(hfac)2(EDO-EDT-TTF-Py)2","","","- C40 H24 Cu F12 N2 O8 S12 -","- C40 H24 Cu F12 N2 O8 S12 -","- C40 H24 Cu F12 N2 O8 S12 -","1","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Cador, Olivier; Yoshida, Yukihiro; Saito, Gunzi","Paramagnetic transition metal complexes with a redox-active ligand: M(hfac)2(EDO-EDT-TTF-py)n; [M = CuII, n= 1, 2; M = MnII, n= 2]","New Journal of Chemistry","2005","29","9","1135","","10.1039/b507163a","","","0.71073","MoKα","","0.1305","0.0817","","","0.2219","0.2617","","","","","","1.05","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050004","7.1013","0.0009","11.1105","0.0015","16.346","0.003","91.662","0.006","91.036","0.007","93.65","0.006","1286.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Mn(hfac)2(EDO-EDT-TTF-Py)2","","","- C40 H24 F12 Mn N2 O8 S12 -","- C40 H24 F12 Mn N2 O8 S12 -","- C40 H24 F12 Mn N2 O8 S12 -","1","0.5","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Cador, Olivier; Yoshida, Yukihiro; Saito, Gunzi","Paramagnetic transition metal complexes with a redox-active ligand: M(hfac)2(EDO-EDT-TTF-py)n; [M = CuII, n= 1, 2; M = MnII, n= 2]","New Journal of Chemistry","2005","29","9","1135","","10.1039/b507163a","","","0.71073","MoKα","","0.2125","0.1056","","","0.2637","0.34","","","","","","1.029","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050005","9.2937","0.0001","15.1897","0.0002","24.3174","0.0006","92.461","0.001","93.048","0.001","105.491","0.001","3297.64","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Cu(hfac)2(EDO-EDT-TTF-Py)","","","- C25 H13 Cu F12 N O6 S6 -","- C25 H13 Cu F12 N O6 S6 -","- C100 H52 Cu4 F48 N4 O24 S24 -","4","2","","Ota, Akira; Ouahab, Lahcène; Golhen, Stéphane; Cador, Olivier; Yoshida, Yukihiro; Saito, Gunzi","Paramagnetic transition metal complexes with a redox-active ligand: M(hfac)2(EDO-EDT-TTF-py)n; [M = CuII, n= 1, 2; M = MnII, n= 2]","New Journal of Chemistry","2005","29","9","1135","","10.1039/b507163a","","","0.71073","MoKα","","0.1093","0.0632","","","0.1553","0.1846","","","","","","1.018","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050006","7.266","0.004","12.168","0.003","17.628","0.004","100.33","","90.79","0.02","104.64","","1480.6","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","4,4-difluoro-8-(-1-pyrenyl)-1,3,5,7-tetramethyl-2,4-diethyl-4- bora-3a,4a-diaza-s-indacene","4,4-difluoro-8-(-1-pyrenyl)-1,3,5,7-tetramethyl-2,4-diethyl-4-bora- 3a,4a-diaza-s-indacene","","- C34 H34 B F2 N3 O2 -","- C34 H34 B F2 N3 O2 -","- C68 H68 B2 F4 N6 O4 -","2","1","","Rostron, James P.; Ulrich, Gilles; Retailleau, Pascal; Harriman, Anthony; Ziessel, Raymond","Engineering of an electronically decoupled difluoroindacene-pyrene dyad possessing high affinity for DNA","New Journal of Chemistry","2005","29","10","1241","","10.1039/b507585h","","","0.71073","MoKα","","0.1091","0.074","","","0.207","0.2367","","","","","","1.059","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050007","10.5232","0.0012","7.5048","0.0004","20.2461","0.0015","90","","102.02","0.007","90","","1563.9","0.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3,5-Diphenyl-1H-pyrrole-2-carboxylic acid ethyl ester","3,5-Diphenyl-1H-pyrrole-2-carboxylic acid ethyl ester","","- C19 H17 N O2 -","- C19 H17 N O2 -","- C76 H68 N4 O8 -","4","1","","John Killoran; John F. Gallagher; Paul V. Murphy; Donal F. O'Shea","A study of the effects of subunit pre-orientation for diarylpyrrole esters; design of new aryl-heteroaryl fluorescent sensors","New Journal of Chemistry","2005","29","10","1258","","10.1039/b507669b","","","0.71073","MoKα","","0.0693","0.0449","","","0.1018","0.1142","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050008","9.8173","0.0011","13.3363","0.0011","15.9016","0.001","67.237","0.005","80.48","0.008","72.421","0.008","1827.3","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","3-(4-Dimethylamino-phenyl)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester","3-(4-Dimethylamino-phenyl)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester","","- C21 H22 N2 O2 -","- C21 H22 N2 O2 -","- C84 H88 N8 O8 -","4","2","","John Killoran; John F. Gallagher; Paul V. Murphy; Donal F. O'Shea","A study of the effects of subunit pre-orientation for diarylpyrrole esters; design of new aryl-heteroaryl fluorescent sensors","New Journal of Chemistry","2005","29","10","1258","","10.1039/b507669b","","","0.71073","MoKα","","0.0997","0.0544","","","0.1187","0.1408","","","","","","1.027","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7050009","7.861","0.002","9.401","0.003","14.244","0.003","83.46","0.02","81.78","0.01","79.74","0.02","1020.9","0.5","294","2","294","2","","","","","","","","4","P -1","-P 1","2","3-(4-Dimethylamino-2,6-dimethyl-phenyl)-5-phenyl-1H-pyrrole-2- carboxylic acid ethyl ester","3-(4-Dimethylamino-2,6-dimethyl-phenyl)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester","","- C23 H26 N2 O2 -","- C23 H26 N2 O2 -","- C46 H52 N4 O4 -","2","1","","John Killoran; John F. Gallagher; Paul V. Murphy; Donal F. O'Shea","A study of the effects of subunit pre-orientation for diarylpyrrole esters; design of new aryl-heteroaryl fluorescent sensors","New Journal of Chemistry","2005","29","10","1258","","10.1039/b507669b","","","0.71073","MoKα","","0.214","0.154","","","","","","","","","","2.111","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7050010","7.6973","0.0005","9.3729","0.0006","14.0807","0.001","83.347","0.001","82.391","0.001","79.132","0.001","984.54","0.11","150","2","150","2","","","","","","","","4","P -1","-P 1","2","3-(4-Dimethylamino-2,6-dimethyl-phenyl)-5-phenyl-1H-pyrrole-2- carboxylic acid ethyl ester","3-(4-Dimethylamino-2,6-dimethyl-phenyl)-5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester","","- C23 H26 N2 O2 -","- C23 H26 N2 O2 -","- C46 H52 N4 O4 -","2","1","","John Killoran; John F. Gallagher; Paul V. Murphy; Donal F. O'Shea","A study of the effects of subunit pre-orientation for diarylpyrrole esters; design of new aryl-heteroaryl fluorescent sensors","New Journal of Chemistry","2005","29","10","1258","","10.1039/b507669b","","","0.71073","MoKα","","0.0541","0.0478","","","0.1273","0.1326","","","","","","1.037","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7050011","12.997","0.0002","18.486","0.0002","16.127","0.0003","90","","90","","90","","3874.71","0.1","110","2","110","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C36 H60 N8 O8 -","- C36 H60 N8 O8 -","- C144 H240 N32 O32 -","4","0.5","","Meyer, Michel; Frémond, Laurent; Espinosa, Enrique; Brandès, Stéphane; Yves Vollmer, Guy; Guilard, Roger","Synthesis, characterization and X-ray crystal structures of cyclam derivatives. 7. Hydrogen-bond induced allosteric effects and protonation cooperativity in a macrotricyclic bisdioxocyclam receptor","New Journal of Chemistry","2005","29","9","1121","","10.1039/b508076b","","","0.7107","MoKα","","0.1415","0.0532","","","0.0992","0.1288","","","","","","1.004","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050012","7.5852","0.0011","12.1545","0.0017","22.829","0.003","90","","90","","90","","2104.7","0.5","273","2","150","1","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C16 H22 Br2 N4 O4 Zn -","- C16 H22 Br2 N4 O4 Zn -","- C64 H88 Br8 N16 O16 Zn4 -","4","0.5","","Tzeng, Biing-Chiau; Chen, Bo-So; Lee, Shih-Yang; Liu, Wei-Hsin; Lee, Gene-Hsiang; Peng, Shie-Ming","Anion-directed assembly of supramolecular zinc(ii) halides with N,N′-bis-4-methyl-pyridyl oxalamide","New Journal of Chemistry","2005","29","10","1254","","10.1039/b508293e","","","0.71073","MoKα","","0.0484","0.0339","","","0.0812","0.0887","","","","","","1.039","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050013","7.4152","0.0002","11.8222","0.0003","22.7057","0.0007","90","","90","","90","","1990.47","0.1","150","2","150","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C16 H22 Cl2 N4 O4 Zn -","- C16 H22 Cl2 N4 O4 Zn -","- C64 H88 Cl8 N16 O16 Zn4 -","4","0.5","","Tzeng, Biing-Chiau; Chen, Bo-So; Lee, Shih-Yang; Liu, Wei-Hsin; Lee, Gene-Hsiang; Peng, Shie-Ming","Anion-directed assembly of supramolecular zinc(ii) halides with N,N′-bis-4-methyl-pyridyl oxalamide","New Journal of Chemistry","2005","29","10","1254","","10.1039/b508293e","","","0.71073","MoKα","","0.0891","0.0501","","","0.1152","0.1287","","","","","","1.103","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050014","8.2323","0.0001","10.9481","0.0001","12.0332","0.0002","105.908","0.001","96.5427","0.0009","102.907","0.0008","998.74","0.02","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C32 H32 I4 N8 O6 Zn2 -","- C32.02 H24 I4 N8 O5.98 Zn2 -","- C32.02 H24 I4 N8 O5.98 Zn2 -","1","0.5","","Tzeng, Biing-Chiau; Chen, Bo-So; Lee, Shih-Yang; Liu, Wei-Hsin; Lee, Gene-Hsiang; Peng, Shie-Ming","Anion-directed assembly of supramolecular zinc(ii) halides with N,N′-bis-4-methyl-pyridyl oxalamide","New Journal of Chemistry","2005","29","10","1254","","10.1039/b508293e","","","0.71073","MoKα","","0.0363","0.0314","","","0.0801","0.0825","","","","","","1.037","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050015","10.902","0.001","12.36","0.001","17.546","0.002","90","","90","","90","","2364.3","0.4","293","","293","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C11.5 H7 F3 N2 S -","- C11.25 H7 F3 N2 S -","- C90 H56 F24 N16 S8 -","8","1","","Marion Giraud; Anne Léaustic; Marie-France Charlot; Pei Yu; Michèle Césario; Christian Philouze; Robert Pansu; Keitaro Nakatani; Eléna Ishow","Synthesis and photochromism of two new 1,2-bis(thiazolyl)perfluorocyclopentenes with chelating sites","New Journal of Chemistry","2005","29","3","439","","10.1039/b409274k","","","1.5418","CuKα","","0.0673","0.0673","","0.1183","","0.1183","","","1.987","","","1.987","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050016","16.492","0.006","8.379","0.003","16.79","0.007","90","","93.52","0.04","90","","2315.8","1.5","293","2","293","2","","","","","","","chemical synthesis","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H14 F6 N4 S2 -","- C23 H14 F6 N4 S2 -","- C92 H56 F24 N16 S8 -","4","1","","Marion Giraud; Anne Léaustic; Marie-France Charlot; Pei Yu; Michèle Césario; Christian Philouze; Robert Pansu; Keitaro Nakatani; Eléna Ishow","Synthesis and photochromism of two new 1,2-bis(thiazolyl)perfluorocyclopentenes with chelating sites","New Journal of Chemistry","2005","29","3","439","","10.1039/b409274k","","","0.71073","MoKα","","0.0749","0.0496","","0.1698","","0.1401","","","0.869","","","0.876","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050018","13.405","0.006","10.911","0.002","14.405","0.003","90","","90","","90","","2106.9","1.1","296.2","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C26 H25 N3 O2 -","- C26 H25 N3 O2 -","- C104 H100 N12 O8 -","4","1","","Ooyama, Yousuke; Nakamura, Takato; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Synthesis of novel imidazoanthraquinol derivatives and their photophysical properties in benzene and in the crystalline state","New Journal of Chemistry","2005","29","3","447","","10.1039/b410311d","","","0.7107","MoKα","","0.0736","0.0424","","","0.0987","0.1201","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050019","16.13","0.003","8.793","0.003","18.26","0.003","90","","96.12","0.01","90","","2575.1","1.1","296.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H33 N3 O2 -","- C30 H33 N3 O2 -","- C120 H132 N12 O8 -","4","1","","Ooyama, Yousuke; Nakamura, Takato; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Synthesis of novel imidazoanthraquinol derivatives and their photophysical properties in benzene and in the crystalline state","New Journal of Chemistry","2005","29","3","447","","10.1039/b410311d","","","0.7107","MoKα","","0.0556","0.0439","","","0.1093","0.1212","","","","","","1.312","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050020","13.8846","0.0005","14.8256","0.0004","21.8859","0.0007","102.61","0.002","92.898","0.002","113.902","0.002","3970.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H26 Br30 Mn6 O27 -","- C28 H20 Br30 Mn6 O27 -","- C56 H40 Br60 Mn12 O54 -","2","1","","Jordi Gómez-Segura; Elsa Lhotel; Carley Paulsen; Dominique Luneau; Klaus Wurst; Jaume Veciana; Daniel Ruiz-Molina; Philippe Gerbier","Trihaloacetic acids: an investigation of steric and inductive ligand effects on the synthesis of [Mn12O12(O2CCX3)16(H2O)4] single-molecule magnets","New Journal of Chemistry","2005","29","3","499","","10.1039/b411371c","","","0.71073","MoKα","","0.0917","0.065","","","0.1662","0.1802","","","","","","1.036","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050021","10.6317","0.0006","13.5792","0.0005","17.0719","0.0009","78.218","0.003","76.225","0.002","78.187","0.003","2311.5","0.2","233","2","233","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H20 Cl18 Mn3 O17 -","- C17 Cl18 Mn3 O17 -","- C34 Cl36 Mn6 O34 -","2","1","","Jordi Gómez-Segura; Elsa Lhotel; Carley Paulsen; Dominique Luneau; Klaus Wurst; Jaume Veciana; Daniel Ruiz-Molina; Philippe Gerbier","Trihaloacetic acids: an investigation of steric and inductive ligand effects on the synthesis of [Mn12O12(O2CCX3)16(H2O)4] single-molecule magnets","New Journal of Chemistry","2005","29","3","499","","10.1039/b411371c","","","0.71073","MoKα","","0.0872","0.0732","","","0.2097","0.2211","","","","","","1.041","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050022","15.789","0.0008","19.5781","0.001","20.064","0.001","95.61","0.001","105.667","0.001","106.933","0.001","5607.1","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H15 F48 Mn12 O49.5 -","- C32 F48 Mn12 O49.5 -","- C64 F96 Mn24 O99 -","2","1","","Jordi Gómez-Segura; Elsa Lhotel; Carley Paulsen; Dominique Luneau; Klaus Wurst; Jaume Veciana; Daniel Ruiz-Molina; Philippe Gerbier","Trihaloacetic acids: an investigation of steric and inductive ligand effects on the synthesis of [Mn12O12(O2CCX3)16(H2O)4] single-molecule magnets","New Journal of Chemistry","2005","29","3","499","","10.1039/b411371c","","","0.71073","MoKα","","0.1066","0.0586","","","0.1777","0.1952","","","","","","1.111","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050023","11.239","0.002","12.38","0.003","13.299","0.003","74.38","0.03","77.53","0.03","66.05","0.02","1616.6","0.7","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H43 N O4 S6 -","- C26 H43 N O4 S6 -","- C52 H86 N2 O8 S12 -","2","1","","Lin, Hai-Hong; Yan, Zhe-Min; Dai, Jie; Zhang, De-Qing; Zuo, Jing-Lin; Zhu, Qin-Yu; Jia, Ding-Xian","A water-soluble derivative of tetrathiafulvalene exhibiting pH sensitive redox properties","New Journal of Chemistry","2005","29","3","509","","10.1039/b411380b","","","0.7107","MoKα","","0.1425","0.1083","","","0.1787","0.1909","","","","","","1.238","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050024","11.111","0.002","16.954","0.002","12.318","0.002","90","","113.97","0.01","90","","2120.3","0.5","296.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 N3 O2 -","- C26 H25 N3 O2 -","- C104 H100 N12 O8 -","4","1","","Katsuhira Yoshida; Yousuke Ooyama","Heterocyclic quinol-type fluorophores. Part 4. Dramatic solid-state fluorescence enhancement behaviour of imidazoanthraquinol-type clathrate hosts upon inclusion of various kinds of organic solvent molecules","New J.Chem.(Nouv.J.Chim.)","2005","","","","","10.1039/b411591k","","","0.7107","MoKα","","0.0994","0.0623","","","0.1457","0.1662","","","","","","1.444","","","","has coordinates","282887","2023-04-27","17:16:28",""
"7050025","11.111","0.002","16.954","0.002","12.318","0.002","90","","113.97","0.01","90","","2120.3","0.5","296.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 N3 O2 -","- C26 H25 N3 O2 -","- C104 H100 N12 O8 -","4","1","","Katsuhira Yoshida; Yousuke Ooyama","Heterocyclic quinol-type fluorophores. Part 4. Dramatic solid-state fluorescence enhancement behaviour of imidazoanthraquinol-type clathrate hosts upon inclusion of various kinds of organic solvent molecules","New J.Chem.(Nouv.J.Chim.)","2005","","","","","10.1039/b411591k","","","0.7107","MoKα","","0.1687","0.0827","","","0.2003","0.2174","","","","","","1.901","","","","has coordinates","282887","2023-04-27","17:16:28",""
"7050026","13.277","0.002","11.943","0.002","17.664","0.003","90","","108.36","0.01","90","","2658.4","0.8","296.2","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H35 N3 O3 -","- C30 H35 N3 O3 -","- C120 H140 N12 O12 -","4","1","","Ooyama, Yousuke; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Dramatic solid-state fluorescence enhancement behaviour of imidazoanthraquinol-type clathrate hosts upon inclusion of various kinds of organic solvent molecules","New Journal of Chemistry","2005","29","9","1204","","10.1039/b411591k","","","0.7107","MoKα","","0.0738","0.0537","","","0.1332","0.1467","","","","","","1.579","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050027","9.25","0.003","16.607","0.008","8.1","0.002","96.08","0.03","97.9","0.02","96.25","0.03","1215.9","0.8","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H29 N3 O3 -","- C28 H29 N3 O3 -","- C56 H58 N6 O6 -","2","1","","Ooyama, Yousuke; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Dramatic solid-state fluorescence enhancement behaviour of imidazoanthraquinol-type clathrate hosts upon inclusion of various kinds of organic solvent molecules","New Journal of Chemistry","2005","29","9","1204","","10.1039/b411591k","","","0.7107","MoKα","","0.0776","0.0601","","","0.1568","0.1621","","","","","","2.136","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050028","9.62","0.002","23.485","0.002","15.297","0.002","90","","107.87","0.01","90","","3289.3","0.9","296.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H45 N3 O4 -","- C34 H45 N3 O4 -","- C136 H180 N12 O16 -","4","1","","Ooyama, Yousuke; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Dramatic solid-state fluorescence enhancement behaviour of imidazoanthraquinol-type clathrate hosts upon inclusion of various kinds of organic solvent molecules","New Journal of Chemistry","2005","29","9","1204","","10.1039/b411591k","","","0.7107","MoKα","","0.099","0.0593","","","0.1292","0.1566","","","","","","1.185","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050029","7.957","0.003","20.75","0.002","14.977","0.002","90","","96.81","0.02","90","","2455.4","1","296.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H31 N3 O3 -","- C28 H31 N3 O3 -","- C112 H124 N12 O12 -","4","1","","Ooyama, Yousuke; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Dramatic solid-state fluorescence enhancement behaviour of imidazoanthraquinol-type clathrate hosts upon inclusion of various kinds of organic solvent molecules","New Journal of Chemistry","2005","29","9","1204","","10.1039/b411591k","","","0.7107","MoKα","","0.0635","0.0465","","","0.1153","0.1216","","","","","","1.439","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050030","16.57","0.01","12.047","0.008","24.125","0.008","90","","90","","90","","4816","5","296.2","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C28 H30 N3 O2.5 -","- C28 H30 N3 O2.5 -","- C224 H240 N24 O20 -","8","2","","Ooyama, Yousuke; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Dramatic solid-state fluorescence enhancement behaviour of imidazoanthraquinol-type clathrate hosts upon inclusion of various kinds of organic solvent molecules","New Journal of Chemistry","2005","29","9","1204","","10.1039/b411591k","","","0.7107","MoKα","","0.1085","0.0497","","","0.0571","0.0699","","","","","","1.212","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050031","9.5378","0.001","12.572","0.0014","5.183","0.0006","90","","90","","90","","621.49","0.12","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","nickel amidomethylphosphonate monohydrate","","- C2 H6 N Ni O5 P -","- C2 H4 N Ni O5 P -","- C8 H16 N4 Ni4 O20 P4 -","4","1","","Modi, Rakesh; Hix, Gary B.; Tremayne, Maryjane; MacLean, Elizabeth","Polymorphism in nickel phosphonates: synthesis of layered and microporous Ni(O3PCH2C(O)NH2)�H2O","New Journal of Chemistry","2005","29","3","427","","10.1039/b411740a","","","0.6877","synchrotron","","0.0541","0.0526","","","0.1332","0.1341","","","","","","1.067","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050032","6.956","0.002","5.6659","0.001","18.636","0.005","90","","98.9","0.02","90","","725.6","0.3","183","2","183","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H14 Cl I S -","- C14 H14 Cl I S -","- C28 H28 Cl2 I2 S2 -","2","1","","Asseily, Gabriel A.; Davies, Robert P.; Rzepa, Henry S.; White, Andrew J. P.","A solid-state structural and theoretical study on the 1 ? 1 addition compounds of thioethers with dihalogens and interhalogens I?X (X = I, Br, Cl)","New Journal of Chemistry","2005","29","2","315","","10.1039/b411873a","","","1.54178","CuKα","","0.037","0.0346","","","0.0836","0.0843","","","","","","1.074","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050033","7.1678","0.0006","5.7376","0.0011","18.5292","0.0018","90","","100.495","0.007","90","","749.28","0.17","183","2","183","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H14 Br I S -","- C14 H14 Br I S -","- C28 H28 Br2 I2 S2 -","2","1","","Asseily, Gabriel A.; Davies, Robert P.; Rzepa, Henry S.; White, Andrew J. P.","A solid-state structural and theoretical study on the 1 ? 1 addition compounds of thioethers with dihalogens and interhalogens I?X (X = I, Br, Cl)","New Journal of Chemistry","2005","29","2","315","","10.1039/b411873a","","","0.71073","MoKα","","0.0321","0.0264","","","0.0529","0.0542","","","","","","1.06","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050034","14.3905","0.0007","42.019","0.002","42.158","0.002","90","","90","","90","","25492","2","193","2","193","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C40 H62 Cu2 N12 O27 -","- C40 H32 Cu2 N12 O26 -","- C640 H512 Cu32 N192 O416 -","16","1","","Lu, Jack Y.; Fernandez, Wifredo A.; Ge, Zhenghua; Abboud, Khalil A.","A novel two-fold interpenetrating 3D 42.84 network self-assembled from a new 1D coordination polymer","New Journal of Chemistry","2005","29","3","434","","10.1039/b412334d","","","0.71073","MoKα","","0.0797","0.0699","","","0.2103","0.2233","","","","","","1.097","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050035","7.8122","0.0008","7.8122","0.0008","20.232","0.003","90","","90","","90","","1234.8","0.3","223","2","223","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C10 H8 Cu N4 O6 -","- C10 H8 Cu N4 O6 -","- C40 H32 Cu4 N16 O24 -","4","0.5","","Lu, Jack Y.; Fernandez, Wifredo A.; Ge, Zhenghua; Abboud, Khalil A.","A novel two-fold interpenetrating 3D 42.84 network self-assembled from a new 1D coordination polymer","New Journal of Chemistry","2005","29","3","434","","10.1039/b412334d","","","0.71073","MoKα","","0.0303","0.0252","","","0.0654","0.0684","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050036","11.576","0.001","23.162","0.003","11.171","0.001","90","","117.85","0.01","90","","2648.3","0.5","150","","150","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H26 Br2 N Ni P -","- C28 H26 Br2 N Ni P -","- C112 H104 Br8 N4 Ni4 P4 -","4","1","","Sofia I. Pascu; Karl S. Coleman; A. R. Cowley; Malcolm L. H. Green; Nicholas H. Rees","New group 10 complexes of the bulky iminophosphine ligands [Ph2PCH2C(Ph)?N(2,6-R2C6H3)], where R = Me, iPr","New Journal of Chemistry","2005","29","2","385","","10.1039/b412391c","","","0.71069","MoKα","","0.1762","0.117","","0.1087","0.1041","0.1041","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050037","13.535","0.0006","23.464","0.002","27.85","0.003","90","","90","","90","","8844.7","1.3","150","","150","","","","","","","","?","8","P c a b","-P 2bc 2ac","61","","","","- C41.24 H39.47 Br2 Cl2.47 N Ni O P2 -","- C41.236 H39.4718 Br2 Cl2.472 N Ni O P2 -","- C329.888 H315.774 Br16 Cl19.776 N8 Ni8 O8 P16 -","8","1","","Sofia I. Pascu; Karl S. Coleman; A. R. Cowley; Malcolm L. H. Green; Nicholas H. Rees","New group 10 complexes of the bulky iminophosphine ligands [Ph2PCH2C(Ph)?N(2,6-R2C6H3)], where R = Me, iPr","New Journal of Chemistry","2005","29","2","385","","10.1039/b412391c","","","0.71069","MoKα","","0.131","0.0581","","0.0962","0.0658","0.0658","","","","","","1.2474","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050038","9.9766","0.0002","13.5588","0.0003","21.8426","0.0007","90","","90","","90","","2954.66","0.13","150","","150","","","","","","","","?","6","P 21 c n","P -2n 2a","33","","","","- C32 H34 Br2 N P Pd -","- C32 H34 Br2 N P Pd -","- C128 H136 Br8 N4 P4 Pd4 -","4","1","","Sofia I. Pascu; Karl S. Coleman; A. R. Cowley; Malcolm L. H. Green; Nicholas H. Rees","New group 10 complexes of the bulky iminophosphine ligands [Ph2PCH2C(Ph)?N(2,6-R2C6H3)], where R = Me, iPr","New Journal of Chemistry","2005","29","2","385","","10.1039/b412391c","","","0.71073","MoKα","","0.0779","0.0394","","0.0664","0.0344","0.0344","","","","","","1.1158","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050039","10.4664","0.0002","16.3356","0.0003","16.3526","0.0003","90","","99.3449","0.0009","90","","2758.78","0.09","150","","150","","","","","","","","?","6","P 1 21 1","P 2yb","4","","","","- C28 H26 I2 N P Pd -","- C28 H26 I2 N P Pd -","- C112 H104 I8 N4 P4 Pd4 -","4","2","","Sofia I. Pascu; Karl S. Coleman; A. R. Cowley; Malcolm L. H. Green; Nicholas H. Rees","New group 10 complexes of the bulky iminophosphine ligands [Ph2PCH2C(Ph)?N(2,6-R2C6H3)], where R = Me, iPr","New Journal of Chemistry","2005","29","2","385","","10.1039/b412391c","","","0.71073","MoKα","","0.0408","0.0304","","0.0346","0.0333","0.0333","","","","","","1.07","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050040","39.359","0.001","9.388","0.001","14.772","0.001","90","","107.83","0.01","90","","5196.1","0.7","150","","150","","","","","","","","?","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H31 N P Pt -","- C30 H31 N P Pt -","- C240 H248 N8 P8 Pt8 -","8","1","","Sofia I. Pascu; Karl S. Coleman; A. R. Cowley; Malcolm L. H. Green; Nicholas H. Rees","New group 10 complexes of the bulky iminophosphine ligands [Ph2PCH2C(Ph)?N(2,6-R2C6H3)], where R = Me, iPr","New Journal of Chemistry","2005","29","2","385","","10.1039/b412391c","","","0.71073","MoKα","","0.0314","0.0272","","0.0357","0.0349","0.0349","","","","","","1.3238","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050041","20.8343","0.0012","10.083","0.0006","13.5064","0.0008","90","","90","","90","","2837.3","0.3","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","μ6-oxo-dodeca-μ-methoxo-hexakis(oxovanadium)","","- C12 H36 O19 V6 -","- C12 H36 O19 V6 -","- C48 H144 O76 V24 -","4","1","","Yurii, Yablokov; Maria A. Augustyniak-Jablokow; .; Serguei Borshch; .; Daniel, Charles; Hartl, Hans","EPR study of the magnetic states of mixed-valence VIV4 - VV2 alkoxypolyoxovanadium cluster","New J.Chem.(Nouv.J.Chim.)","2005","","","","","10.1039/b412427h","","","0.71073","MoKα","","0.0347","0.0282","","","0.0694","0.0727","","","","","","1.016","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050042","26.7896","0.0005","26.7896","0.0005","22.2608","0.0004","90","","90","","90","","15976.2","0.5","183.2","","183.2","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C29 H11 Cl3 F20 O P2 Re -","- C26 H4 Cl3 F20 O P2 Re -","- C416 H64 Cl48 F320 O16 P32 Re16 -","16","1","","Parr, Maria L.; Perez-Acosta, Carmen; Faller, J. W.","Synthesis, characterization and structural investigation of new rhenium-oxo complexes containing bidentate phosphine ligands: an exploration of chirality and conformation in chelate rings of small and large bite angle ligands","New Journal of Chemistry","2005","29","4","613","","10.1039/b412818d","","","0.7107","MoKα","","0.0535","0.031","","0.042","","0.038","","","0.866","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050043","17.2122","0.0002","14.1969","0.0002","28.0146","0.0005","90","","90","","90","","6845.64","0.17","183.2","","183.2","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C39 H32 Cl3 O2 P2 Re -","- C39 H32 Cl3 O2 P2 Re -","- C312 H256 Cl24 O16 P16 Re8 -","8","1","","Parr, Maria L.; Perez-Acosta, Carmen; Faller, J. W.","Synthesis, characterization and structural investigation of new rhenium-oxo complexes containing bidentate phosphine ligands: an exploration of chirality and conformation in chelate rings of small and large bite angle ligands","New Journal of Chemistry","2005","29","4","613","","10.1039/b412818d","","","0.7107","MoKα","","0.101","0.048","","0.063","","0.051","","","0.96","","","1.08","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050044","8.173","0.006","10.794","0.008","10.913","0.008","69.848","0.013","85.759","0.013","82.043","0.013","894.7","1.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H36 F18 N2 S6 Ti -","- C20 H36 F18 N2 S6 Ti -","- C20 H36 F18 N2 S6 Ti -","1","0.5","","Carmalt, Claire J.; Peters, Emily S.; Parkin, Ivan P.; Tocher, Derek A.","Reactivity of tetrakisdimethylamido-titanium(iv) and -zirconium(iv) with thiols","New Journal of Chemistry","2005","29","4","620","","10.1039/b413060j","","","0.71073","MoKα","","0.0468","0.0416","","","0.1064","0.1107","","","","","","0.976","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050045","11.8588","0.0006","18.7448","0.001","27.2112","0.0014","90","","94.271","0.001","90","","6032","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H93 Cl4 N S9 Zr2 -","- C40 H93 Cl4 N S9 Zr2 -","- C160 H372 Cl16 N4 S36 Zr8 -","4","1","","Carmalt, Claire J.; Peters, Emily S.; Parkin, Ivan P.; Tocher, Derek A.","Reactivity of tetrakisdimethylamido-titanium(iv) and -zirconium(iv) with thiols","New Journal of Chemistry","2005","29","4","620","","10.1039/b413060j","","","0.71073","MoKα","","0.0584","0.0494","","","0.1086","0.1127","","","","","","1.126","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050046","10.2844","0.0005","16.5841","0.0008","75.389","0.004","90","","90","","90","","12858.2","1.1","100","2","100","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C38 H34 N4 O4 Zn -","- C38 H34 N4 O4 Zn -","- C608 H544 N64 O64 Zn16 -","16","2","","Takacs, James M.; Hrvatin, Paul M.; Atkins, Jeffery M.; Reddy, D. Sahadeva; Clark, Joanna L.","The selective formation of neutral, heteroleptic zinc(ii) complexes via self-discrimination of chiral bisoxazoline racemates and pseudoracemates","New Journal of Chemistry","2005","29","2","263","","10.1039/b413439g","","","0.71073","MoKα","","0.0554","0.0524","","","0.1037","0.1046","","","","","","1.214","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050047","17.205","0.003","10.733","0.002","18.407","0.004","90","","105.98","0.03","90","","3267.7","1.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N4 O4 Zn -","- C38 H34 N4 O4 Zn -","- C152 H136 N16 O16 Zn4 -","4","1","","Takacs, James M.; Hrvatin, Paul M.; Atkins, Jeffery M.; Reddy, D. Sahadeva; Clark, Joanna L.","The selective formation of neutral, heteroleptic zinc(ii) complexes via self-discrimination of chiral bisoxazoline racemates and pseudoracemates","New Journal of Chemistry","2005","29","2","263","","10.1039/b413439g","","","0.71073","MoKα","","0.0746","0.0549","","","0.1408","0.1532","","","","","","1.124","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050048","10.7889","0.0006","10.8866","0.0006","17.2241","0.0009","73.146","0.001","88.623","0.001","86.943","0.001","1933.32","0.18","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C46 H39 N5 O4 Zn -","- C46 H39 N5 O4 Zn -","- C92 H78 N10 O8 Zn2 -","2","2","","Takacs, James M.; Hrvatin, Paul M.; Atkins, Jeffery M.; Reddy, D. Sahadeva; Clark, Joanna L.","The selective formation of neutral, heteroleptic zinc(ii) complexes via self-discrimination of chiral bisoxazoline racemates and pseudoracemates","New Journal of Chemistry","2005","29","2","263","","10.1039/b413439g","","","0.71073","MoKα","","0.0391","0.0378","","","0.0903","0.0911","","","","","","1.046","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050049","16.0169","0.0017","16.2046","0.001","27.024","0.003","96.325","0.006","96.207","0.005","108.071","0.006","6551.9","1.1","100","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C141.5 H183.5 N7.5 O14 U -","- C141.5 H183.5 N7.5 O14 U -","- C283 H367 N15 O28 U2 -","2","1","","Bernardo Masci; Pierre Thuéry","Synthesis of homooxacalixarenes with 5 and 10 phenol units and crystal structure of their complexes with uranyl ions","New Journal of Chemistry","2005","29","3","493","","10.1039/b413827a","","","0.71073","MoKα","","0.1717","0.0867","","","0.1842","0.2307","","","","","","1.002","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050050","13.45","0.0014","19.1428","0.0016","20.2899","0.0018","117.13","0.006","102.485","0.007","96.117","0.007","4411","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C178 H244 N20 O28 U4 -","- C178 H240 N20 O28 U4 -","- C178 H240 N20 O28 U4 -","1","0.5","","Bernardo Masci; Pierre Thuéry","Synthesis of homooxacalixarenes with 5 and 10 phenol units and crystal structure of their complexes with uranyl ions","New Journal of Chemistry","2005","29","3","493","","10.1039/b413827a","","","0.71073","MoKα","","0.2695","0.0886","","","0.1589","0.2386","","","","","","0.913","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050051","12.6083","0.0001","12.8156","0.0001","13.7369","0.0001","75.0063","0.0004","76.7008","0.0004","64.5828","0.0004","1918.45","0.03","123","1","123","1","","","","","","","","6","P -1","-P 1","2","","","","- C36 H18 Ag B F24 N2 -","- C36 H18 Ag B F24 N2 -","- C72 H36 Ag2 B2 F48 N4 -","2","1","","Yanmei Zhang; Ana M. Santos; Eberhardt Herdtweck; Janos Mink; Fritz E. Kühn","Organonitrile ligated silver complexes with perfluorinated weakly coordinating anions and their catalytic application for coupling reactions","New Journal of Chemistry","2005","29","2","366","","10.1039/b414060e","","","0.71073","MoKα","","0.0467","0.0369","","","0.0886","0.094","","","","","","1.022","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050052","13.2954","0.0008","12.4529","0.0008","8.5445","0.0005","90","","97.917","0.001","90","","1401.2","0.15","150","1","150","1","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C14 H14 N6 O -","- C14 H14 N6 O -","- C56 H56 N24 O4 -","4","1","","Daniel L. Reger; James R. Gardinier; Selma Bakbak; Radu F. Semeniuc; Uwe H. F. Bunz; Mark D. Smith","Multitopic third generation tris(pyrazolyl)methane ligands built on alkyne structural scaffolding: first preparation of mixed tris(pyrazolyl)methane/tris(pyrazolyl)borate ligands","New Journal of Chemistry","2005","29","8","1035","","10.1039/b414770g","","","0.71073","MoKα","","0.0314","0.0294","","","0.0625","0.063","","","","","","1.018","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050053","8.7819","0.0006","12.1248","0.0008","15.3073","0.001","96.84","0.001","99.563","0.001","105.995","0.001","1521.48","0.18","150","0.2","150","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H29 I N12 O2 -","- C30 H29 I N12 O2 -","- C60 H58 I2 N24 O4 -","2","1","","Daniel L. Reger; James R. Gardinier; Selma Bakbak; Radu F. Semeniuc; Uwe H. F. Bunz; Mark D. Smith","Multitopic third generation tris(pyrazolyl)methane ligands built on alkyne structural scaffolding: first preparation of mixed tris(pyrazolyl)methane/tris(pyrazolyl)borate ligands","New Journal of Chemistry","2005","29","8","1035","","10.1039/b414770g","","","0.71073","MoKα","","0.034","0.0318","","","0.0796","0.0812","","","","","","1.079","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050054","8.1473","0.0005","34.148","0.002","11.3257","0.0007","90","","109.185","0.001","90","","2976","0.3","150","0.2","150","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C62 H58 N24 O4 -","- C62 H58 N24 O4 -","- C124 H116 N48 O8 -","2","0.5","","Daniel L. Reger; James R. Gardinier; Selma Bakbak; Radu F. Semeniuc; Uwe H. F. Bunz; Mark D. Smith","Multitopic third generation tris(pyrazolyl)methane ligands built on alkyne structural scaffolding: first preparation of mixed tris(pyrazolyl)methane/tris(pyrazolyl)borate ligands","New Journal of Chemistry","2005","29","8","1035","","10.1039/b414770g","","","0.71073","MoKα","","0.0815","0.0639","","","0.1656","0.1752","","","","","","1.063","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050055","8.5941","0.0004","13.4373","0.0007","16.3188","0.0008","103.953","0.001","98.33","0.001","106.999","0.001","1701.27","0.15","100","1","100","1","","","","","","","","7","P -1","-P 1","2","","","","- C62 H60 B2 Cl8 Fe N24 O2 -","- C60 H56 B2 Cl4 Fe N24 O2 -","- C60 H56 B2 Cl4 Fe N24 O2 -","1","0.5","","Daniel L. Reger; James R. Gardinier; Selma Bakbak; Radu F. Semeniuc; Uwe H. F. Bunz; Mark D. Smith","Multitopic third generation tris(pyrazolyl)methane ligands built on alkyne structural scaffolding: first preparation of mixed tris(pyrazolyl)methane/tris(pyrazolyl)borate ligands","New Journal of Chemistry","2005","29","8","1035","","10.1039/b414770g","","","0.71073","MoKα","","0.0816","0.0728","","","0.2133","0.2232","","","","","","1.088","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050056","9.278","0.0011","13.531","0.0016","13.9489","0.0017","113.953","0.003","90.227","0.002","102.32","0.002","1555.4","0.3","297","2","297","2","","","","","","","","5","P -1","-P 1","2","","N,N'-Bis-{[1-(n-hexyl)-3-methyl-5-oxo-2-pyrazolin-4-ilpropyliden]-1-yl} ethylenedi-amino manganese(V)","","- C28 H48 Mn N7 O2 -","- C28 H48 Mn N7 O2 -","- C56 H96 Mn2 N14 O4 -","2","1","","Fredy R. Pérez; Julio Belmar; Yanko Moreno; Ricardo Baggio; Octavio Peña","Pyrazolone-based nitrido complexes: synthesis and nitrogen transfer to alkenes","New Journal of Chemistry","2005","29","2","283","","10.1039/b415101a","","","0.71073","MoKα","","0.1384","0.0672","","","0.1564","0.1961","","","","","","1.029","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050057","30.392","0.004","30.392","0.004","15.737","0.004","90","","90","","90","","14536","5","293","2","293","2","","","","","","","","4","I 41 c d","I 4bw -2c","110","","","","- C36 H26 Eu2 O16 -","- C36 H18 Eu2 O16 -","- C576 H288 Eu32 O256 -","16","1","","Zheng, Xiang-Jun; Jin, Lin-Pei; Gao, Song; Lu, Shao-Zhe","Second ligand-directed self-assembly of lanthanide(iii) coordination polymers with 1,4-naphthalenedicarboxylate","New Journal of Chemistry","2005","29","6","798","","10.1039/b415337e","","","0.71073","MoKα","","0.0679","0.0387","","","0.0586","0.0657","","","","","","1.03","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050058","30.408","0.005","30.408","0.005","15.747","0.005","90","","90","","90","","14560","6","293","2","293","2","","","","","","","","4","I 41 c d","I 4bw -2c","110","","","","- C36 H25 Gd2 O15.5 -","- C36 H18 Gd2 O15.5 -","- C576 H288 Gd32 O248 -","16","1","","Zheng, Xiang-Jun; Jin, Lin-Pei; Gao, Song; Lu, Shao-Zhe","Second ligand-directed self-assembly of lanthanide(iii) coordination polymers with 1,4-naphthalenedicarboxylate","New Journal of Chemistry","2005","29","6","798","","10.1039/b415337e","","","0.71073","MoKα","","0.065","0.0362","","","0.0548","0.0623","","","","","","1.116","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050059","14.24","0.005","22.191","0.007","15.185","0.005","90","","102.98","0.005","90","","4676","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C51 H36 Eu2 N3 O15 -","- C51 H36 Eu2 N3 O15 -","- C204 H144 Eu8 N12 O60 -","4","1","","Zheng, Xiang-Jun; Jin, Lin-Pei; Gao, Song; Lu, Shao-Zhe","Second ligand-directed self-assembly of lanthanide(iii) coordination polymers with 1,4-naphthalenedicarboxylate","New Journal of Chemistry","2005","29","6","798","","10.1039/b415337e","","","0.71073","MoKα","","0.0845","0.0423","","","0.0557","0.0645","","","","","","0.962","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050060","14.099","0.005","21.938","0.008","15.066","0.006","90","","103.259","0.008","90","","4536","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C51 H36 N3 O15 Yb2 -","- C51 H36 N3 O15 Yb2 -","- C204 H144 N12 O60 Yb8 -","4","1","","Zheng, Xiang-Jun; Jin, Lin-Pei; Gao, Song; Lu, Shao-Zhe","Second ligand-directed self-assembly of lanthanide(iii) coordination polymers with 1,4-naphthalenedicarboxylate","New Journal of Chemistry","2005","29","6","798","","10.1039/b415337e","","","0.71073","MoKα","","0.2442","0.0959","","","0.1728","0.2582","","","","","","0.976","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050061","8.777","0.005","21.279","0.005","9.934","0.005","90","0.005","97.797","0.005","90","0.005","1838.2","1.5","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C48 H36 N2 O2 -","- C48 H36 N2 O2 -","- C96 H72 N4 O4 -","2","1","","Yan, Yun-Xing; Tao, Xu-Tang; Sun, Yuan-Hong; Wang, Chuan-Kui; Xu, Gui-Bao; Yu, Wen-Tao; Zhao, Hua-Ping; Yang, Jia-Xiang; Yu, Xiao-Qiang; Wu, Yong-Zhong; Zhao, Xian; Jiang, Min-Hua","Structures and nonlinear optical properties of new symmetrical two-photon photopolymerization initiators","New Journal of Chemistry","2005","29","3","479","","10.1039/b415354e","","","0.71069","MoKα","","0.166","0.0648","","","0.1199","0.1573","","","","","","0.939","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050062","7.3627","0.0014","12.33","0.003","13.929","0.002","83.439","0.008","81.485","0.007","72.674","0.009","1190.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H20 Co2 N2 O14 -","- C21 H18 Co2 N2 O14 -","- C42 H36 Co4 N4 O28 -","2","1","","Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Kang, Yao; Qin, Ye-Yan; Yao, Yuan-Gen","A novel 3D framework generated by unusual pillared 2D bilayer motifs","New Journal of Chemistry","2005","29","3","421","","10.1039/b415953e","","","0.71073","MoKα","","","0.0739","","","0.1381","0.1543","","","","","","1.085","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050063","8.8868","0.0006","9.972","0.0007","10.5256","0.0008","75.286","0.003","81.777","0.003","85.916","0.003","892.31","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H22 Cu N2 O7 -","- C16 H22 Cu N2 O7 -","- C32 H44 Cu2 N4 O14 -","2","1","","Graf, Ernest; Wais Hosseini, Mir; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: design of coordinating tectons based on diazamacrocycles bearing pyridine units and formation of 1D copper coordination networks","New Journal of Chemistry","2005","29","2","343","","10.1039/b416145a","","","0.71073","MoKα","","0.0904","0.0696","","","0.175","0.191","","","","","","1.109","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050064","8.6452","0.0002","11.4949","0.0003","12.4095","0.0003","108.692","0.002","93.096","0.002","107.264","0.002","1100.27","0.05","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H52 Cu2 N4 O14 -","- C37 H44 Cu2 N4 O14 -","- C37 H44 Cu2 N4 O14 -","1","0.5","","Graf, Ernest; Wais Hosseini, Mir; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: design of coordinating tectons based on diazamacrocycles bearing pyridine units and formation of 1D copper coordination networks","New Journal of Chemistry","2005","29","2","343","","10.1039/b416145a","","","0.71073","MoKα","","0.0827","0.0531","","","0.1707","0.1888","","","","","","1.024","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050065","14.991","0.003","17.852","0.004","19.543","0.004","90","","100.154","0.003","90","","5148.2","1.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H62 Ag3 N13 O17 -","- C42 H46 Ag3 N13 O17 -","- C168 H184 Ag12 N52 O68 -","4","1","","Laura Valencia; Rufina Bastida; Alejandro Macías; Manuel Vicente; Paulo Pérez-Lourido","Synthesis and helical polymeric structure of a luminescent pendant-armed macrocyclic silver(i) complex with Ag?Ag interactions","New Journal of Chemistry","2005","29","3","424","","10.1039/b416342g","","","0.71073","MoKα","","0.0583","0.0314","","","0.0766","0.0935","","","","","","1.069","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050066","8.413","0.002","9.333","0.002","10.846","0.002","68.71","0.003","73.31","0.003","76.7","0.003","752.5","0.3","140","2","140","2","","","","","","","","4","P -1","-P 1","2","","3,5-dimethyl-1-thiocarboxamide pyrazole","","- C6 H9 N3 S -","- C6 H9 N3 S -","- C24 H36 N12 S4 -","4","2","","Kovács, Attila; Nemcsok, Dénes; Pokol, György; Mészáros Szécsényi, Katalin; Leovac, Vukadin M.; Jaćimović, Željko K.; Radosavljević Evans, Ivana; Howard, Judith A. K.; Tomić, Zoran D.; Giester, Gerald","Structural, spectroscopic and computational studies of the HgL2Cl2 complex (L = 3,5-dimethyl-1-thiocarboxamide pyrazole) and the crystal structure of L","New Journal of Chemistry","2005","29","6","833","","10.1039/b416816j","","","0.71073","MoKα","","0.0597","0.0397","","","0.0956","0.1038","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050067","8.8204","0.0015","9.9196","0.0016","11.1329","0.0018","82.063","0.003","80.698","0.003","83.015","0.003","947.1","0.3","120","","120","","","","","","","","?","6","P -1","-P 1","2","","","","- C12 H18 Cl2 Hg N6 S2 -","- C12 H18 Cl2 Hg N6 S2 -","- C24 H36 Cl4 Hg2 N12 S4 -","2","1","","Kovács, Attila; Nemcsok, Dénes; Pokol, György; Mészáros Szécsényi, Katalin; Leovac, Vukadin M.; Jaćimović, Željko K.; Radosavljević Evans, Ivana; Howard, Judith A. K.; Tomić, Zoran D.; Giester, Gerald","Structural, spectroscopic and computational studies of the HgL2Cl2 complex (L = 3,5-dimethyl-1-thiocarboxamide pyrazole) and the crystal structure of L","New Journal of Chemistry","2005","29","6","833","","10.1039/b416816j","","","0.71073","MoKα","","0.0292","0.0268","","0.0696","0.0694","0.0694","","","","","","1.0027","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050068","8.1686","0.0016","10.4479","0.0018","10.8106","0.0017","62.257","0.007","69.159","0.007","80.817","0.009","763.1","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 Ag3 N3 O7 -","- C12 H8 Ag3 N3 O7 -","- C24 H16 Ag6 N6 O14 -","2","1","","Liu, Zheng; Liu, Ping; Chen, Yun; Wang, Jian; Huang, Meihua","Synthesis, structures, and photoluminescent properties of two ligand unsupported silver(i) coordination polymers from isonicotinate anions","New Journal of Chemistry","2005","29","3","474","","10.1039/b417363e","","","0.71073","MoKα","","0.025","0.0224","","","0.0568","0.0578","","","","","","1.07","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050069","14.0652","0.0011","15.6176","0.0014","11.5015","0.0011","90","","99.635","0.007","90","","2490.8","0.4","120","1","120","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","tris(2-hydroxypyridine)-2-hydroxypyridinium triiodide","tris(2-hydroxypyridine)-2-hydroxypyridinium triiodide","","- C20 H21 I3 N4 O4 -","- C20 H21 I3 N4 O4 -","- C80 H84 I12 N16 O16 -","4","0.5","","Antoniadis, Constantinos D.; Hadjikakou, Sotiris K.; Hadjiliadis, Nick; Kubicki, Maciej; Butler, Ian S.","Synthesis, X-ray characterization and study of new ionic complexes of 2-pyridone, obtained by oxidation with I2","New Journal of Chemistry","2005","29","5","714","","10.1039/b417828a","","","0.71073","MoKα","","0.0703","0.0467","","","0.097","0.1059","","","","","","0.942","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050070","11.2119","0.0016","12.6039","0.0018","23.715","0.003","78.545","0.012","76.688","0.012","86.422","0.012","3195.8","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","hexakis(2-hydroxypyridine)-bis(2-hydroxypyridinium) di- heptaiodide diiodine iodate","hexakis(2-hydroxypyridine)-bis(2-hydroxypyridinium) di-heptaiodide diiodine iodate","","- C40 H42 I13 N8 O8 -","- C40 H42 I13 N8 O8 -","- C80 H84 I26 N16 O16 -","2","1","","Antoniadis, Constantinos D.; Hadjikakou, Sotiris K.; Hadjiliadis, Nick; Kubicki, Maciej; Butler, Ian S.","Synthesis, X-ray characterization and study of new ionic complexes of 2-pyridone, obtained by oxidation with I2","New Journal of Chemistry","2005","29","5","714","","10.1039/b417828a","","","0.71073","MoKα","","0.2058","0.0699","","","0.1166","0.1576","","","","","","0.772","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050071","24.2866","0.0004","8.1348","0.0002","18.8753","0.0004","90","","128.844","0.0008","90","","2904.48","0.11","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H13 Co N9 -","- C11 H13 Co N9 -","- C88 H104 Co8 N72 -","8","1","","Bai, Shi-Qiang; Gao, En-Qing; He, Zheng; Fang, Chen-Jie; Yan, Chun-Hua","Crystal structures and magnetic behaviour of three new azido-bridged dinuclear cobalt(ii) and copper(ii) complexes","New Journal of Chemistry","2005","29","7","935","","10.1039/b418239a","","","0.71073","MoKα","","0.0507","0.0303","","","0.074","0.0802","","","","","","1.016","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050072","24.3949","0.0003","8.0468","0.0001","18.7195","0.0003","90","","128.654","0.0007","90","","2869.64","0.07","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H13 Cu N9 -","- C11 H13 Cu N9 -","- C88 H104 Cu8 N72 -","8","1","","Bai, Shi-Qiang; Gao, En-Qing; He, Zheng; Fang, Chen-Jie; Yan, Chun-Hua","Crystal structures and magnetic behaviour of three new azido-bridged dinuclear cobalt(ii) and copper(ii) complexes","New Journal of Chemistry","2005","29","7","935","","10.1039/b418239a","","","0.71073","MoKα","","0.062","0.0324","","","0.0718","0.0775","","","","","","0.974","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050073","12.015","0.0004","6.394","0.0002","19.1148","0.0008","90","","102.01","0.03","90","","1436.33","0.18","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 Cu N8 -","- C13 H12 Cu N8 -","- C52 H48 Cu4 N32 -","4","1","","Bai, Shi-Qiang; Gao, En-Qing; He, Zheng; Fang, Chen-Jie; Yan, Chun-Hua","Crystal structures and magnetic behaviour of three new azido-bridged dinuclear cobalt(ii) and copper(ii) complexes","New Journal of Chemistry","2005","29","7","935","","10.1039/b418239a","","","0.71073","MoKα","","0.0912","0.0467","","","0.0987","0.1128","","","","","","1.048","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050074","16.9935","0.0008","22.1127","0.0011","23.0089","0.0011","69.117","0.001","69.422","0.001","71.419","0.001","7375.6","0.6","123","2","123","2","","","","","","","","6","P -1","-P 1","2","((Eu(H2O)7)0.33(Eu(H2O)4)2(Eu(H2O)6)(4,4-dipyridine-N,N- dioxide)4.5 (p-sulfonatocalix(8)arene-2H)).1.5(4,4-dipyridine-N,N- dioxide).8(H2O)","","","- C113.5 H134 Eu3.33 N11.5 O68.5 S8 -","- C113.5 H84 Eu3.33 N11.5 O68.11 S8 -","- C227 H168 Eu6.66 N23 O136.22 S16 -","2","1","","Dalgarno, Scott J.; Hardie, Michaele J.; Atwood, Jerry L.; Warren, John E.; Raston, Colin L.","A complex 3D ‘wavy brick wall’ coordination polymer based on p-sulfonatocalix[8]arene","New Journal of Chemistry","2005","29","5","649","","10.1039/b418352p","","","0.6903","Synchrotron","","0.0942","0.0699","","","0.1932","0.2147","","","","","","1.029","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050075","9.1235","0.0001","16.8059","0.0003","18.7246","0.0003","90","","76.758","0.001","90","","2794.68","0.07","176","2","176","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H48 Si -","- C28 H48 Si -","- C112 H192 Si4 -","4","1","","Schultz, Madeleine; Sofield, Chadwick D.; Walter, Marc D.; Andersen, Richard A.","Coordination complexes of bivalent ansa-ytterbocenes: synthesis, structure and comparison with related unbridged ytterbocenes and ansa-ferrocenes","New Journal of Chemistry","2005","29","7","919","","10.1039/b418550a","","","0.71073","MoKα","","0.054","0.0464","","","0.1139","0.1189","","","","","","1.089","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050076","15.5073","0.0002","12.0673","0.0001","32.6681","0.0001","90","","96.81","0.001","90","","6070.09","0.1","159","2","159","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H46 Fe Si5 -","- C24 H46 Fe Si5 -","- C192 H368 Fe8 Si40 -","8","1","","Schultz, Madeleine; Sofield, Chadwick D.; Walter, Marc D.; Andersen, Richard A.","Coordination complexes of bivalent ansa-ytterbocenes: synthesis, structure and comparison with related unbridged ytterbocenes and ansa-ferrocenes","New Journal of Chemistry","2005","29","7","919","","10.1039/b418550a","","","0.71073","MoKα","","0.0523","0.0423","","","0.0978","0.1034","","","","","","1.169","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050077","31.0159","0.0002","9.9066","0.0002","19.6178","0.0002","90","","117.403","0.001","90","","5351.43","0.13","175","2","175","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H46 Fe Si -","- C28 H46 Fe Si -","- C224 H368 Fe8 Si8 -","8","1","","Schultz, Madeleine; Sofield, Chadwick D.; Walter, Marc D.; Andersen, Richard A.","Coordination complexes of bivalent ansa-ytterbocenes: synthesis, structure and comparison with related unbridged ytterbocenes and ansa-ferrocenes","New Journal of Chemistry","2005","29","7","919","","10.1039/b418550a","","","0.71073","MoKα","","0.0491","0.0422","","","0.1051","0.1108","","","","","","1.018","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050078","10.833","0.003","13.688","0.004","22.584","0.004","96.46","0.02","96.06","0.03","106.02","0.02","3165.4","1.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","cis-nitrosyl-(5-(4'pyridyl)-10,15,20-trisphenyl-porphyrin)- tetrachloro-ruthenate(III) tetrabutylamonium dichloroform solvate","","- C61 H67 Cl10 N7 O Ru -","- C61 H67 Cl10 N7 O Ru -","- C122 H134 Cl20 N14 O2 Ru2 -","2","1","","Gianferrara, Teresa; Serli, Barbara; Zangrando, Ennio; Iengo, Elisabetta; Alessio, Enzo","Pyridylporphyrins peripherally coordinated to ruthenium-nitrosyls, including the water-soluble Na4[Zn·4′TPyP{RuCl4(NO)}4]: synthesis and structural characterization","New Journal of Chemistry","2005","29","7","895","","10.1039/b418855a","","","0.71073","MoKα","","0.1053","0.0666","","","0.1685","0.2005","","","","","","1.046","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050079","16.978","0.004","14.283","0.004","73.283","0.01","90","","91.28","0.03","90","","17766","7","100","2","100","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","fac-trichloro-cis-bis(5-(4'pyridyl)-10,15,20-trisphenyl-porphyrin)-nitrosyl- ruthenium(II) chloroform n-hexane solvate","","- C91.5 H67.5 Cl10.5 N11 O Ru -","- C91.5 H67.5 Cl10.5 N11 O Ru -","- C732 H540 Cl84 N88 O8 Ru8 -","8","1","","Gianferrara, Teresa; Serli, Barbara; Zangrando, Ennio; Iengo, Elisabetta; Alessio, Enzo","Pyridylporphyrins peripherally coordinated to ruthenium-nitrosyls, including the water-soluble Na4[Zn·4′TPyP{RuCl4(NO)}4]: synthesis and structural characterization","New Journal of Chemistry","2005","29","7","895","","10.1039/b418855a","","","1","synchrotron","","0.1488","0.113","","","0.2747","0.3129","","","","","","1.176","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050080","38.252","0.006","8.936","0.003","40.475","0.006","90","","103.49","0.03","90","","13453","6","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","(5,10,15,20-(4'pyridyl)-porphyrin)-tetra-(tetrachloro-nitrosyl-ruthenate(III)) tetra(tetrabutylamonium) bis(nitromethane) diethylether solvate","","- C108 H181 Cl16 N18 O8.5 Ru4 -","- C108 H181 Cl16.41 N17.59 O8.09 Ru4 -","- C432 H724 Cl65.64 N70.36 O32.36 Ru16 -","4","1","","Gianferrara, Teresa; Serli, Barbara; Zangrando, Ennio; Iengo, Elisabetta; Alessio, Enzo","Pyridylporphyrins peripherally coordinated to ruthenium-nitrosyls, including the water-soluble Na4[Zn·4′TPyP{RuCl4(NO)}4]: synthesis and structural characterization","New Journal of Chemistry","2005","29","7","895","","10.1039/b418855a","","","1","synchrotron","","0.0559","0.0549","","","0.1522","0.1541","","","","","","1.108","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050081","6.036","0.003","12.342","0.005","5.788","0.003","90","","90","","90","","431.18","","295","1","295","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H7 N O2 -","- C3 H7 N O2 -","- C12 H28 N4 O8 -","4","1","","C. Wilson; Minakshi Ghosh; L. Johnson; Dean Myles; Wenging Wang.","Neutron diffraction investigations of L- and D-alanine at different temperatures: The search for structural evidence for parity violation","New J.Chem.(Nouv.J.Chim.)","2005","","","","","","","neutron","","neutron","","0.0784","0.0784","","","0.183","0.183","","","","","","1.78","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050082","6.043","0.003","12.337","0.005","5.784","0.003","90","","90","","90","","431.21","","295","1","295","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H7 N O2 -","- C3 H7 N O2 -","- C12 H28 N4 O8 -","4","1","","C. Wilson; Minakshi Ghosh; L. Johnson; Dean Myles; Wenging Wang.","Neutron diffraction investigations of L- and D-alanine at different temperatures: The search for structural evidence for parity violation","New J.Chem.(Nouv.J.Chim.)","2005","","","","","","","neutron","","neutron","","0.0844","0.0844","","","0.2079","0.2079","","","","","","2.143","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050083","5.942","0.003","12.261","0.005","5.785","0.0003","90","","90","","90","","421.5","0.3","60","1","60","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H7 N O2 -","- C3 H7 N O2 -","- C12 H28 N4 O8 -","4","1","","Wilson, Chick C.; Myles, Dean; Ghosh, Minakshi; Johnson, Louise N.; Wang, Wenging","Neutron diffraction investigations of l- and d-alanine at different temperatures: the search for structural evidence for parity violation","New Journal of Chemistry","2005","29","10","1318","","10.1039/b419295h","","neutron","","neutron","","0.0799","0.0799","","","0.2012","0.2012","","","","","","1.941","","","","has coordinates","209450","2020-10-21","18:00:00",""
"7050084","5.94","0.003","12.274","0.005","5.806","0.003","90","","90","","90","","423.3","0.4","60","1","60","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C3 H7 N O2 -","- C3 H7 N O2 -","- C12 H28 N4 O8 -","4","1","","Wilson, Chick C.; Myles, Dean; Ghosh, Minakshi; Johnson, Louise N.; Wang, Wenging","Neutron diffraction investigations of l- and d-alanine at different temperatures: the search for structural evidence for parity violation","New Journal of Chemistry","2005","29","10","1318","","10.1039/b419295h","","neutron","","neutron","","0.0588","0.0588","","","0.1499","0.1499","","","","","","1.315","","","","has coordinates","209450","2020-10-21","18:00:00",""
"7050085","8.9484","0.0005","6.7152","0.0003","12.4323","0.0007","90","","92.5","0.003","90","","746.35","0.07","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 O4 -","- C18 H20 O4 -","- C36 H40 O8 -","2","0.5","","Sergey P. Gromov; Artem I. Vedernikov; Evgeny N. Ushakov; Natalia A. Lobova; Asya A. Botsmanova; Lyudmila G. Kuz'mina; Andrei V. Churakov; Yuri A. Strelenko; Michael V. Alfimov; Judith A. K. Howard; Dan Johnels; Ulf G. Edlund","Novel supramolecular charge-transfer systems based on bis(18-crown-6)stilbene and viologen analogues bearing two ammonioalkyl groups","New Journal of Chemistry","2005","29","7","881","","10.1039/b500667h","","","0.71073","MoKα","","0.0448","0.0339","","","0.0844","0.0892","","","","","","1.008","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050086","42.7776","0.0015","9.0073","0.0003","8.6096","0.0003","90","","95.988","0.002","90","","3299.3","0.2","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C34 H48 O12 -","- C34 H48 O12 -","- C136 H192 O48 -","4","0.5","","Sergey P. Gromov; Artem I. Vedernikov; Evgeny N. Ushakov; Natalia A. Lobova; Asya A. Botsmanova; Lyudmila G. Kuz'mina; Andrei V. Churakov; Yuri A. Strelenko; Michael V. Alfimov; Judith A. K. Howard; Dan Johnels; Ulf G. Edlund","Novel supramolecular charge-transfer systems based on bis(18-crown-6)stilbene and viologen analogues bearing two ammonioalkyl groups","New Journal of Chemistry","2005","29","7","881","","10.1039/b500667h","","","0.71073","MoKα","","0.0829","0.0435","","","0.0839","0.0949","","","","","","1.015","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050087","6.0846","0.0002","15.6681","0.0004","8.6321","0.0003","90","","96.589","0.001","90","","817.5","0.04","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C14 H13 Ag B F4 N5 -","- C14 H13 Ag B F4 N5 -","- C28 H26 Ag2 B2 F8 N10 -","2","0.5","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71073","MoKα","","0.0471","0.0305","","","0.0725","0.0787","","","","","","1.037","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050088","10.4959","0.0015","11.9036","0.0016","8.6632","0.0012","97.956","0.013","110.611","0.009","92.935","0.013","997.5","0.3","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H16.5 Ag F6 N5 O1.75 Sb -","- C14 H13 Ag F6 N5 O1.748 Sb -","- C28 H26 Ag2 F12 N10 O3.496 Sb2 -","2","1","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71069","MoKα","","0.0352","0.0307","","","0.0788","0.0804","","","","","","1.037","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050089","6.7441","0.0012","13.452","0.002","15.028","0.002","90","","97.568","0.013","90","","1351.5","0.4","123","2","123","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C12 H10 Ag N5 O3 -","- C12 H10 Ag N5 O3 -","- C48 H40 Ag4 N20 O12 -","4","1","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71069","MoKα","","0.0463","0.0347","","","0.0834","0.0862","","","","","","1.046","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050090","6.0509","0.0002","15.8105","0.0004","8.6688","0.0002","90","","97.244","0.001","90","","822.71","0.04","123","2","123","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C14 H13 Ag Cl N5 O4 -","- C14 H13 Ag Cl N5 O4 -","- C28 H26 Ag2 Cl2 N10 O8 -","2","0.5","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71073","MoKα","","0.0308","0.0253","","","0.0625","0.0653","","","","","","1.025","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050091","7.5292","0.0002","9.7601","0.0003","11.8669","0.0004","75.444","0.001","74.672","0.001","83.659","0.002","813.13","0.04","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H13 Ag B F4 N5 -","- C14 H13 Ag B F4 N5 -","- C28 H26 Ag2 B2 F8 N10 -","2","1","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71073","MoKα","","0.0446","0.0296","","","0.0529","0.0567","","","","","","1.028","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050092","9.3202","0.0004","14.296","0.0006","13.2368","0.0004","90","","110.178","0.002","90","","1655.45","0.11","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 Ag Cl N5 O4 -","- C14 H13 Ag Cl N5 O4 -","- C56 H52 Ag4 Cl4 N20 O16 -","4","1","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71073","MoKα","","0.0525","0.03","","","0.0619","0.0686","","","","","","1.034","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050093","8.0933","0.0002","8.8628","0.0003","9.3988","0.0004","89.868","0.002","82.849","0.002","72.614","0.002","637.93","0.04","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H20 Ag2 N10 O6 -","- C24 H20 Ag2 N10 O6 -","- C24 H20 Ag2 N10 O6 -","1","0.5","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71073","MoKα","","0.0342","0.0254","","","0.0551","0.0577","","","","","","1.06","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050094","10.4948","0.0003","13.9768","0.0004","14.3519","0.0004","64.474","0.002","88.167","0.002","77.08","0.001","1846.64","0.1","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C17.5 H17.5 Ag Cl N5 O4 -","- C17.5 H17.5 Ag Cl N5 O4 -","- C70 H70 Ag4 Cl4 N20 O16 -","4","2","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71073","MoKα","","0.0943","0.05","","","0.0963","0.1117","","","","","","1.013","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050095","25.0213","0.0005","9.3011","0.0002","15.9564","0.0004","90","","109.683","0.001","90","","3496.49","0.14","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H8 Ag N5 O3 -","- C10 H7.97 Ag Cl0.03 N5 O3 -","- C120 H95.64 Ag12 Cl0.36 N60 O36 -","12","1.5","","Kennedy, Alan R.; Brown, Karen G.; Graham, Duncan; Kirkhouse, Jennifer B.; Kittner, Madeleine; Major, Claire; McHugh, Callum J.; Murdoch, Paul; Smith, W. Ewen","Chromophore containing bipyridyl ligands. Part 1: supramolecular solid-state structure of Ag(i) complexes","New Journal of Chemistry","2005","29","6","826","","10.1039/b500698h","","","0.71073","MoKα","","0.0458","0.0311","","","0.0595","0.0645","","","","","","1.049","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050096","14.4571","0.0004","16.0168","0.0004","16.1516","0.0005","90","","112.092","0.001","90","","3465.42","0.17","120","1","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C31 H35 B2 Cl2 F8 N3 O2 Ru -","- C31 H35 B2 Cl2 F8 N3 O2 Ru -","- C124 H140 B8 Cl8 F32 N12 O8 Ru4 -","4","1","","Cédric Fischmeister; Loïc Toupet; Pierre H. Dixneuf","Direct propargylation of furan and arene by propargylic alcohols promoted by bisoxazoline‒ruthenium catalysts","New Journal of Chemistry","2005","29","6","765","","10.1039/b501305d","","","0.71069","MoKα","","0.0826","0.0596","","","0.1546","0.175","","","","","","1.074","","","","has coordinates","180054","2020-10-21","18:00:00",""
"7050097","14.7028","0.0012","7.9159","0.0007","28.661","0.002","90","","90","","90","","3335.7","0.5","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C16 H52 N16 O9 -","- C16 H52 N16 O9 -","- C64 H208 N64 O36 -","4","1","","Lee, Sang-Ok; Kariuki, Benson M.; Harris, Kenneth D. M.","Hydrogen-bonded chains of α,ω-diaminoalkane and α,ω-dihydroxyalkane guest molecules lead to disrupted tunnel structures in urea inclusion compounds","New Journal of Chemistry","2005","29","10","1266","","10.1039/b502004m","","","1.54178","CuKα","","0.0776","0.06","","","0.1702","0.1928","","","","","","1.033","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050098","14.5312","0.0012","8.0457","0.0007","28.962","0.002","90","","90","","90","","3386.1","0.5","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C17 H54 N16 O9 -","- C17 H54 N16 O9 -","- C68 H216 N64 O36 -","4","1","","Lee, Sang-Ok; Kariuki, Benson M.; Harris, Kenneth D. M.","Hydrogen-bonded chains of α,ω-diaminoalkane and α,ω-dihydroxyalkane guest molecules lead to disrupted tunnel structures in urea inclusion compounds","New Journal of Chemistry","2005","29","10","1266","","10.1039/b502004m","","","1.54178","CuKα","","0.0751","0.0542","","","0.1484","0.1705","","","","","","1.023","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050099","8.2121","0.0002","8.2121","0.0002","48.6159","0.0014","90","","90","","120","","2839.34","0.13","296","2","296","2","","","","","","","","4","P 31 2 1","P 31 2""","152","","","","- C19 H60 N18 O10 -","- C19 H60 N18 O10 -","- C57 H180 N54 O30 -","3","0.5","","Lee, Sang-Ok; Kariuki, Benson M.; Harris, Kenneth D. M.","Hydrogen-bonded chains of α,ω-diaminoalkane and α,ω-dihydroxyalkane guest molecules lead to disrupted tunnel structures in urea inclusion compounds","New Journal of Chemistry","2005","29","10","1266","","10.1039/b502004m","","","1.54178","CuKα","","0.0773","0.0692","","","0.2056","0.216","","","","","","1.037","","","","has coordinates,has disorder","180054","2020-10-21","18:00:00",""
"7050100","5.2046","0.0003","7.3638","0.0004","14.6064","0.0008","90","","98.604","0.003","90","","553.5","0.05","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 N4 O4 -","- C6 H18 N4 O4 -","- C12 H36 N8 O8 -","2","0.5","","Lee, Sang-Ok; Kariuki, Benson M.; Harris, Kenneth D. M.","Hydrogen-bonded chains of α,ω-diaminoalkane and α,ω-dihydroxyalkane guest molecules lead to disrupted tunnel structures in urea inclusion compounds","New Journal of Chemistry","2005","29","10","1266","","10.1039/b502004m","","","1.54178","CuKα","","0.0333","0.0316","","","0.0928","0.0956","","","","","","1.136","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050101","30.388","0.004","14.59","0.002","22.348","0.003","90","","98.943","0.003","90","","9788","2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C94 H82 Cu3 F24 N26 P4 -","- C94 H82 Cu3 F24 N26 P4 -","- C376 H328 Cu12 F96 N104 P16 -","4","0.5","","Argent, Stephen P.; Adams, Harry; Harding, Lindsay P.; Riis-Johannessen, T.; Jeffery, John C.; Ward, Michael D.","Homo- and heteropolynuclear helicates with a ‘2 + 3 + 2’-dentate compartmental ligand","New Journal of Chemistry","2005","29","7","904","","10.1039/b502423d","","","0.71073","MoKα","","0.1439","0.0707","","","0.173","0.2156","","","","","","1.045","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050102","22.397","0.003","15.0598","0.0019","30.411","0.004","90","","99.856","0.003","90","","10106","2","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C94 H82 Cu3 F24 N24 O4 P4 -","- C94 H82 Cu3 F24 N24 O4 P4 -","- C376 H328 Cu12 F96 N96 O16 P16 -","4","0.5","","Argent, Stephen P.; Adams, Harry; Harding, Lindsay P.; Riis-Johannessen, T.; Jeffery, John C.; Ward, Michael D.","Homo- and heteropolynuclear helicates with a ‘2 + 3 + 2’-dentate compartmental ligand","New Journal of Chemistry","2005","29","7","904","","10.1039/b502423d","","","0.71073","MoKα","","0.1855","0.085","","","0.2079","0.2689","","","","","","1.031","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050103","30.6701","0.0018","13.781","0.0008","21.3348","0.0013","90","","97.511","0.002","90","","8940.1","0.9","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C86 H70 Ag2 B4 F16 Fe N22 -","- C86 H70 Ag2 B4 F16 Fe N22 -","- C344 H280 Ag8 B16 F64 Fe4 N88 -","4","0.5","","Argent, Stephen P.; Adams, Harry; Harding, Lindsay P.; Riis-Johannessen, T.; Jeffery, John C.; Ward, Michael D.","Homo- and heteropolynuclear helicates with a ‘2 + 3 + 2’-dentate compartmental ligand","New Journal of Chemistry","2005","29","7","904","","10.1039/b502423d","","","1.54178","CuKα","","0.0893","0.055","","","0.1248","0.1352","","","","","","0.869","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050104","28.943","0.005","11.5611","0.0019","25.405","0.004","90","","100.848","0.003","90","","8349","2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C87 H73 Ag3 B3 F12 N23 O2 -","- C87 H73 Ag3 B3 F12 N23 O2 -","- C348 H292 Ag12 B12 F48 N92 O8 -","4","1","","Argent, Stephen P.; Adams, Harry; Harding, Lindsay P.; Riis-Johannessen, T.; Jeffery, John C.; Ward, Michael D.","Homo- and heteropolynuclear helicates with a ‘2 + 3 + 2’-dentate compartmental ligand","New Journal of Chemistry","2005","29","7","904","","10.1039/b502423d","","","0.71073","MoKα","","0.0546","0.038","","","0.0969","0.1055","","","","","","1.023","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050105","19.066","0.003","28.822","0.004","19.716","0.003","90","","115.093","0.002","90","","9812","3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C92 H79 Ag4 B4 F16 N25 -","- C95 H70 Ag4 B4 F16 N22 -","- C380 H280 Ag16 B16 F64 N88 -","4","1","","Argent, Stephen P.; Adams, Harry; Harding, Lindsay P.; Riis-Johannessen, T.; Jeffery, John C.; Ward, Michael D.","Homo- and heteropolynuclear helicates with a ‘2 + 3 + 2’-dentate compartmental ligand","New Journal of Chemistry","2005","29","7","904","","10.1039/b502423d","","","0.71073","MoKα","","0.2475","0.1622","","","0.4759","0.5148","","","","","","1.481","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050106","13.477","0.003","4.9491","0.0009","18.952","0.004","90","","108.357","0.004","90","","1199.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H26 N4 O3 -","- C27 H26 N4 O3 -","- C54 H52 N8 O6 -","2","0.5","","Cai, Ping; Li, Ming-xue; Duan, Chun-Ying; Lu, Feng; Guo, Dong; Meng, Qing-Jin","Syntheses, crystal structure and electrochemical properties of dinuclear ruthenium complexes containing saturated and unsaturated spacers","New Journal of Chemistry","2005","29","8","1011","","10.1039/b502656c","","","0.71073","MoKα","","0.1079","0.0615","","","0.1608","0.1778","","","","","","1.015","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050107","25.242","0.01","15.105","0.006","17.269","0.007","90","","98.179","0.006","90","","6517","5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C53 H48 Cl4 N12 O18 Ru2 -","- C54 H42 Cl4 N12 O19 Ru2 -","- C216 H168 Cl16 N48 O76 Ru8 -","4","0.5","","Cai, Ping; Li, Ming-xue; Duan, Chun-Ying; Lu, Feng; Guo, Dong; Meng, Qing-Jin","Syntheses, crystal structure and electrochemical properties of dinuclear ruthenium complexes containing saturated and unsaturated spacers","New Journal of Chemistry","2005","29","8","1011","","10.1039/b502656c","","","0.71073","MoKα","","0.2314","0.0687","","","0.1416","0.1589","","","","","","1.085","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050108","8.7954","0.0011","9.5631","0.0013","13.9798","0.0018","95.811","0.011","91.078","0.011","115.79","0.013","1050.7","0.3","140","2","140","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H54 N2 O12 -","- C44 H54 N2 O12 -","- C44 H54 N2 O12 -","1","0.5","","Suárez, Stéphane; Mamula, Olimpia; Scopelliti, Rosario; Donnio, Bertrand; Guillon, Daniel; Terazzi, Emmanuel; Piguet, Claude; Bünzli, Jean-Claude G.","Lanthanide luminescent mesomorphic complexes with macrocycles derived from diaza-18-crown-6","New Journal of Chemistry","2005","29","10","1323","","10.1039/b503591k","","","0.71073","MoKα","","0.0561","0.0421","","","0.1111","0.1194","","","","","","0.964","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050109","15.2643","0.0009","19.8739","0.0012","22.2367","0.001","90","","130.901","0.003","90","","5098.7","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","p-hexanoyl-calix(4)arene.Nitrobenzene","","","- C58 H69 N O10 -","- C58 H69 N O10 -","- C232 H276 N4 O40 -","4","1","","Dubes, Alix; Udachin, Kostantin A.; Shahgaldian, Patrick; Lazar, Adina N.; Coleman, Anthony W.; Ripmeester, John A.","Guest-induced chain folding in amphiphilic calixarene structures","New Journal of Chemistry","2005","29","9","1141","","10.1039/b503629c","","","0.7107","MoKα","","0.104","0.0687","","","0.1802","0.2097","","","","","","1.033","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050110","11.6164","0.0008","13.1","0.0009","15.4081","0.0011","105.165","0.001","90.198","0.001","91.794","0.001","2261.8","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","p-hexanoyl-calix(4)arene.Methanol","","","- C52.5 H66 O8.5 -","- C52.5 H66 O8.5 -","- C105 H132 O17 -","2","1","","Dubes, Alix; Udachin, Kostantin A.; Shahgaldian, Patrick; Lazar, Adina N.; Coleman, Anthony W.; Ripmeester, John A.","Guest-induced chain folding in amphiphilic calixarene structures","New Journal of Chemistry","2005","29","9","1141","","10.1039/b503629c","","","0.7107","MoKα","","0.0857","0.064","","","0.1796","0.1965","","","","","","1.061","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050111","10.3974","0.0008","15.6582","0.0012","16.6568","0.0012","90.948","0.002","107.931","0.002","100.732","0.002","2527","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","p-hexanoyl-calix(4)arene.Dimethylformamide.Methanol","","","- C55.7 H73.8 N O9.7 -","- C55.7 H73.8 N O9.7 -","- C111.4 H147.6 N2 O19.4 -","2","1","","Dubes, Alix; Udachin, Kostantin A.; Shahgaldian, Patrick; Lazar, Adina N.; Coleman, Anthony W.; Ripmeester, John A.","Guest-induced chain folding in amphiphilic calixarene structures","New Journal of Chemistry","2005","29","9","1141","","10.1039/b503629c","","","0.7107","MoKα","","0.1282","0.0607","","","0.1563","0.179","","","","","","0.945","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050112","10.246","0.0008","15.8637","0.0013","16.5907","0.0014","83.7","0.002","107.745","0.002","99.412","0.002","2528.6","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","p-hexanoyl-calix(4)arene.Dimehylsulfoxyde.Methanol","","","- C55 H74 O10 S -","- C55 H74 O10 S -","- C110 H148 O20 S2 -","2","1","","Dubes, Alix; Udachin, Kostantin A.; Shahgaldian, Patrick; Lazar, Adina N.; Coleman, Anthony W.; Ripmeester, John A.","Guest-induced chain folding in amphiphilic calixarene structures","New Journal of Chemistry","2005","29","9","1141","","10.1039/b503629c","","","0.7107","MoKα","","0.1253","0.0785","","","0.2272","0.2652","","","","","","1.041","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050113","23.106","0.003","12.3869","0.0012","31.118","0.004","90","","108.952","0.014","90","","8423.5","1.9","103","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C71 H86 Cl2 N2 O7 S16 -","- C71 H86 Cl2 N2 O7 S16 -","- C284 H344 Cl8 N8 O28 S64 -","4","1","","Zhao, Bang-Tun; Blesa, María-Jesús; Mercier, Nicolas; Le Derf, Franck; Sallé, Marc","A calixarene‒amide‒tetrathiafulvalene assembly for the electrochemical detection of anions","New Journal of Chemistry","2005","29","9","1164","","10.1039/b504339e","","x-ray","0.71073","MoKα","","0.2719","0.2311","","","0.4728","0.4906","","","","","","1.09","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050114","9.8773","0.0006","12.154","0.0007","18.643","0.0011","100.878","0.002","93.328","0.002","94.944","0.002","2183.3","0.2","173","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H30 N2 O -","- C25 H30 N2 O -","- C100 H120 N8 O4 -","4","2","","Thompson, Barry C.; Abboud, Khalil A.; Reynolds, John R.; Nakatani, Keitaro; Audebert, Pierre","Electrochromic conjugated N-salicylidene-aniline (anil) functionalized pyrrole and 2,5-dithienylpyrrole-based polymers","New Journal of Chemistry","2005","29","9","1128","","10.1039/b504577k","","","0.71073","MoKα","","0.0987","0.0552","","","0.1225","0.1413","","","","","","1.021","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050115","9.6773","0.0001","10.2288","0.0002","14.8317","0.0003","88.96","0.001","71.712","0.001","75.763","0.001","1348.4","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H44 Cd4 N4 O16 -","- C58 H44 Cd4 N4 O16 -","- C58 H44 Cd4 N4 O16 -","1","0.5","","Wen, Yi-Hang; Zhang, Jian; Wang, Xiao-Qin; Feng, Yun-Long; Cheng, Jian-kai; Li, Zhao-Ji; Yao, Yuan-Gen","A rare metal‒organic 3D architecture with a pseudo-primitive cubic topology with double edges constructed from a 12-connected SBU","New Journal of Chemistry","2005","29","8","995","","10.1039/b504917b","","","0.71073","MoKα","","","0.0383","","","0.0917","0.1006","","","","","","1.196","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050116","7.5196","0.0015","8.1049","0.0016","11.426","0.002","101.53","0.03","96.26","0.03","100.54","0.03","663.1","0.3","293","","293","","","","","","","","","6","P 1","P 1","1","Alex-3","","","- C10 H12 I N O6 S -","- C10 H12 I N O6 S -","- C20 H24 I2 N2 O12 S2 -","2","2","","Koposov, Alexey Y.; Nemykin, Victor N.; Zhdankin, Viktor V.","Intra- and intermolecular interactions in the solid state structure of 2-iodylbenzenesulfonamides: a heptacoordinated organic iodine(v) compound","New Journal of Chemistry","2005","29","8","998","","10.1039/b506573a","","","0.71073","MoKα","","0.0658","0.0654","","0.1524","0.1514","0.1514","","","","","","0.9737","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050117","15.878","0.004","8.135","0.011","13.873","0.006","90","","105.53","0.03","90","","1727","3","293","","293","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C13 H18 I N O6 S -","- C13 H18 I N O6 S -","- C52 H72 I4 N4 O24 S4 -","4","2","","Koposov, Alexey Y.; Nemykin, Victor N.; Zhdankin, Viktor V.","Intra- and intermolecular interactions in the solid state structure of 2-iodylbenzenesulfonamides: a heptacoordinated organic iodine(v) compound","New Journal of Chemistry","2005","29","8","998","","10.1039/b506573a","","","0.71073","MoKα","","0.0921","0.0574","","0.1702","0.1261","0.1261","","","","","","0.935","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050118","10.716","0.001","16.811","0.001","13.097","0.001","90","","104.23","0.01","90","","2287","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 N2 O2 S2 -","- C28 H24 N2 O2 S2 -","- C112 H96 N8 O8 S8 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0744","0.0634","","","0.1619","0.1712","","","","","","1.033","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050119","15.279","0.001","12.807","0.001","12.191","0.001","90","","94.51","0.01","90","","2378.1","0.3","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C28 H21 Co N2 O2 S2 -","- C28 H21 Co N2 O2 S2 -","- C112 H84 Co4 N8 O8 S8 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0303","0.0276","","","0.0624","0.0636","","","","","","1.063","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050120","11.383","0.001","11.383","0.001","18.347","0.001","90","","90","","90","","2377.3","0.3","173","2","173","2","","","","","","","","6","P 41","P 4w","76","","","","- C28 H22 N2 O2 S2 Zn -","- C28 H22 N2 O2 S2 Zn -","- C112 H88 N8 O8 S8 Zn4 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0477","0.0375","","","0.0702","0.0737","","","","","","1.022","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050121","11.233","0.001","11.233","0.001","18.428","0.002","90","","90","","90","","2325.3","0.4","150","2","150","2","","","","","","","","6","P 41","P 4w","76","","","","- C28 H22 N2 Ni O2 S2 -","- C28 H22 N2 Ni O2 S2 -","- C112 H88 N8 Ni4 O8 S8 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.2345","0.194","","","0.4342","0.4559","","","","","","1.112","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050122","10.75","0.001","12.299","0.001","12.656","0.001","84.38","0.01","67.41","0.01","70.99","0.01","1460","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36.5 H28 N2 Ni O2.5 S2 -","- C36.5 H28 N2 Ni O2.5 S2 -","- C73 H56 N4 Ni2 O5 S4 -","2","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.075","0.0507","","","0.1099","0.1229","","","","","","1.055","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050123","22.994","0.001","7.612","0.001","17.98","0.002","90","","110.55","0.01","90","","2946.8","0.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H26 N2 O2 S2 Zn -","- C36 H26 N2 O2 S2 Zn -","- C144 H104 N8 O8 S8 Zn4 -","4","0.5","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0529","0.0339","","","0.0664","0.0726","","","","","","1.036","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050124","13.929","0.0003","13.929","0.0003","14.231","0.0005","90","0.001","90","0.001","90","0.002","2761.06","0.13","173","2","173","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C16 H15 Co0.5 N O4 -","- C16 H15 Co0.5 N O4 -","- C128 H120 Co4 N8 O32 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.0787","0.0439","","","0.0924","0.106","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050125","13.925","0.002","13.925","0.002","14.181","0.003","90","","90","","90","","2749.8","0.8","173","2","173","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C16 H15 N Ni0.5 O4 -","- C16 H15 N Ni0.5 O4 -","- C128 H120 N8 Ni4 O32 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.1044","0.0746","","","0.1695","0.1863","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050126","13.925","0.002","13.925","0.002","14.181","0.003","90","","90","","90","","2749.8","0.8","173","2","173","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C15 H15 N O3 Zn0.5 -","- C15 H15 N O3 Zn0.5 -","- C120 H120 N8 O24 Zn4 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.0756","0.0382","","","0.0708","0.0818","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050127","17.254","0.0002","8.395","0.0004","15.994","0.0006","90","0.001","90","0.001","90","0.002","2316.69","0.14","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C14 H12 N O2 -","- C14 H12 N O2 -","- C112 H96 N8 O16 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.0939","0.066","","","0.1532","0.1711","","","","","","1.054","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050128","18.373","0.008","5.489","0.004","11.369","0.004","90","","124.22","0.03","90","","948.1","0.9","122","2","122","2","","","","","","","","3","C 1 2 1","C 2y","5","Schiff base","N-[(1E)-1H-pyrrol-2-ylmethylene]benzene-1,2-diamine","","- C11 H11 N3 -","- C11 H11 N3 -","- C44 H44 N12 -","4","1","","Munro, Orde Q.; Strydom, Sandra D.; Grimmer, Craig D.","Complementary hydrogen bonding in a new tridentate Schiff base ligand: X-ray, DFT and solution NMR studiesElectronic supplementary information (ESI) available: unit cell packing diagram for 3 (Fig. S1) and 1H NMR spectra of 3 as a function of the concentration of added H2O in CDCl3 solution (Fig. S2). See http://www.rsc.org/suppdata/nj/b3/b305946d/","New Journal of Chemistry","2004","28","1","34","","10.1039/b305946d","","","0.71073","MoKα","","0.0382","0.0361","","","0.1","0.1016","","","","","","1.063","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050129","11.13247","0.00012","20.67256","0.00017","7.44834","0.00005","90","","97.985","0.0006","90","","1697.52","0.03","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C11 H8 O2 -","- C11 H8 O2 -","- C88 H64 O16 -","8","2","","Nowell, Harriott; Paul Attfield, J.","X-Ray and neutron powder diffraction studies of the crystal structure of vitamin K3Electronic supplementary information (ESI) available: X-ray powder diffraction data. See http://www.rsc.org/suppdata/nj/b3/b306072a/","New Journal of Chemistry","2004","28","3","406","","10.1039/b306072a","powder diffraction","x-ray","0.598542","","","","","","","","","0.1076","","2.96","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050130","11.11103","0.00025","20.6416","0.0005","7.43426","0.0001","90","","97.949","0.0009","90","","1688.66","0.06","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C11 H8 O2 -","- C11 H8 O2 -","- C88 H64 O16 -","8","2","","Nowell, Harriott; Paul Attfield, J.","X-Ray and neutron powder diffraction studies of the crystal structure of vitamin K3Electronic supplementary information (ESI) available: X-ray powder diffraction data. See http://www.rsc.org/suppdata/nj/b3/b306072a/","New Journal of Chemistry","2004","28","3","406","","10.1039/b306072a","powder diffraction","","","","","","","","","","","","","2.72","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050131","29.5519","0.0012","10.0503","0.0005","19.316","0.0009","90","","112.005","0.004","90","","5319","0.4","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H36 N3 O7 V -","- C26 H36 N3 O7 V -","- C208 H288 N24 O56 V8 -","8","1","","Jozef Tatiersky; Peter Schwendt; Jaromír Marek; Michal Sivák","Racemic vanadium(V) oxo monoperoxo complexes with two achiral bidentate heteroligands. Synthesis, characterization, crystal structure and stereochemistry of K[VO(O2)(ox)(bpy)]·3H2O and Pr4N[VO(O2)(ox)(phen)]","New J. Chem.","2004","28","1","127","133","10.1039/b306090j","","","0.71073","MoKα","","0.0576","0.0417","","","0.0954","0.1021","","","","","","1.004","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050132","9.6777","0.0005","13.8879","0.0006","12.7353","0.0006","90","","97.606","0.005","90","","1696.6","0.14","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 K N2 O10 V -","- C12 H14 K N2 O10 V -","- C48 H56 K4 N8 O40 V4 -","4","1","","Jozef Tatiersky; Peter Schwendt; Jaromír Marek; Michal Sivák","Racemic vanadium(V) oxo monoperoxo complexes with two achiral bidentate heteroligands. Synthesis, characterization, crystal structure and stereochemistry of K[VO(O2)(ox)(bpy)]·3H2O and Pr4N[VO(O2)(ox)(phen)]","New J. Chem.","2004","28","1","127","133","10.1039/b306090j","","","0.71073","MoKα","","0.0301","0.0245","","0.0634","0.0615","","","","1.004","1.038","1.038","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050133","9.755","0.004","8.478","0.003","17.791","0.003","90","","95.72","0.02","90","","1464","0.8","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 Fe2 N4 O4 -","- C32 H30 Fe2 N4 O4 -","- C64 H60 Fe4 N8 O8 -","2","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0601","","","","0.1801","","","","","","1.084","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050134","10.801","0.005","7.696","0.005","17.052","0.004","90","","95.1","0.03","90","","1411.8","1.2","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Fe2 N4 O2 -","- C34 H30 Fe2 N4 O2 -","- C68 H60 Fe4 N8 O4 -","2","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0501","","","","0.1478","","","","","","1.067","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050135","10.766","0.003","7.576","0.003","17.452","0.004","90","","94.59","0.02","90","","1418.9","0.8","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Fe2 N4 O2 -","- C34 H28 Fe2 N4 O2 -","- C68 H56 Fe4 N8 O4 -","2","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0492","","","","0.143","","","","","","1.047","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050136","7.406","0.003","19.131","0.007","20.727","0.003","90","","92.42","0.03","90","","2934.1","1.7","296.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 Fe2 N4 O4 S -","- C32 H30 Fe2 N4 O4 S -","- C128 H120 Fe8 N16 O16 S4 -","4","1","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0407","","","","0.1287","","","","","","1.03","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050137","9.32","0.004","10.951","0.005","13.149","0.004","90","","99.32","0.03","90","","1324.3","0.9","296.3","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H26 Fe N2 O2 -","- C34 H26 Fe N2 O2 -","- C68 H52 Fe2 N4 O4 -","2","1","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.042","","","","0.137","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050138","11.037","0.002","12.652","0.004","7.518","0.005","104.42","0.03","96.41","0.03","88.21","0.03","1010.4","0.8","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H18 Fe N2 O6 -","- C23 H18 Fe N2 O6 -","- C46 H36 Fe2 N4 O12 -","2","1","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0419","","","","0.1119","","","","","","1.055","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050139","12.474","0.004","13.687","0.003","19.39","0.003","90","","94.1","0.02","90","","3302","1.4","296.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H30 Fe2 N4 O8 -","- C38 H30 Fe2 N4 O8 -","- C152 H120 Fe8 N16 O32 -","4","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0521","","","","0.1638","","","","","","1.016","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050140","7.997","0.003","14.278","0.002","17.219","0.002","90","","90","","90","","1966.1","0.8","296.2","","","","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C20 H22 Fe N2 O5 -","- C20 H17 Fe N2 O5 -","- C80 H68 Fe4 N8 O20 -","4","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0565","","","","0.1707","","","","","","1.162","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050141","9.433","0.001","10.255","0.001","12.18","0.002","81.66","0.01","87.44","0.01","73.95","0.01","1120.3","0.3","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H26 O3 Sn -","- C24 H26 O3 Sn -","- C48 H52 O6 Sn2 -","2","1","","Chisholm, Malcolm H.; Delbridge, Ewan E.; Gallucci, Judith C.","Modeling the catalyst resting state in aryl tin(iv) polymerizations of lactide and estimating the relative rates of transamidation, transesterification and chain transferElectronic supplementary information (ESI) available: kinetic data of reactions C and E in Scheme 2. See http://www.rsc.org/suppdata/nj/b3/b306700a/","New Journal of Chemistry","2004","28","1","145","","10.1039/b306700a","","","0.71073","MoKα","","0.0312","0.024","","0.0554","0.0527","","","","1.081","1.1","1.1","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050142","11.554","0.001","11.075","0.001","19.704","0.002","90","","98.947","0.004","90","","2490.7","0.4","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 N2 O4 Sn -","- C24 H34 N2 O4 Sn -","- C96 H136 N8 O16 Sn4 -","4","1","","Chisholm, Malcolm H.; Delbridge, Ewan E.; Gallucci, Judith C.","Modeling the catalyst resting state in aryl tin(iv) polymerizations of lactide and estimating the relative rates of transamidation, transesterification and chain transferElectronic supplementary information (ESI) available: kinetic data of reactions C and E in Scheme 2. See http://www.rsc.org/suppdata/nj/b3/b306700a/","New Journal of Chemistry","2004","28","1","145","","10.1039/b306700a","","","0.71073","MoKα","","0.0452","0.0349","","0.0979","0.0926","","","","1.036","1.087","1.087","","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050143","11.21","0.002","8.8436","0.0018","25.809","0.005","90","","98.39","0.03","90","","2531.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 Cl2 N4 O9 -","- C16 H38 Cl2 N4 O9 -","- C64 H152 Cl8 N16 O36 -","4","1","","Ali, Mahammad; Ray, Ambarish; Sheldrick, William S.; Mayer-Figge, H.; Gao, Song; Sahmes, Alexander I.","Synthesis, crystal structure, EPR and magnetic properties of a cyano-bridged Cuii?Niii heterobimetallic complex: an unusual structure with long-range ferromagnetic exchange through hydrogen bonding","New Journal of Chemistry","2004","28","3","412","","10.1039/b306866h","","","0.71073","MoKα","","0.1742","0.0737","","","0.14","0.1794","","","","","","1.003","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050144","15.14","0.009","12.002","0.004","14.286","0.005","90","","115.62","0.04","90","","2341","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H36 Cu N8 Ni -","- C20 H36 Cu N8 Ni -","- C80 H144 Cu4 N32 Ni4 -","4","0.5","","Ali, Mahammad; Ray, Ambarish; Sheldrick, William S.; Mayer-Figge, H.; Gao, Song; Sahmes, Alexander I.","Synthesis, crystal structure, EPR and magnetic properties of a cyano-bridged Cuii?Niii heterobimetallic complex: an unusual structure with long-range ferromagnetic exchange through hydrogen bonding","New Journal of Chemistry","2004","28","3","412","","10.1039/b306866h","","","0.71073","MoKα","","0.0906","0.0604","","","0.1568","0.1822","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050145","8.6072","0.0007","11.55","0.002","11.857","0.002","99.737","0.002","92.727","0.002","109.999","0.002","1084.6","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H9 Cu K N2 O7 -","- C6 H9 Cu K N2 O7 -","- C24 H36 Cu4 K4 N8 O28 -","4","2","","Malek, Kamilla; Vala, Martin; Swiatek-Kozlowska, Jolanta; Proniewicz, Leonard M.","Solid state study of the copper(ii) complex of 2-hydroxyiminopropanoic acidElectronic supplementary information (ESI) available: bond lengths, bond angles and hydrogen bonds for K[CuHL2]�H2O; harmonic frequencies, IR and Raman intensities and potential energy distributions for hpa and K[CuHL2]�H2O. See http://www.rsc.org/suppdata/nj/b3/b307066m/","New Journal of Chemistry","2004","28","4","477","","10.1039/b307066m","","","0.71073","MoKα","","0.0507","0.0333","","","0.0836","0.0893","","","","","","0.977","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050146","15.018","0.0015","5.0236","0.0005","9.9426","0.0006","90","","106.549","0.005","90","","719.04","0.11","240","2","240","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","hexanoic acid","hexanoic acid","","- C6 H12 O2 -","- C6 H12 O2 -","- C24 H48 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.0732","0.0504","","","0.1253","0.1393","","","","","","1.053","","","","has coordinates","297177","2025-01-07","15:02:33",""
"7050147","16.0089","0.0015","5.0764","0.0004","10.1589","0.0007","90","","92.864","0.003","90","","824.56","0.12","230","2","230","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","heptanoic acid","heptanoic acid","","- C7 H14 O2 -","- C7 H14 O2 -","- C28 H56 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.101","0.0624","","","0.1569","0.1855","","","","","","1.045","","","","has coordinates","297177","2025-01-07","15:02:39",""
"7050148","18.6641","0.0011","4.9756","0.0003","9.5741","0.0005","90","","95.774","0.002","90","","884.59","0.09","170","2","170","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","octanoic acid","octanoic acid","","- C8 H16 O2 -","- C8 H16 O2 -","- C32 H64 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.0853","0.0701","","","0.186","0.1963","","","","","","1.156","","","","has coordinates","297177","2025-01-07","15:02:47",""
"7050149","21.113","0.0003","4.9188","0.0006","10.1177","0.0007","90","","93.778","0.007","90","","1048.45","0.15","270","2","270","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","nonanoic acid","nonanoic acid","","- C9 H18 O2 -","- C9 H18 O2 -","- C36 H72 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.1142","0.0719","","","0.1874","0.2205","","","","","","1.095","","","","has coordinates","297177","2025-01-07","15:02:47",""
"7050150","22.844","0.0016","4.9612","0.0003","9.3977","0.0006","90","","93.559","0.004","90","","1063.02","0.12","170","2","170","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","decanoic acid","decanoic acid","","- C10 H20 O2 -","- C10 H20 O2 -","- C40 H80 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.1261","0.0925","","","0.2108","0.235","","","","","","1.091","","","","has coordinates","297177","2025-01-07","15:02:48",""
"7050151","25.839","0.003","4.9123","0.0004","10.0285","0.0011","90","","99.01","0.003","90","","1257.2","0.2","300","2","300","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","undecanoic acid","undecanoic acid","","- C11 H22 O2 -","- C11 H22 O2 -","- C44 H88 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.1022","0.0714","","","0.183","0.2063","","","","","","1.103","","","","has coordinates","297177","2025-01-07","15:02:48",""
"7050152","27.563","0.002","4.9627","0.0003","9.5266","0.0006","90","","98.006","0.002","90","","1290.41","0.15","270","2","270","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","dodecanoic acid","dodecanoic acid","","- C12 H24 O2 -","- C12 H24 O2 -","- C48 H96 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.0881","0.0671","","","0.1621","0.1813","","","","","","1.186","","","","has coordinates","297177","2025-01-07","15:02:48",""
"7050153","59.88","0.002","4.9425","0.0002","9.8118","0.0005","90","","93.8","0.002","90","","2897.5","0.2","310","2","310","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","tridecanoic acid","tridecanoic acid","","- C13 H26 O2 -","- C13 H26 O2 -","- C104 H208 O16 -","8","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.0949","0.0597","","","0.1496","0.177","","","","","","1.079","","","","has coordinates","297177","2025-01-07","15:02:48",""
"7050154","31.559","0.003","4.9652","0.0005","9.426","0.0011","90","","94.432","0.004","90","","1472.6","0.3","270","2","270","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","tetradecanoic acid","tetradecanoic acid","","- C14 H28 O2 -","- C14 H28 O2 -","- C56 H112 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.7107","MoKα","","0.0722","0.0564","","","0.142","0.1526","","","","","","1.12","","","","has coordinates","297177","2025-01-07","15:02:48",""
"7050155","69.258","0.003","4.9556","0.0002","9.7197","0.0004","90","","98.024","0.002","90","","3303.3","0.2","330","2","330","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","pentadecanoic acid","pentadecanoic acid","","- C15 H30 O2 -","- C15 H30 O2 -","- C120 H240 O16 -","8","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acids","New Journal of Chemistry","2004","28","1","104","114","10.1039/b307208h","","","0.71073","MoKα","","0.1315","0.0697","","","0.1564","0.1889","","","","","","1.118","","","","has coordinates","297177","2025-01-07","15:02:48",""
"7050156","8.949","0.002","9.856","0.002","8.358","0.002","102.12","0.03","110.5","0.03","74.78","0.03","660.6","0.3","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 Ag N5 O4 -","- C12 H8 Ag N5 O4 -","- C24 H16 Ag2 N10 O8 -","2","1","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","199","10.1039/b307384j","","","0.71073","MoKα","","0.0529","0.0421","","0.0918","0.0884","","","","1.101","1.122","1.122","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050157","29.829","0.006","13.139","0.003","8.5558","0.0017","90","","105.95","0.03","90","","3224.1","1.3","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H28 Cu2 N4 O11 -","- C22 H22 Cu2 N4 O11 -","- C88 H88 Cu8 N16 O44 -","4","0.5","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.1342","0.0678","","","0.149","0.1692","","","","","","1.021","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050158","7.4061","0.0015","10.725","0.002","26.453","0.005","90","","96.11","0.03","90","","2089.2","0.7","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Co N4 O10 S -","- C14 H19 Co N4 O10 S -","- C56 H76 Co4 N16 O40 S4 -","4","1","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.0885","0.0547","","","0.1232","0.134","","","","","","1.07","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050159","4.1122","0.0008","13.463","0.003","23.674","0.005","90","","91.69","0.03","90","","1310.1","0.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Cd I2 N8 O2 -","- C24 H16 Cd I2 N8 O2 -","- C48 H32 Cd2 I4 N16 O4 -","2","0.5","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.0783","0.0644","","0.185","0.1569","","","","1.127","1.138","1.138","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050160","7.9571","0.0016","8.674","0.0017","11.326","0.002","94.31","0.03","110.17","0.03","94.66","0.03","726.9","0.3","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H20 Mn N10 O4 S2 -","- C26 H20 Mn N10 O4 S2 -","- C26 H20 Mn N10 O4 S2 -","1","0.5","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.069","0.0594","","","0.1722","0.1821","","","","","","1.043","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050161","13.261","0.002","6.604","0.002","13.588","0.002","90","","119.09","0.02","90","","1039.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H14 N O4 P -","- C9 H14 N O4 P -","- C36 H56 N4 O16 P4 -","4","1","","Jerzy Zon; Nikolaus Amrhein; Roman Gancarz; Maria Kucharska-Zon; R. Latajka; Piotr Miziak; W.Sawka-Dobrowolska; Wojciech Szczepanik; Borys Szefczyk","Experimental and ab initio calculated structures of 2-aminoindan-2-phosphonic acid, a potent inhibitor of phenylalanine ammonia-lyase, and theoretical studies of its binding to the model enzyme structure","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","0.051","0.0398","","","0.1097","0.114","","","","","","1.04","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050162","25.237","0.006","6.167","0.002","20.349","0.006","90","","122.95","0.03","90","","2657.6","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H18 N O6 P -","- C9 H18 N O6 P -","- C72 H144 N8 O48 P8 -","8","1","","Jerzy Zon; Nikolaus Amrhein; Roman Gancarz; Maria Kucharska-Zon; R. Latajka; Piotr Miziak; W.Sawka-Dobrowolska; Wojciech Szczepanik; Borys Szefczyk","Experimental and ab initio calculated structures of 2-aminoindan-2-phosphonic acid, a potent inhibitor of phenylalanine ammonia-lyase, and theoretical studies of its binding to the model enzyme structure","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.048","0.045","","","0.11","0.127","","","","","","0.93","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050163","27.3962","0.0016","27.3962","0.0016","12.6672","0.001","90","","90","","120","","8233.6","0.9","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C28 H58 N8 Ni O4 -","- C28 H58 N8 Ni O4 -","- C252 H522 N72 Ni9 O36 -","9","0.5","","Gülay Gümüş; Vefa Ahsen; Colette Lebrun; Dominique Luneau; Jacques Pécaut","Unprecedented tubular channels assemblies afforded by alkyl-substituted oxamide oxime metal complexes","New J. Chem.","2004","28","2","177","179","10.1039/b307783g","","","0.71073","MoKα","","0.0977","0.0534","","","0.1508","0.1702","","","","","","1.006","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050164","27.8737","0.0019","27.8737","0.0019","12.4102","0.0013","90","","90","","120","","8350.2","1.2","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C28 H58 N8 O4 Pd -","- C28 H58 N8 O4 Pd -","- C252 H522 N72 O36 Pd9 -","9","0.5","","Gülay Gümüş; Vefa Ahsen; Colette Lebrun; Dominique Luneau; Jacques Pécaut","Unprecedented tubular channels assemblies afforded by alkyl-substituted oxamide oxime metal complexes","New J. Chem.","2004","28","2","177","179","10.1039/b307783g","","","0.71073","MoKα","","0.1684","0.046","","","0.1049","0.1504","","","","","","0.651","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050165","13.353","0.0001","17.5779","0.0001","17.4987","0.0002","90","","99.3274","0.0003","90","","4052.95","0.06","173","1","173","1","","","","","","","see text","9","P 1 n 1","P -2yac","7","Dichlorobis(triphenylphosphine oxide)zinc(ii)","","","- C81 H77 F3 N3 O6 P4 Re Ru S -","- C81 H77 F3 N3 O6 P4 Re Ru S -","- C162 H154 F6 N6 O12 P8 Re2 Ru2 S2 -","2","1","","Fritz E. Kühn; Jing-Lin Zuo; Fabrizia Fabrizi de Biani; Ana M. Santos; Yanmei Zhang; Jin Zhao; Angela Sandulache; Eberhardt Herdtweck","4-Ethynylpyridine as bridging moiety in mixed Ru/Re complexes","New J. Chem.","2004","28","1","43","51","10.1039/b307919h","","","0.71073","MoKα","","0.0431","0.0396","","","0.1015","0.104","","","","","","1.031","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050166","15.3648","0.0013","14.4941","0.0014","16.7893","0.0011","90.013","0.006","91.015","0.006","89.99","0.007","3738.4","0.5","293","","293","","","","","","","","?","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H42 N2 O6 -","- C46 H42 N2 O6 -","- C184 H168 N8 O24 -","4","1","","Miroslav Dudič; Pavel Lhoták; Ivan Stibor; Hana Petříčková; Kamil Lang","(Thia)calix[4]arene‒porphyrin conjugates: novel receptors for fullerene complexation with C70 over C60 selectivity","New J. Chem.","2004","28","1","85","90","10.1039/b307988k","","","1.5418","CuKα","","0.2382","0.0953","","0.1347","0.0818","0.0814","","","","","","1.1779","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050167","18.037","0.003","17.973","0.002","19.697","0.002","90.007","0.009","112.25","0.01","90","0.01","5909.9","1.4","293","","293","","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H68 N2 O7 S4 -","- C60 H68 N2 O7 S4 -","- C240 H272 N8 O28 S16 -","4","1","","Miroslav Dudič; Pavel Lhoták; Ivan Stibor; Hana Petříčková; Kamil Lang","(Thia)calix[4]arene‒porphyrin conjugates: novel receptors for fullerene complexation with C70 over C60 selectivity","New J. Chem.","2004","28","1","85","90","10.1039/b307988k","","","1.5418","CuKα","","0.3075","0.1133","","0.2003","0.1011","0.101","","","","","","1.1699","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050168","15.777","0.003","10.409","0.002","15.932","0.003","90","","114.05","0.03","90","","2389.3","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Cl2 N4 Zn -","- C26 H20 Cl2 N4 Zn -","- C104 H80 Cl8 N16 Zn4 -","4","1","","Drew, Michael G. B.; Tocher, Derek A.; Chowdhury, Kiranmoy; Chowdhury, Shubhamoy; Datta, Dipankar","Zinc(ii) mediated synthesis of an N-substituted 2-(2-pyridyl)imidazole from a 1,2-diketone and 2-(aminomethyl)pyridine and its ligational behaviour","New Journal of Chemistry","2004","28","2","323","","10.1039/b308294f","","","0.71073","MoKα","","0.1102","0.0464","","0.3237","0.1135","","","","1.025","0.974","0.974","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050169","16.513","0.018","16.513","0.018","39.02","0.04","90","","90","","90","","10640","2","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C52.5 H42 Cl3 N8 O8.5 Zn -","- C52.5 H40 Cl3.02 N8 O8.5 Zn -","- C420 H320 Cl24.16 N64 O68 Zn8 -","8","1","","Drew, Michael G. B.; Tocher, Derek A.; Chowdhury, Kiranmoy; Chowdhury, Shubhamoy; Datta, Dipankar","Zinc(ii) mediated synthesis of an N-substituted 2-(2-pyridyl)imidazole from a 1,2-diketone and 2-(aminomethyl)pyridine and its ligational behaviour","New Journal of Chemistry","2004","28","2","323","","10.1039/b308294f","","","0.71073","MoKα","","0.1336","0.1177","","","0.2299","0.2402","","","","","","1.243","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050170","15.7601","0.0002","8.9331","0.0001","22.1109","0.0003","90","","90","","90","","3112.92","0.07","295","2","295","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C17 H12 Mn N2 O5 -","- C17 H12 Mn N2 O5 -","- C136 H96 Mn8 N16 O40 -","8","1","","Wang, Chih-Chieh; Lin, Hui-Wen; Yang, Cheng-Han; Liao, Chen-Hui; Lan, Ia-Ting; Lee, Gene-Hsiang","Synthesis and structure of a novel two-dimensional bilayer framework of a [M(C5O5)(dpe)] coordination polymer","New Journal of Chemistry","2004","28","2","180","","10.1039/b308379a","","","0.71073","MoKα","","0.0686","0.0393","","","0.0921","0.1114","","","","","","1.148","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050171","15.6685","0.0011","8.8628","0.0005","21.9418","0.0013","90","","90","","90","","3047","0.3","295","2","295","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C17 H12 Fe N2 O5 -","- C17 H12 Fe N2 O5 -","- C136 H96 Fe8 N16 O40 -","8","1","","Wang, Chih-Chieh; Lin, Hui-Wen; Yang, Cheng-Han; Liao, Chen-Hui; Lan, Ia-Ting; Lee, Gene-Hsiang","Synthesis and structure of a novel two-dimensional bilayer framework of a [M(C5O5)(dpe)] coordination polymer","New Journal of Chemistry","2004","28","2","180","","10.1039/b308379a","","","0.71073","MoKα","","0.0664","0.0481","","","0.1115","0.1202","","","","","","1.074","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050172","15.9401","0.0008","9.0137","0.0004","22.0831","0.0011","90","","90","","90","","3172.9","0.3","295","2","295","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C17 H12 Cd N2 O5 -","- C17 H12 Cd N2 O5 -","- C136 H96 Cd8 N16 O40 -","8","1","","Wang, Chih-Chieh; Lin, Hui-Wen; Yang, Cheng-Han; Liao, Chen-Hui; Lan, Ia-Ting; Lee, Gene-Hsiang","Synthesis and structure of a novel two-dimensional bilayer framework of a [M(C5O5)(dpe)] coordination polymer","New Journal of Chemistry","2004","28","2","180","","10.1039/b308379a","","","0.71073","MoKα","","0.0341","0.0272","","","0.0636","0.0668","","","","","","1.044","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050173","14.449","0.004","14.449","0.004","17.537","0.005","90","0.005","90","0.005","90","0.005","3661.3","1.8","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 O20 S8 Tb -","- C64 H68 Cl3 O20 S8 Tb -","- C128 H136 Cl6 O40 S16 Tb2 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0797","0.0651","","","0.1577","0.1709","","","","","","1.002","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050174","14.488","0.002","14.488","0.002","17.49","0.004","90","","90","","90","","3671.2","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 Eu O20 S8 -","- C64 H72 Cl3 Eu O20 S8 -","- C128 H144 Cl6 Eu2 O40 S16 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0712","0.0674","","","0.1685","0.1745","","","","","","1.001","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050175","14.469","0.002","14.469","0.002","17.509","0.004","90","","90","","90","","3665.5","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 Gd O20 S8 -","- C64 H72 Cl3 Gd O20 S8 -","- C128 H144 Cl6 Gd2 O40 S16 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0769","0.0707","","","0.1806","0.1902","","","","","","0.989","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050176","14.508","0.002","14.508","0.002","17.559","0.004","90","","90","","90","","3695.9","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 La O20 S8 -","- C64 H72 Cl3 La O20 S8 -","- C128 H144 Cl6 La2 O40 S16 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.1099","0.0873","","","0.2195","0.2432","","","","","","1.002","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050177","14.426","0.002","14.426","0.002","17.487","0.004","90","","90","","90","","3639.2","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 O20 S8 Yb -","- C64 H72 Cl3 O20 S8 Yb -","- C128 H144 Cl6 O40 S16 Yb2 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0671","0.0669","","","0.1647","0.1651","","","","","","1.002","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050178","10.612","0.003","11.147","0.003","13.521","0.004","85.155","0.007","74.476","0.007","77.999","0.007","1506.7","0.7","566","2","566","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H31 F6 Fe2 N2 P -","- C32 H31 F6 Fe2 N2 P -","- C64 H62 F12 Fe4 N4 P2 -","2","1","","Carolina Manzur; César Zúñiga; Lorena Millán; Mauricio Fuentealba; Jose A. Mata; Jean-René Hamon; David Carrillo","Preparation, characterization and electrochemical and X-ray structural studies of new conjugated 1,1'-ferrocenediyl-ended [CpFe-arylhydrazone]+ salts","New J. Chem.","2004","28","1","134","144","10.1039/b308626g","","","0.71073","MoKα","","0.0949","0.0651","","","0.1192","0.1271","","","","","","1.174","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050179","12.573","0.0011","16.5448","0.0014","19.0521","0.0016","90","","90","","90","","3963.2","0.6","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","(1,1'-ferrocenedicarboxaldehyde-di((eta$5!-cyclopentadienyl) (eta$6!-4-methoxiphenylhydrazone)iron(ii)))hexaflurophosphate","{1,1'-ferrocenedicarboxaldehyde-di[(η^5^-cyclopentadienyl) (η^6^-4-methoxiphenylhydrazone)iron(II)]}hexaflurophosphate","","- C18 H18 F6 Fe1.5 N2 O P -","- C18 H18 F6 Fe1.5 N2 O P -","- C144 H144 F48 Fe12 N16 O8 P8 -","8","1","","Carolina Manzur; César Zúñiga; Lorena Millán; Mauricio Fuentealba; Jose A. Mata; Jean-René Hamon; David Carrillo","Preparation, characterization and electrochemical and X-ray structural studies of new conjugated 1,1'-ferrocenediyl-ended [CpFe-arylhydrazone]+ salts","New J. Chem.","2004","28","1","134","144","10.1039/b308626g","","","0.71073","MoKα","","0.1291","0.0442","","","0.0951","0.0991","","","","","","0.606","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050180","12.064","0.005","19.817","0.005","11.242","0.005","90.268","0.005","114.159","0.005","88.532","0.005","2451.4","1.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H71 N O6 -","- C54 H47 N O6 -","- C108 H94 N2 O12 -","2","1","","Arena, Giuseppe; Contino, Annalinda; Longo, Elisa; Spoto, Giuseppe; Arduini, Arturo; Pochini, Andrea; Secchi, Andrea; Massera, Chiara; Ugozzoli, Franco","An integrated approach to the study of the recognition of guests containing CH3 and CH2 acidic groups by differently rigidified cone p-tert-butylcalix[4]arene derivativesElectronic supplementary information (ESI) available: experimental conditions used for calorimetric measurements. See http://www.rsc.org/suppdata/nj/b3/b308996g/","New Journal of Chemistry","2004","28","1","56","","10.1039/b308996g","","","0.71069","MoKα","","0.2354","0.0765","","","0.1853","0.198","","","","","","0.832","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050181","11.237","0.005","19.743","0.005","12.286","0.005","90","0.005","113.688","0.005","90","0.005","2496","1.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C54 H70 Cl N O6 -","- C54 H59 Cl0.99 N O6 -","- C108 H118 Cl1.98 N2 O12 -","2","1","","Arena, Giuseppe; Contino, Annalinda; Longo, Elisa; Spoto, Giuseppe; Arduini, Arturo; Pochini, Andrea; Secchi, Andrea; Massera, Chiara; Ugozzoli, Franco","An integrated approach to the study of the recognition of guests containing CH3 and CH2 acidic groups by differently rigidified cone p-tert-butylcalix[4]arene derivativesElectronic supplementary information (ESI) available: experimental conditions used for calorimetric measurements. See http://www.rsc.org/suppdata/nj/b3/b308996g/","New Journal of Chemistry","2004","28","1","56","","10.1039/b308996g","","","0.71069","MoKα","","0.1478","0.0977","","","0.283","0.3275","","","","","","1.116","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050182","19.892","0.005","19.296","0.005","12.102","0.005","90","0.005","90.69","0.005","90","0.005","4645","3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C52 H71 N O4 -","- C52 H71 N O4 -","- C208 H284 N4 O16 -","4","1","","Arena, Giuseppe; Contino, Annalinda; Longo, Elisa; Spoto, Giuseppe; Arduini, Arturo; Pochini, Andrea; Secchi, Andrea; Massera, Chiara; Ugozzoli, Franco","An integrated approach to the study of the recognition of guests containing CH3 and CH2 acidic groups by differently rigidified cone p-tert-butylcalix[4]arene derivativesElectronic supplementary information (ESI) available: experimental conditions used for calorimetric measurements. See http://www.rsc.org/suppdata/nj/b3/b308996g/","New Journal of Chemistry","2004","28","1","56","","10.1039/b308996g","","","1.54178","CuKα","","0.0581","0.0505","","","0.1735","0.1818","","","","","","1.472","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050183","13.644","0.003","14.574","0.005","17.816","0.004","90","","106.64","0.012","90","","3394.3","1.6","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 N4 O2 -","- C17.5 H22 N4 O2 -","- C140 H176 N32 O16 -","8","2","","Isabel Iriepa; F. Javier Villasante; Enrique Gálvez; Juana Bellanato; Avelino Martín; Pilar Gómez-Sal","Synthesis, spectroscopic and crystallographic study of some carbamates from an azabicyclic chloroformate and primary heterocyclic amines","New J. Chem.","2004","28","5","618","624","10.1039/b309065e","","","0.71069","MoKα","","0.227","0.0846","","","0.2287","0.3129","","","","","","0.971","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050184","21.8166","0.0004","7.3939","0.0001","21.5138","0.0003","90","","118.016","0.0007","90","","3063.72","0.08","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","Bis(2,6-bis(hydrazonomethyl)pyridine)copper(ii) diperchlorate bis-acetone solvate","Bis[2,6-bis{hydrazonomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H30 Cl2 Cu N10 O10 -","- C20 H30 Cl2 Cu N10 O10 -","- C80 H120 Cl8 Cu4 N40 O40 -","4","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0569","0.049","","","0.1317","0.1382","","","","","","1.061","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050185","7.1602","0.0001","13.2144","0.0003","17.3567","0.0003","107.677","0.0012","95.9665","0.0013","103.691","0.0008","1492.58","0.05","300","2","300","2","","","","","","","","6","P -1","-P 1","2","Bis(2,6-bis(oximomethyl)pyridine)copper(ii) diperchlorate bis- acetone solvate","Bis[2,6-bis{oximomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H26 Cl2 Cu N6 O14 -","- C20 H26 Cl2 Cu N6 O14 -","- C40 H52 Cl4 Cu2 N12 O28 -","2","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0852","0.0633","","","0.1782","0.1979","","","","","","1.039","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050186","6.9012","0.0002","13.1087","0.0003","17.5759","0.0004","107.264","0.0016","94.6164","0.0016","105.298","0.001","1442.65","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Bis(2,6-bis(oximomethyl)pyridine)copper(ii) diperchlorate bis- acetone solvate","Bis[2,6-bis{oximomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H26 Cl2 Cu N6 O14 -","- C20 H26 Cl2 Cu N6 O14 -","- C40 H52 Cl4 Cu2 N12 O28 -","2","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0457","0.037","","","0.0943","0.1003","","","","","","1.024","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050187","6.858","0.0002","13.063","0.0003","17.5689","0.0005","107.265","0.0014","94.1119","0.0011","105.66","0.001","1427.36","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Bis(2,6-bis(oximomethyl)pyridine)copper(ii) diperchlorate bis- acetone solvate","Bis[2,6-bis{oximomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H26 Cl2 Cu N6 O14 -","- C20 H26 Cl2 Cu N6 O14 -","- C40 H52 Cl4 Cu2 N12 O28 -","2","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0504","0.0393","","","0.1066","0.114","","","","","","1.037","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050188","11.168","0.003","17.158","0.002","23.129","0.006","90","","96.68","0.02","90","","4401.9","1.7","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H46 Cl0 N2 O4 P2 Rh -","- C52 H46 N2 O4 P2 Rh -","- C208 H184 N8 O16 P8 Rh4 -","4","1","","Acharyya, Rama; Basuli, Falguni; Rosair, Georgina; Bhattacharya, Samaresh","Synthesis, structure and electrochemical properties of some oxime complexes of rhodium","New Journal of Chemistry","2004","28","1","115","","10.1039/b309412j","","","0.71073","MoKα","","0.12","0.0578","","","0.1113","0.1347","","","","","","1.014","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050189","6.7072","0.0005","16.0387","0.0011","8.1083","0.0005","90","","91.16","0.004","90","","872.07","0.1","295","2","295","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C7 H7 N3 O4 -","- C7 H7 N3 O4 -","- C28 H28 N12 O16 -","4","1","","Graham, Duncan; Kennedy, Alan R.; McHugh, Callum J.; Smith, W. Ewen; David, William I. F.; Shankland, Kenneth; Shankland, Norman","The crystal structures of three primary products from the selective reduction of 2,4,6-trinitrotoluene","New Journal of Chemistry","2004","28","1","161","","10.1039/b309792g","","","0.71073","MoKα","","0.0859","0.0645","","","0.1689","0.1835","","","","","","1.1","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050190","8.0136","0.0003","8.0502","0.0003","14.2752","0.0005","75.097","0.002","74.059","0.002","78.453","0.002","847.35","0.05","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H7 N3 O4 -","- C7 H7 N3 O4 -","- C28 H28 N12 O16 -","4","2","","Graham, Duncan; Kennedy, Alan R.; McHugh, Callum J.; Smith, W. Ewen; David, William I. F.; Shankland, Kenneth; Shankland, Norman","The crystal structures of three primary products from the selective reduction of 2,4,6-trinitrotoluene","New Journal of Chemistry","2004","28","1","161","","10.1039/b309792g","","","0.71073","MoKα","","0.0711","0.0611","","","0.1794","0.1852","","","","","","1.122","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050191","15.098","0.0004","3.9219","0.0001","16.4446","0.0005","90","","116.586","0.002","90","","870.77","0.04","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 N3 O5 -","- C7 H7 N3 O5 -","- C28 H28 N12 O20 -","4","1","","Graham, Duncan; Kennedy, Alan R.; McHugh, Callum J.; Smith, W. Ewen; David, William I. F.; Shankland, Kenneth; Shankland, Norman","The crystal structures of three primary products from the selective reduction of 2,4,6-trinitrotoluene","New Journal of Chemistry","2004","28","1","161","","10.1039/b309792g","","","0.71073","MoKα","","0.0642","0.0417","","","0.1019","0.112","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050192","18.591","0.002","10.9955","0.0015","21.767","0.003","90","","100.15","0.014","90","","4379.9","1","273","2","273","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C28 H36 O12 -","- C28 H36 O12 -","- C168 H216 O72 -","6","0.75","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.1291","0.0697","","","0.2529","0.305","","","","","","0.934","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050193","10.5028","0.0015","12.5327","0.0014","12.1758","0.0015","90","","92.081","0.016","90","","1601.6","0.4","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 O4 S2 -","- C14 H18 O4 S2 -","- C56 H72 O16 S8 -","4","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.0513","0.0351","","","0.0894","0.0959","","","","","","0.993","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050194","6.7348","0.0015","7.0518","0.0015","11.256","0.002","75.3","0.03","73.98","0.03","71.04","0.03","478","0.2","213","2","213","2","","","","","","","","3","P -1","-P 1","2","","","","- C10 H10 O6 -","- C10 H10 O6 -","- C20 H20 O12 -","2","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.039","0.0311","","","0.0763","0.079","","","","","","0.956","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050195","19.461","0.003","5.7894","0.0007","32.412","0.006","90","","94.33","0.02","90","","3641.4","1","213","2","213","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 O6 -","- C18 H26 O6 -","- C144 H208 O48 -","8","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.075","0.0535","","","0.1245","0.1393","","","","","","1.058","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050196","8.694","0.002","9.24","0.003","9.899","0.003","110.1","0.03","98.04","0.03","98.76","0.03","722.1","0.4","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 Br2 O6 -","- C12 H12 Br2 O6 -","- C24 H24 Br4 O12 -","2","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.0715","0.058","","","0.1413","0.1481","","","","","","0.962","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050197","11.234","0.0013","7.4699","0.0011","20.184","0.002","90","","96.541","0.013","90","","1682.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Br2 O6 -","- C14 H16 Br2 O6 -","- C56 H64 Br8 O24 -","4","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.0424","0.0281","","","0.0598","0.0615","","","","","","0.797","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050198","24.9759","0.0007","24.9758","0.0007","16.2578","0.00029","90","0.0005","90","0.0005","90","0.0005","10141.5","0.4","","","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C20 H30 Br2 N4 O1.75 -","- C20 H30 Br2 N4 O1.75 -","- C320 H480 Br32 N64 O28 -","16","1","","Raphaël Tripier; Stéphanie Develay; Michel Le Baccon; Françoise Chuburu; François Michaud; Henri Handel","Self-assembly route from a bis-aminal derivative to a new cyclam based macropentacycle","New J. Chem.","2004","28","2","173","176","10.1039/b310074j","","","0.71073","MoK-alpha","","0.1022","0.0695","","0.2348","0.1947","","","","1.069","1.129","1.129","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050199","9.369","0.002","16.409","0.002","16.632","0.002","90","","90","","90","","2556.9","0.7","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H10 Co4 O12 -","- C22 H10 Co4 O12 -","- C88 H40 Co16 O48 -","4","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0594","0.0439","","","0.0789","0.086","","","","","","1.043","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7050200","9.9757","0.0002","35.2755","0.0008","17.6562","0.0004","90","","106.167","0.009","90","","5967.5","0.4","180","2","180","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C68 H54 Co4 O8 P4 -","- C68 H54 Co4 O8 P4 -","- C272 H216 Co16 O32 P16 -","4","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71073","MoKα","","0.0595","0.0458","","0.271","0.0997","","","","1.131","1.148","1.148","","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050201","39.7446","0.0005","15.4562","0.0002","16.7757","0.0003","90","","91.171","0.001","90","","10303.2","0.3","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H32 Co4 O10 P2 -","- C45 H32 Co4 O10 P2 -","- C360 H256 Co32 O80 P16 -","8","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0842","0.0585","","","0.1882","0.2091","","","","","","1.048","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050202","40.5806","0.0005","11.9801","0.0002","36.1936","0.0005","90","","118.245","0.008","90","","15500.8","1.2","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C79.5 H70 Cl4 Co4 O10 P4 -","- C79.5 H68.5 Cl4 Co4 O10 P4 -","- C636 H548 Cl32 Co32 O80 P32 -","8","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0817","0.0578","","","0.1521","0.18","","","","","","1.044","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050203","12.465","0.0004","12.9587","0.0005","13.8733","0.0004","69.498","0.002","73.291","0.002","81.816","0.002","2008.22","0.12","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H28 Cl1.5 Co4 O13 S2 -","- C34 H28 Cl1.5 Co4 O13 S2 -","- C68 H56 Cl3 Co8 O26 S4 -","2","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.1009","0.0549","","","0.1278","0.1477","","","","","","1.046","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050204","11.3551","0.0001","13.8087","0.0002","23.8944","0.0003","73.855","0.002","80.77","0.002","82.12","0.002","3535.32","0.08","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C75 H70 Cl2 Co4 O8 P4 -","- C75 H70 Cl2 Co4 O8 P4 -","- C150 H140 Cl4 Co8 O16 P8 -","2","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0797","0.0564","","","0.1402","0.1543","","","","","","1.019","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050205","12.48","0.003","12.706","0.003","13.148","0.003","70.68","0.03","77.02","0.03","81.03","0.03","1909.6","0.9","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H40 Ga I2 N2 -","- C39 H47 Ga I2 N2 -","- C78 H94 Ga2 I4 N4 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0616","0.0512","","","0.1182","0.1252","","","","","","1.028","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050206","28.873","0.006","14.539","0.003","29.261","0.006","90","","101.29","0.03","90","","12046","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C96 H92 Ga6 I12 N24 O4 -","- C96 H88 Ga6 I12 N24 O4 -","- C384 H352 Ga24 I48 N96 O16 -","4","0.5","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0898","0.0569","","","0.1194","0.1319","","","","","","1.059","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050207","11","0.002","12.525","0.003","21.899","0.004","105.18","0.03","94.44","0.03","99.69","0.03","2846.8","1.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H49 Ga2 I4 N13 O2 -","- C50 H47 Ga2 I4 N13 O2 -","- C100 H94 Ga4 I8 N26 O4 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0926","0.0553","","","0.1264","0.1446","","","","","","1.007","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050208","7.357","0.0015","13.306","0.003","13.759","0.003","99.44","0.03","97.59","0.03","102.53","0.03","1277.2","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H18 Ga I3 N4 -","- C23 H18 Ga I3 N4 -","- C46 H36 Ga2 I6 N8 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0801","0.045","","","0.0857","0.097","","","","","","1.04","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050209","22.813","0.005","14.364","0.003","17.672","0.004","90","","124.81","0.03","90","","4755","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H44 Ga2 I4 N4 -","- C36 H44 Ga2 I4 N4 -","- C144 H176 Ga8 I16 N16 -","4","0.5","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0445","0.0325","","","0.0696","0.0736","","","","","","1.046","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050210","9.617","0.0019","14.831","0.003","10.14","0.002","90","","107.11","0.03","90","","1382.3","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 Ga2 I4 N4 -","- C20 H28 Ga2 I4 N4 -","- C40 H56 Ga4 I8 N8 -","2","0.5","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0326","0.029","","","0.0669","0.0683","","","","","","1.071","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050211","17.008","0.003","16.621","0.003","17.465","0.004","90","","90","","90","","4937.2","1.7","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H30 Cl3 In N2 O -","- C22 H30 Cl3 In N2 O -","- C176 H240 Cl24 In8 N16 O8 -","8","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0795","0.0463","","","0.0884","0.0995","","","","","","1.022","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050212","10.285","0.002","13.001","0.003","16.458","0.003","76.95","0.03","86.76","0.03","81.91","0.03","2121.8","0.8","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H43 Ga2 I6 N3 -","- C33 H43 Ga2 I6 N3 -","- C66 H86 Ga4 I12 N6 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0807","0.0655","","","0.1652","0.1757","","","","","","1.083","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050213","21.246","0.004","17.803","0.004","11.048","0.002","90","","90","","90","","4178.8","1.4","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C38 H36 Ga I3 N10 -","- C38 H36 Ga I3 N10 -","- C152 H144 Ga4 I12 N40 -","4","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0595","0.0484","","","0.1109","0.1174","","","","","","1.035","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050214","23.869","0.002","23.869","0.002","6.4684","0.0005","90","","90","","120","","3191.5","0.5","253","2","253","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C21 H12 Br3 N3 O3 -","- C21 H12 Br3 N3 O3 -","- C126 H72 Br18 N18 O18 -","6","0.333333","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0539","0.0343","","","0.056","0.0595","","","","","","0.9","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050215","5.9681","0.0004","13.6038","0.0012","16.0136","0.0013","111.029","0.009","91.527","0.009","96.39","0.01","1202.89","0.18","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C24.5 H3.5 Cl0.5 F15 N3 O3 -","- C24.502 H3.506 Cl0.498 F15 N3 O3 -","- C49.004 H7.012 Cl0.996 F30 N6 O6 -","2","1","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0612","0.0352","","","0.0824","0.0898","","","","","","0.87","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050216","5.9555","0.0005","13.5912","0.0012","16.1207","0.0014","111.055","0.01","91.871","0.01","95.776","0.01","1208.2","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H5 F15 N3 O3 -","- C25 H5 F15 N3 O3 -","- C50 H10 F30 N6 O6 -","2","1","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0665","0.0382","","","0.0904","0.098","","","","","","0.845","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050217","6.2648","0.0006","17.8465","0.0017","20.782","0.002","86.114","0.012","84.699","0.012","88.033","0.011","2307.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 Br3 F12 N3 O3 -","- C21 Br3 F12 N3 O3 -","- C84 Br12 F48 N12 O12 -","4","2","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0658","0.0406","","","0.0936","0.1004","","","","","","0.972","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050218","5.996","0.0005","26.565","0.0015","13.533","0.001","90","","99.315","0.009","90","","2127.2","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H0 F15 N3 O3 -","- C21 F15 N3 O3 -","- C84 F60 N12 O12 -","4","2","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0457","0.0353","","","0.0813","0.085","","","","","","0.94","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050219","9.828","0.002","15.632","0.003","20.084","0.004","90","","90","","90","","3085.5","1.1","180","2","180","2","","","","","","","synthesis as described","6","P n m a","-P 2ac 2n","62","","Hexa(3-thienyl)cyclotriphosphazene","","- C25 H19 Cl3 N3 P3 S6 -","- C12.5 H9 Cl1.5 N1.5 P1.5 S3 -","- C100 H72 Cl12 N12 P12 S24 -","8","1","","Virginie Vicente; Alain Fruchier; Marc Taillefer; Corinne Combes-Chamalet; Ian J. Scowen; Françoise Plénat; Henri-Jean Cristau","Synthesis and structural studies (1H, 13C, 31P NMR and X-ray) of new C-bonded cyclotriphosphazenes with heterocyclic substituents from novel phosphinic acid derivatives","New J. Chem.","2004","28","3","418","424","10.1039/b311046j","","","0.71073","MoKα","","0.0479","0.0407","","","0.1031","0.1078","","","","","","1.051","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050220","11.277","0.0016","9.1335","0.001","13.561","0.002","90","","101.044","0.017","90","","1370.9","0.3","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Hexa-2-thienylcyclotrphosphazene","","- C24 H18 N3 P3 S6 -","- C24 H18 N3 P3 S6 -","- C48 H36 N6 P6 S12 -","2","1","","Virginie Vicente; Alain Fruchier; Marc Taillefer; Corinne Combes-Chamalet; Ian J. Scowen; Françoise Plénat; Henri-Jean Cristau","Synthesis and structural studies (1H, 13C, 31P NMR and X-ray) of new C-bonded cyclotriphosphazenes with heterocyclic substituents from novel phosphinic acid derivatives","New J. Chem.","2004","28","3","418","424","10.1039/b311046j","","","0.71073","MoKα","","0.0284","0.0268","","","0.0712","0.0722","","","","","","1.045","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050221","19.42","0.002","15.7094","0.0016","20.428","0.004","90","","96.673","0.007","90","","6189.9","1.5","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C25 H13 Cl3 N3 P3 S6 -","- C25 H13 Cl3 N3 P3 S6 -","- C200 H104 Cl24 N24 P24 S48 -","8","1","","Virginie Vicente; Alain Fruchier; Marc Taillefer; Corinne Combes-Chamalet; Ian J. Scowen; Françoise Plénat; Henri-Jean Cristau","Synthesis and structural studies (1H, 13C, 31P NMR and X-ray) of new C-bonded cyclotriphosphazenes with heterocyclic substituents from novel phosphinic acid derivatives","New J. Chem.","2004","28","3","418","424","10.1039/b311046j","","","0.71073","MoKα","","0.122","0.0593","","","0.1099","0.1338","","","","","","0.994","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050222","12.487","0.004","17.799","0.005","20.803","0.006","113.601","0.004","91.155","0.005","91.297","0.005","4234","2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Yb[6]PyNO","","","- C67 H95 N5 O49 S6 Yb2 -","- C67 H55 N5 O49 S6 Yb2 -","- C134 H110 N10 O98 S12 Yb4 -","2","1","","Atwood, Jerry L.; Dalgarno, Scott J.; Hardie, Michaele J.; Raston, Colin L.","Hydrogen-bonded arrays of a ytterbium(iii) p-sulfonatocalix[6]arene complex","New Journal of Chemistry","2004","28","2","326","","10.1039/b311288h","","","0.71073","MoKα","","0.0659","0.044","","","0.0999","0.1089","","","","","","1.028","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050223","10.7371","0.0017","14.083","0.003","17.183","0.003","90","","90","","90","","2598.3","0.8","293","2","293","2","","","","","","","","8","P c c n","-P 2ab 2ac","56","","","","- C20 H20 Cl4 F6 Fe N4 O2 P -","- C20 H18 Cl4 F6 Fe N4 O2 P -","- C80 H72 Cl16 F24 Fe4 N16 O8 P4 -","4","0.5","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.2513","0.0816","","","0.1574","0.2337","","","","","","0.933","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050224","10.4143","0.0019","13.959","0.003","16.933","0.005","90","","90","","90","","2461.6","1","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C20 H20 Cl5 Fe N4 O6 -","- C20 H20 Cl5 Fe N4 O6 -","- C80 H80 Cl20 Fe4 N16 O24 -","4","0.5","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.0737","0.0458","","","0.113","0.1248","","","","","","1.018","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050225","11.837","0.004","17.134","0.005","13.764","0.005","90","","113.08","0.02","90","","2568.1","1.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 F6 Fe N4 O4.5 P -","- C22 F6 Fe N4 O4.5 P -","- C88 F24 Fe4 N16 O18 P4 -","4","1","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.2157","0.0954","","","0.2205","0.2952","","","","","","0.995","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050226","12.934","0.0004","16.76","0.0005","24.609","0.0009","89.859","0.0015","89.597","0.0017","83.111","0.0017","5295.9","0.3","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H42 Mn N5 O13 S -","- C52 H36.5 Mn N4.5 O11.5 S0.5 -","- C208 H146 Mn4 N18 O46 S2 -","4","2","","Shmilovits, Michaela; Vinodu, Mikki; Goldberg, Israel","Self-assembly patterns of porphyrins in crystals. Structures of hydrogen-bonding and coordination polymers of manganese tetra(carboxyphenyl)porphyrin","New Journal of Chemistry","2004","28","2","223","","10.1039/b312183f","","","0.71073","MoKα","","0.1329","0.0691","","","0.1652","0.1864","","","","","","1.045","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050227","13.691","0.0005","8.744","0.0003","20.593","0.0006","90","","91.695","0.002","90","","2464.19","0.14","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H39.1 Mn N5 O11.55 -","- C48 H24 Mn N4 O10.55 -","- C96 H48 Mn2 N8 O21.1 -","2","0.5","","Shmilovits, Michaela; Vinodu, Mikki; Goldberg, Israel","Self-assembly patterns of porphyrins in crystals. Structures of hydrogen-bonding and coordination polymers of manganese tetra(carboxyphenyl)porphyrin","New Journal of Chemistry","2004","28","2","223","","10.1039/b312183f","","","0.71073","MoKα","","0.0796","0.0621","","","0.1773","0.1909","","","","","","1.046","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050228","7.893","0.002","7.901","0.002","15.805","0.005","85.564","0.005","84.968","0.005","62.449","0.005","869.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 N2 O2 Se2 -","- C18 H16 N2 O2 Se2 -","- C36 H32 N4 O4 Se4 -","2","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.0904","0.0708","","","0.1774","0.187","","","","","","0.973","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050229","7.7728","0.0007","7.7691","0.0006","15.5568","0.0013","85.376","0.005","85.84","0.007","63.251","0.007","835.48","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 N2 O2 S2 -","- C18 H16 N2 O2 S2 -","- C36 H32 N4 O4 S4 -","2","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","1.54178","CuKα","","0.0323","0.0318","","","0.0825","0.0827","","","","","","1.18","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050230","5.6512","0.001","7.9702","0.0014","30.441","0.005","90","","90","","90","","1371.1","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N O S -","- C16 H15 N O S -","- C64 H60 N4 O4 S4 -","4","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.0314","0.0306","","","0.0807","0.0819","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050231","7.3118","0.0006","15.2642","0.0012","17.2559","0.0014","90","","90","","90","","1925.9","0.3","93","2","93","2","","","","","","","","6","P b n a","-P 2ac 2b","60","","","","- C9 H8 Br N O Se -","- C9 H8 Br N O Se -","- C72 H64 Br8 N8 O8 Se8 -","8","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.0605","0.0282","","","0.0515","0.0592","","","","","","0.967","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050232","15.416","0.003","17.917","0.003","7.8119","0.0012","90","","102.816","0.004","90","","2104","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 I N O Se -","- C9 H8 I N O Se -","- C72 H64 I8 N8 O8 Se8 -","8","2","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazoline","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.1363","0.0342","","","0.037","0.0456","","","","","","0.783","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050233","12.0601","0.0008","13.733","0.001","20.595","0.002","105.244","0.006","91.599","0.007","108.298","0.006","3101.8","0.5","173","","173","","","","","","","","Synthetic","4","P -1","-P 1","2","lid-shaped heptatitanate","(μ2-1,3-propanediolato(O,O'))-bis(μ4-oxo)-bis(μ3-oxo)-octakis(μ2-ethoxo)-decakis(ethoxy)-hepta-titanium","","- C39 H96 O24 Ti7 -","- C39 H96 O24 Ti7 -","- C78 H192 O48 Ti14 -","2","1","","Frédérique Biechel; Julien Dubuc; Marc Henry","General principles driving the chemical reactivity of titanium(IV) alkoxides","New J. Chem.","2004","28","6","764","769","10.1039/b312486j","","","0.71073","Mo-Kα","","0.148","0.051","","0.171","0.074","","","","3.45","1.39","1.39","","","","","has coordinates","194606","2020-10-21","18:00:00",""
"7050234","9.5168","0.0003","13.4861","0.0007","17.8842","0.0009","99.008","0.009","90.923","0.009","105.676","0.009","2178.6","0.2","173","","173","","","","","","","","Synthetic","4","P -1","-P 1","2","tentacular tetratitanate","(μ4-2,2-bis(hydroxymethyl)-1,3-propanediolato(O,O',O'',O'''))-tetrakis(μ2-ethoxo)-octakis(ethoxy)-tetra-titanium","","- C29 H68 O16 Ti4 -","- C29 H68 O16 Ti4 -","- C58 H136 O32 Ti8 -","2","1","","Frédérique Biechel; Julien Dubuc; Marc Henry","General principles driving the chemical reactivity of titanium(IV) alkoxides","New J. Chem.","2004","28","6","764","769","10.1039/b312486j","","","0.71073","Mo-Kα","","0.103","0.053","","0.119","","0.08","","","2.265","","","1.518","","","","has coordinates","194606","2020-10-21","18:00:00",""
"7050235","11.17","0.004","11.937","0.004","16.536","0.005","74.2","0.03","80.21","0.04","62.56","0.02","1880.3","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H39 Cl N3 O10 Re -","- C33 H39 Cl N3 O10 Re -","- C66 H78 Cl2 N6 O20 Re2 -","2","1","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0472","0.0371","","","0.0716","0.0743","","","","","","0.975","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050236","12.1864","0.0013","13.9338","0.0015","14.076","0.002","61.504","0.012","85.83","0.008","79.965","0.009","2068.3","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H15 Cl N3 O3 Re -","- C23 H15 Cl N3 O3 Re -","- C92 H60 Cl4 N12 O12 Re4 -","4","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0322","0.0259","","","0.0542","0.0561","","","","","","1.042","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050237","10.975","0.002","13.661","0.002","14.578","0.003","107.544","0.015","111.036","0.013","102.713","0.017","1808","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H12 Cl N4 O3 Re -","- C18 H12 Cl N4 O3 Re -","- C72 H48 Cl4 N16 O12 Re4 -","4","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.046","0.0322","","","0.0607","0.065","","","","","","0.999","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050238","11.125","0.004","14.259","0.004","14.454","0.006","98.149","0.015","111.39","0.02","112.669","0.015","1860.6","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H12 Cl N4 O3 Re -","- C18 H12 Cl N4 O3 Re -","- C72 H48 Cl4 N16 O12 Re4 -","4","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0702","0.0481","","","0.1067","0.1146","","","","","","0.951","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050239","9.1998","0.0015","21.486","0.004","21.451","0.004","90","","93.7","0.004","90","","4231.3","1.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 Cl N4 O3 Re -","- C21 H18 Cl N4 O3 Re -","- C168 H144 Cl8 N32 O24 Re8 -","8","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0443","0.0274","","","0.0494","0.0534","","","","","","1.016","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050240","10.1741","0.0008","10.6139","0.0009","11.3542","0.0009","97.425","0.001","90.136","0.001","110.437","0.001","1137.81","0.16","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H28 N2 -","- C32 H28 N2 -","- C64 H56 N4 -","2","1","","Mateo Alajarín; Angel Vidal; María-Mar Ortín; Delia Bautista","Persistent radical effect in the intramolecular addition of benzylic radicals onto ketenimines: selective cross-coupling of α-(indol-2-yl)benzyl radicals with the 1-cyano-1-methylethyl radical","New J. Chem.","2004","28","5","570","577","10.1039/b312930f","","","0.71073","MoKα","","0.0442","0.0402","","","0.1033","0.1065","","","","","","1.021","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050241","7.646","0.001","21.303","0.002","12.505","0.001","90","","104.87","0.01","90","","1968.6","0.4","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 N2 -","- C26 H24 N2 -","- C104 H96 N8 -","4","1","","Mateo Alajarín; Angel Vidal; María-Mar Ortín; Delia Bautista","Persistent radical effect in the intramolecular addition of benzylic radicals onto ketenimines: selective cross-coupling of α-(indol-2-yl)benzyl radicals with the 1-cyano-1-methylethyl radical","New J. Chem.","2004","28","5","570","577","10.1039/b312930f","","","0.71073","MoKα","","0.0748","0.04","","0.0882","0.0804","","","","0.858","1.01","1.01","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050242","18.3759","0.0004","25.4454","0.0008","8.74","0.0002","90","","97.257","0.002","90","","4053.93","0.18","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,7-bis-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-fluoren-9-one pyridine solvate","","- C53 H38 N2 O3 -","- C53 H38 N2 O3 -","- C212 H152 N8 O12 -","4","1","","Scott, Janet L.; Yamada, Tomohiko; Tanaka, Koichi","Guest specific solid-state fluorescence rationalised by reference to solid-state structures and specific intermolecular interactions","New Journal of Chemistry","2004","28","4","447","","10.1039/b312931d","","","0.71073","MoKα","","0.1746","0.0687","","","0.1377","0.1723","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050243","16.9301","0.0004","8.5045","0.0002","25.5885","0.0006","90","","92.569","0.001","90","","3680.58","0.15","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,7-bis-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-fluoren-9-one 3-acetylpyridine solvate","","- C50 H35 N O4 -","- C50 H35 N O4 -","- C200 H140 N4 O16 -","4","1","","Scott, Janet L.; Yamada, Tomohiko; Tanaka, Koichi","Guest specific solid-state fluorescence rationalised by reference to solid-state structures and specific intermolecular interactions","New Journal of Chemistry","2004","28","4","447","","10.1039/b312931d","","","0.71073","MoKα","","0.1821","0.0606","","","0.0974","0.1266","","","","","","0.962","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050244","9.7909","0.0015","13.64","0.002","15.018","0.002","94.261","0.003","92.364","0.003","97.445","0.003","1980.5","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","JXH-II-076","","","- C21 H26 Fe I N -","- C21 H26 Fe I N -","- C84 H104 Fe4 I4 N4 -","4","2","","G. Gokel; Leonard J. Barbour; Jiaxin Hu","Ferrocene Derivatives as Receptors to Explore Ammonium Cation-pi Interactions","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1629","0.1182","","","0.2179","0.233","","","","","","1.279","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7050245","31.69","0.005","5.9141","0.0009","19.117","0.003","90","","110.715","0.003","90","","3351.2","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","JXH-II-076","","","- C40 H48 Fe2 N2 O -","- C40 H48 Fe2 N2 O -","- C160 H192 Fe8 N8 O4 -","4","0.5","","G. Gokel; Leonard J. Barbour; Jiaxin Hu","Ferrocene Derivatives as Receptors to Explore Ammonium Cation-pi Interactions","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0734","0.0433","","","0.0861","0.0972","","","","","","0.997","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050246","9.3614","0.0012","9.8737","0.0012","24.449","0.004","90","","90.81","0.03","90","","2259.6","0.5","150","","150","","","","","","","","see text","7","P 1 21 1","P 2yb","4","","","","- C38 H60 Cl2 N8 O8 Ru S2 -","- C38 H60 Cl2 N8 O8 Ru S2 -","- C76 H120 Cl4 N16 O16 Ru2 S4 -","2","1","","Hotze, Anna C. G.; Kooijman, Huub; Spek, Anthony L.; Haasnoot, Jaap G.; Reedijk, Jan","Synthesis and characterization of ruthenium(ii) complexes with the new ligand 2-phenylazopyridine-5-sulfonic acid (Hsazpy): in search for new anticancer agents","New Journal of Chemistry","2004","28","5","565","","10.1039/b313746e","","x-ray","0.71073","MoKα","","0.0706","0.0577","","","0.1253","0.1348","","","","","","1.057","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050247","8.043","0.0003","11.427","0.0004","10.502","0.0005","90","","108.089","0.0017","90","","917.51","0.06","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","amidinium (2-hydroxyethoxy)acetate","","- C6 H14 N2 O4 -","- C6 H14 N2 O4 -","- C24 H56 N8 O16 -","4","1","","Ferretti, Valeria; Bertolasi, Valerio; Pretto, Loretta","Supramolecular aggregation by means of charge-assisted hydrogen bonds in acid-base adducts containing amidinium cations","New Journal of Chemistry","2004","28","5","646","","10.1039/b314143h","","","0.7107","MoKα","","0.0885","0.0476","","","0.1077","0.1388","","","","","","1.123","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050248","10.429","0.0004","7.727","0.0003","11.884","0.0006","90","","101.789","0.0014","90","","937.47","0.07","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","amidinium (2-hydroxyethoxy)acetate","","- C6 H14 N2 O4 -","- C6 H14 N2 O4 -","- C24 H56 N8 O16 -","4","1","","Ferretti, Valeria; Bertolasi, Valerio; Pretto, Loretta","Supramolecular aggregation by means of charge-assisted hydrogen bonds in acid-base adducts containing amidinium cations","New Journal of Chemistry","2004","28","5","646","","10.1039/b314143h","","","0.7107","MoKα","","0.0924","0.0465","","","0.1042","0.1343","","","","","","1.084","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050249","10.0507","0.0004","9.2132","0.0005","7.7953","0.0006","90","","90","","90","","721.84","0.07","293","","293","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Amidinium acetate","","- C4 H10 N2 O2 -","- C4 H10 N2 O2 -","- C16 H40 N8 O8 -","4","0.5","","Ferretti, Valeria; Bertolasi, Valerio; Pretto, Loretta","Supramolecular aggregation by means of charge-assisted hydrogen bonds in acid-base adducts containing amidinium cations","New Journal of Chemistry","2004","28","5","646","","10.1039/b314143h","","","0.7107","MoKα","","0.0745","0.0516","","","0.1486","0.171","","","","","","1.02","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050250","9.9117","0.0002","14.1651","0.0003","18.1568","0.0005","90","","90","","90","","2549.22","0.1","203","2","203","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2,3-bis-fluoren-9-ylidene-succinic acid acetone solvate (1:1)","2,3-bis-fluoren-9-ylidene-succinic acid acetone solvate (1:1)","","- C33 H24 O5 -","- C33 H24 O5 -","- C132 H96 O20 -","4","1","","Tanaka, Koichi; Iwamoto, Toshimasa; Caira, Mino R.","Conglomerate and racemate formation of 2,3-bisfluoren-9-ylidenesuccinic acid by inclusion complexation with achiral guest molecules","New Journal of Chemistry","2004","28","3","329","","10.1039/b314192f","","","0.71073","MoKα","","0.0944","0.0545","","","0.122","0.1392","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050251","15.8893","0.0003","9.7361","0.0002","13.328","0.0002","90","","90","","90","","2061.84","0.07","203","2","203","2","","","","","","","","3","P b c n","-P 2n 2ab","60","2,3-bis-fluoren-9-ylidene-succinic acid","2,3-bis-fluoren-9-ylidene-succinic acid","","- C30 H18 O4 -","- C30 H18 O4 -","- C120 H72 O16 -","4","0.5","","Tanaka, Koichi; Iwamoto, Toshimasa; Caira, Mino R.","Conglomerate and racemate formation of 2,3-bisfluoren-9-ylidenesuccinic acid by inclusion complexation with achiral guest molecules","New Journal of Chemistry","2004","28","3","329","","10.1039/b314192f","","","0.71073","MoKα","","0.0518","0.0376","","","0.089","0.0949","","","","","","1.043","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050252","12.173","0.0001","12.3379","0.0002","17.7792","0.0002","90","","94.282","0.001","90","","2662.79","0.06","203","2","203","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,3-bis-fluoren-9-ylidene-succinic acid ethyl acetate solvate (1:1)","2,3-bis-fluoren-9-ylidene-succinic acid ethyl acetate solvate (1:1)","","- C34 H26 O6 -","- C34 H26 O6 -","- C136 H104 O24 -","4","1","","Tanaka, Koichi; Iwamoto, Toshimasa; Caira, Mino R.","Conglomerate and racemate formation of 2,3-bisfluoren-9-ylidenesuccinic acid by inclusion complexation with achiral guest molecules","New Journal of Chemistry","2004","28","3","329","","10.1039/b314192f","","","0.71073","MoKα","","0.06","0.039","","","0.0897","0.0978","","","","","","1.037","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050253","33.77","0.04","8.9","0.014","21.83","0.03","90","","128.805","0.01","90","","5113","12","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 La N6 O14.5 -","- C19 H11 La N6 O14.5 -","- C152 H88 La8 N48 O116 -","8","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.1242","0.0784","","","0.2119","0.2361","","","","","","1.069","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050254","9.094","0.013","9.561","0.013","15.038","0.017","98.736","0.01","100.343","0.01","93.335","0.01","1266","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 N7 Nd O11 -","- C21 H14 N7 Nd O11 -","- C42 H28 N14 Nd2 O22 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.1796","0.0851","","","0.2113","0.2579","","","","","","0.977","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050255","8.769","0.012","9.483","0.012","15.525","0.017","99.735","0.01","98.239","0.01","93.805","0.01","1254","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 N7 O11 Pr -","- C21 H14 N7 O11 Pr -","- C42 H28 N14 O22 Pr2 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.0531","0.0458","","","0.1487","0.1644","","","","","","0.961","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050256","8.618","0.009","9.458","0.012","15.445","0.017","100.457","0.01","97.727","0.01","94.181","0.01","1221","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 Er N7 O11 -","- C21 H14 Er N7 O11 -","- C42 H28 Er2 N14 O22 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.0577","0.0454","","","0.1281","0.1392","","","","","","0.966","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050257","10.533","0.014","10.68","0.014","17.12","0.02","86.069","0.01","79.225","0.01","82.233","0.01","1873","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H24 Eu N9 O13 -","- C39 H22 Eu N9 O13 -","- C78 H44 Eu2 N18 O26 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.1679","0.1076","","","0.3053","0.3331","","","","","","1.086","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050258","10.527","0.014","10.643","0.014","17.09","0.02","86.191","0.01","79.141","0.01","82.187","0.01","1861","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H24 Gd N9 O13 -","- C39 H22 Gd N9 O13 -","- C78 H44 Gd2 N18 O26 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.0972","0.0706","","","0.1961","0.2218","","","","","","0.94","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050259","7.536","0.002","12.597","0.003","14.629","0.004","90","","99.77","0.02","90","","1368.6","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Cu(Medpt)(N3)](ClO4)","","","- C7 H19 Cl Cu N6 O4 -","- C7 H19 Cl Cu N6 O4 -","- C28 H76 Cl4 Cu4 N24 O16 -","4","1","","Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente","Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour","New J. Chem.","2004","28","6","681","686","10.1039/b314526c","","","0.71069","MoKα","","0.0508","0.0387","","0.1014","0.0916","","","","1.08","1.099","1.099","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050260","8.524","0.006","8.78","0.004","11.32","0.006","71.79","0.05","68.88","0.06","63.2","0.05","693.9","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H30 Cl2 Cu2 N12 O8 -","- C10 H30 Cl2 Cu2 N12 O8 -","- C10 H30 Cl2 Cu2 N12 O8 -","1","0.5","","Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente","Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour","New J. Chem.","2004","28","6","681","686","10.1039/b314526c","","","0.71069","MoKα","","0.0788","0.0654","","0.1907","0.1587","","","","1.076","1.089","1.089","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050261","23.638","0.002","11.011","0.002","13.924","0.002","90","","104.65","0.02","90","","3506.3","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H50 Cl2 Cu2 N12 O8 -","- C20 H50 Cl2 Cu2 N12 O8 -","- C80 H200 Cl8 Cu8 N48 O32 -","4","0.5","","Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente","Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour","New J. Chem.","2004","28","6","681","686","10.1039/b314526c","","","0.71069","MoKα","","0.0587","0.0455","","0.2011","0.1186","","","","0.915","0.912","0.912","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050262","9.875","0.002","17.863","0.004","13.393","0.003","90","","106.64","0.03","90","","2263.4","0.8","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","C24 H16 Cl4 Cu2 N4","","","- C24 H16 Cl4 Cu2 N4 O0 -","- C24 H16 Cl4 Cu2 N4 -","- C96 H64 Cl16 Cu8 N16 -","4","1","","Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang","Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0344","0.0261","","","0.0457","0.047","","","","","","0.92","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050263","7.6507","0.0015","9.0871","0.0018","9.1094","0.0018","96.74","0.03","104.05","0.03","109.21","0.03","566.55","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 Cu I N2 -","- C12 H8 Cu I N2 -","- C24 H16 Cu2 I2 N4 -","2","1","","Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang","Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0381","0.0333","","","0.0918","0.0939","","","","","","1.035","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050264","19.627","0.005","14.827","0.003","15.196","0.004","90","","103.057","0.018","90","","4308.1","1.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H16 Cl2 Cu2 N4 -","- C24 H16 Cl2 Cu2 N4 -","- C192 H128 Cl16 Cu16 N32 -","8","1","","Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang","Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0768","0.036","","","0.08","0.089","","","","","","0.85","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050265","9.945","0.002","6.5064","0.0013","18.222","0.004","90","","91.23","0.03","90","","1178.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H8 Br2 Cu I0 N2 -","- C12 H8 Br2 Cu N2 -","- C48 H32 Br8 Cu4 N8 -","4","1","","Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang","Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0479","0.0285","","","0.06","0.0642","","","","","","0.97","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050266","10.04","0.002","14.516","0.003","16.319","0.003","90","","94.29","0.03","90","","2371.7","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 Br1.5 Cu1.5 N2 -","- C12 H8 Br1.5 Cu1.5 N2 -","- C96 H64 Br12 Cu12 N16 -","8","1","","Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang","Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.076","0.039","","","0.0772","0.0887","","","","","","0.914","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050267","10.0495","0.0008","15.0351","0.0012","16.8237","0.0012","90","","94.105","0.002","90","","2535.5","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 Cu1.5 I1.5 N2 -","- C12 H8 Cu1.5 I1.5 N2 -","- C96 H64 Cu12 I12 N16 -","8","1","","Xu Ji-Qing; Hai-Ying Bie; Jing Lu; Jie-Hui Yu; Xiao Zhang","Syntheses, Characterization and Optical Properties of Some Copper(I) Halides with 1,10-Phenanthroline Ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0571","0.0386","","","0.0804","0.0859","","","","","","0.965","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050268","14.6951","0.0012","14.6951","0.0012","12.813","0.002","90","","90","","120","","2396.2","0.5","120","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","catena-(octakis(μ ~3~-hydroxo)-tris((μ ~2~-oxalato-O,O') -(piperazine-N,N'))-hepta-nickel)","","- C18 H38 N6 Ni7 O20 -","- C18 H38 N6 Ni7 O20 -","- C54 H114 N18 Ni21 O60 -","3","0.166667","","Keene, Tony D.; Hursthouse, Michael B.; Price, Daniel J.","Ferromagnetic coupling in a heptanuclear nickel cluster with a vertex-shared dicubane structure","New Journal of Chemistry","2004","28","5","558","","10.1039/b315323a","","","0.71073","MoKα","","0.1032","0.0575","","","0.1164","0.1318","","","","","","1.033","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050269","7.4613","0.0003","8.9753","0.0004","17.5018","0.0009","90","","90","","90","","1172.05","0.09","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.03","0.0274","","","0.0781","0.0807","","","","","","1.085","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050270","7.4667","0.0003","8.9827","0.0003","17.5438","0.0006","90","","90","","90","","1176.68","0.07","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0306","0.0277","","","0.0797","0.0829","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050271","23.052","0.007","8.9826","0.0008","12.684","0.003","90","","107.504","0.012","90","","2504.8","1","298","2","298","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C30 H26 Mn N2 O4 -","- C30 H26 Mn N2 O4 -","- C120 H104 Mn4 N8 O16 -","4","1","","Pradeep, Chullikkattil P.; Htwe, Tin; Zacharias, Panthapally S.; Das, Samar K.","First structurally characterized optically active mononuclear Mn(iv) complex: synthesis, crystal structure and properties of [MnivL2] {H2L?=?S-(?)-2-[(2-hydroxy-1-phenylethylimino)methyl]phenol}Electronic supplementary information (ESI) available: GC analysis of the styrene epoxidation; 1H NMR spectrum of (E)-stilbene oxide produced by the epoxidation of (E)-stilbene. See http://www.rsc.org/suppdata/nj/b3/b315658c/","New Journal of Chemistry","2004","28","6","735","","10.1039/b315658c","","","0.71073","MoKα","","0.0253","0.0236","","","0.0622","0.0633","","","","","","1.073","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050272","27.863","0.0005","11.4857","0.0002","7.5182","0.0001","90","","93.915","0.001","90","","2400.41","0.07","200","2","200","2","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N8 O5 -","- C24 H26 N8 O5 -","- C96 H104 N32 O20 -","4","1","","Carmen Alvarez-Rua; Santiago García-Granda; Shyamaprosad Goswami; Reshmi Mukherjee; Swapan Dey; Rosa M. Claramunt; M. Dolores Santa María; Isabel Rozas; Nadine Jagerovic; Ibon Alkorta; José Elguero","Multiple hydrogen bonds and tautomerism in naphthyridine derivatives","New J. Chem.","2004","28","6","700","707","10.1039/b315692c","","","1.5418","CuKα","","0.0697","0.0461","","","0.1221","0.1647","","","","","","0.962","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050273","19.001","0.003","25.829","0.008","7.844","0.002","90","","90","","90","","3849.7","1.7","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C10 H10 N4 O -","- C10 H10 N4 O -","- C160 H160 N64 O16 -","16","1","","Carmen Alvarez-Rua; Santiago García-Granda; Shyamaprosad Goswami; Reshmi Mukherjee; Swapan Dey; Rosa M. Claramunt; M. Dolores Santa María; Isabel Rozas; Nadine Jagerovic; Ibon Alkorta; José Elguero","Multiple hydrogen bonds and tautomerism in naphthyridine derivatives","New J. Chem.","2004","28","6","700","707","10.1039/b315692c","","","1.5418","CuKα","","0.085","0.0482","","","0.0994","0.1184","","","","","","0.95","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050274","19.5212","0.0013","13.7568","0.0011","26.832","0.002","90","","111.705","0.003","90","","6694.8","0.9","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(Cd(IIMB)2(H2O)(SO4))-7.5H2O","[Cd(IIMB)2(H2O)(SO4)]-7.5H2O","","- C26 H41 Cd N8 O12.5 S -","- C26 H32 Cd N8 O12.5 S -","- C208 H256 Cd8 N64 O100 S8 -","8","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu","Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.1038","0.0616","","","0.1457","0.1577","","","","","","1.022","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050275","8.898","0.0005","12.7568","0.0005","14.3176","0.0003","63.556","0.002","80.625","0.002","70.607","0.002","1372.37","0.1","200","","200","","","","","","","","","6","P -1","-P 1","2","(Cd(IIMB)2Cl2)-H2O","[Cd(IIMB)2Cl2]-H2O","","- C26 H26 Cd Cl2 N8 O -","- C26 H26 Cd Cl2 N8 O -","- C52 H52 Cd2 Cl4 N16 O2 -","2","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu","Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.0941","0.0424","","","0.063","0.0715","","","","","","0.908","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050276","29.0122","0.0009","12.1985","0.0004","16.5499","0.0006","90","","104.885","0.0008","90","","5660.6","0.3","200","","200","","","","","","","","","5","C 1 c 1","C -2yc","9","(Cd(IIMB)4(H2O)2)(NO3)2-5(H2O)","[Cd(IIMB)4(H2O)2](NO3)2-5(H2O)","","- C52 H62 Cd N18 O13 -","- C52 H48 Cd N18 O13 -","- C208 H192 Cd4 N72 O52 -","4","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu","Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.0852","0.0487","","","0.1124","0.1206","","","","","","0.855","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050277","8.828","0.0004","9.2669","0.0003","23.8138","0.0009","90","","91.6407","0.0013","90","","1947.37","0.13","200","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(Cd(IIMB)(OAc)2)-H2O","{Cd(IIMB)(OAc)2]-H2O","","- C17 H20 Cd N4 O5 -","- C17 H20 Cd N4 O5 -","- C68 H80 Cd4 N16 O20 -","4","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu","Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.0691","0.036","","","0.0605","0.0657","","","","","","0.951","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050278","19.26","0.02","14.45","0.02","26.8","0.06","90","","111.39","0.11","90","","6944","20","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(Mn(IIMB)2(OSO3)(H2O))-8.2(H2O)","[Mn(IIMB)2(OSO3)(H2O)]-8.2(H2O)","","- C26 H42.43 Mn N8 O13.22 S -","- C26 H30 Mn N8 O13.215 S -","- C208 H240 Mn8 N64 O105.72 S8 -","8","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu","Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71075","MoKα","","0.0949","0.058","","","0.1605","0.1735","","","","","","0.933","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050279","28.14","0.03","12.158","0.011","16.671","0.014","90","","103.24","0.08","90","","5553","9","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","(Mn(IIMB)4(OH2)2)Cl2-5(H2O)","[Mn(IIMB)4(OH2)2]Cl2-5(H2O)","","- C52 H62 Cl2 Mn N16 O7 -","- C52 H52 Cl2 Mn N16 O7 -","- C208 H208 Cl8 Mn4 N64 O28 -","4","0.5","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu","Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71075","MoKα","","0.1081","0.0607","","","0.1571","0.1765","","","","","","0.904","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050280","14.8166","0.0003","18.2768","0.0004","24.8929","0.0006","69.9171","0.0005","75.1473","0.0007","88.2844","0.0009","6107.1","0.2","200","","200","","","","","","","","","5","P -1","-P 1","2","(Zn(IIMB)2)4(NO3)8-13.5(H2O)","[Zn(IIMB)2]4(NO3)8-13.5(H2O)","","- C104 H123 N40 O37.5 Zn4 -","- C20 H17 N40 O37.466 Zn4 -","- C40 H34 N80 O74.932 Zn8 -","2","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao; Hui-Fang Zhu","Syntheses and Crystal Structures of 1D Tabular Chain and 2D Polycatenane Built from Asymmetric 1-(1-Imidazolyl)-4-(imidazol-1-ylmethyl)benzene Ligand with Metal Salts","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.1777","0.1005","","","0.2823","0.3211","","","","","","1.054","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050281","20.548","0.003","7.194","0.001","24.526","0.005","90","","102.707","0.005","90","","3536.7","1","170","2","170","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","2,4-Diamino-6-phenyl-1,3,5-triazine","2,4-Diamino-6-phenyl-1,3,5-triazine","","- C9 H9 N5 -","- C9 H9 N5 -","- C144 H144 N80 -","16","2","","Antonio de la Hoz; Maria del Carmen Mateo; Angel Diaz-Ortiz; Jose Elguero; Concepcion Foces-Foces; A.Moreno; Ana Sanchez-Migallon; Gema Valiente","Green synthesis and self-association of 2,4-diamino-1,3,5-triazine derivatives","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.1916","0.0962","","","0.1789","0.2188","","","","","","1.086","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050282","12.1135","0.0011","12.4648","0.0009","16.1423","0.0013","90","","97.286","0.009","90","","2417.7","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,4-diamino-6-(1-phenylpyrazol-3-yl)-1,3,5-triazine","2,4-diamino-6-(1-phenylpyrazol-3-yl)-1,3,5-triazine","","- C12 H11 N7 -","- C12 H11 N7 -","- C96 H88 N56 -","8","2","","Antonio de la Hoz; Maria del Carmen Mateo; Angel Diaz-Ortiz; Jose Elguero; Concepcion Foces-Foces; A.Moreno; Ana Sanchez-Migallon; Gema Valiente","Green synthesis and self-association of 2,4-diamino-1,3,5-triazine derivatives","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","0.0901","0.0624","","","0.2077","0.2527","","","","","","1.009","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050283","12.3025","0.0013","12.0425","0.0012","19.841","0.003","90","","90","","90","","2939.4","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2,4-diamino-6-piperidino-1,3,5-triazine","2,4-diamino-6-piperidino-1,3,5-triazine","","- C8 H14 N6 -","- C8 H14 N6 -","- C96 H168 N72 -","12","3","","Antonio de la Hoz; Maria del Carmen Mateo; Angel Diaz-Ortiz; Jose Elguero; Concepcion Foces-Foces; A.Moreno; Ana Sanchez-Migallon; Gema Valiente","Green synthesis and self-association of 2,4-diamino-1,3,5-triazine derivatives","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.068","0.0596","","","0.1591","0.1838","","","","","","1.006","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050284","38.6254","0.0007","12.3153","0.0002","21.5662","0.0005","90","","101.392","0.0007","90","","10056.6","0.3","173","","173","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H144 Cl8 O4 Si8 Sn8 -","- C60 H144 Cl8 O4 Si8 Sn8 -","- C240 H576 Cl32 O16 Si32 Sn32 -","4","0.5","","Jens Beckmann; Dainis Dakternieks; Andrew Duthie; Fong Sheen Kuan; Klaus Jurkschat; Markus Schürman; Edward R. T. Tiekink","Synthesis and structures of new oligomethylene-bridged double ladders. How far can the layers be separated?","New J.Chem.(Nouv.J.Chim.)","2004","28","","1268","1276","10.1039/b316009b","","","0.71073","MoKα","","0.128","0.046","","","0.051","0.063","","","","","","0.88","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050285","13.169","0.002","22.458","0.006","11.489","0.001","94.79","0.01","98.67","0.009","76.67","0.02","3264","1","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C94 H200 Cl8 O4 Si8 Sn8 -","- C94 H200 Cl8 O4 Si8 Sn8 -","- C94 H200 Cl8 O4 Si8 Sn8 -","1","0.5","","Dainis Dakternieks; Jens Beckmann; Andrew Duthie; Fong Sheen Kuan","Synthesis and Structures of New Alkylidene Double Ladders. How Far Can The Layers Be Separated?","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050286","18.3507","0.0019","24.823","0.002","12.2041","0.0009","90","","94.768","0.005","90","","5540","0.8","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H128 Cl8 O4 Si8 Sn8 -","- C52 H128 Cl8 O4 Si8 Sn8 -","- C104 H256 Cl16 O8 Si16 Sn16 -","2","0.5","","Dainis Dakternieks; Jens Beckmann; Andrew Duthie; Fong Sheen Kuan","Synthesis and Structures of New Alkylidene Double Ladders. How Far Can The Layers Be Separated?","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.244","0.074","","","0.187","0.215","","","","","","0.82","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050287","49.8011","0.0013","25.1497","0.0007","12.1328","0.0003","90","","100.687","0.0015","90","","14932.5","0.7","173","1","173","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C107 H208 Cl8 O4 Si8 Sn8 -","- C107 H208 Cl8 O4 Si8 Sn8 -","- C428 H832 Cl32 O16 Si32 Sn32 -","4","0.5","","Dainis Dakternieks; Jens Beckmann; Andrew Duthie; Fong Sheen Kuan","Synthesis and Structures of New Alkylidene Double Ladders. How Far Can The Layers Be Separated?","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050288","6.6533","0.001","8.881","0.002","9.771","0.002","82.31","0.02","74.07","0.02","86.98","0.02","550.09","0.19","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H14 F3 P S -","- C8 H14 F3 P S -","- C16 H28 F6 P2 S2 -","2","1","","Alan Brisdon; Nicholas A. Barnes; F.R.William, Brown; Wendy Cross; Ian R. Crossley; Cheryl Fish; James V. Morey; Robin G. Pritchard; Lakhdar Sekhri","The synthesis and chemistry of fluorovinyl-containing phosphines, and the single crystal X-ray structure of SPPri2(CF=CF2).","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0472","0.0323","","","0.0744","0.0815","","","","","","1.008","","","","has coordinates","277870","2022-09-15","11:09:05",""
"7050289","4.0185","0.0001","19.4997","0.0006","7.2382","0.0003","90","","92.118","0.005","90","","566.79","0.03","173","","173","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C9 H13 Cl Cu N2 O3 -","- C9 H13 Cl Cu N2 O3 -","- C18 H26 Cl2 Cu2 N4 O6 -","2","1","","N.Tounsi; L.Dupont; C.Cadiou; A.Mohamadou; R.Plantier-Royon; F.Massicot; C.Portella; M.Aplincourt","Complexes of amidic ligands derived from lactic acid: Equilibrium, synthesis and crystal structure of copper(II) complexes.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","Mo-Kα","","0.024","0.021","","0.04","","0.029","","","1.069","","","1.038","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7050290","4.0535","0.0001","19.3293","0.0007","7.3828","0.0002","90","","92.357","0.005","90","","577.96","0.03","173","","173","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C9 H13 Br Cu N2 O3 -","- C9 H10 Br Cu N2 O3 -","- C18 H20 Br2 Cu2 N4 O6 -","2","1","","N.Tounsi; L.Dupont; C.Cadiou; A.Mohamadou; R.Plantier-Royon; F.Massicot; C.Portella; M.Aplincourt","Complexes of amidic ligands derived from lactic acid: Equilibrium, synthesis and crystal structure of copper(II) complexes.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","Mo-Kα","","0.049","0.033","","0.067","","0.041","","","1.262","","","1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7050291","14.1746","0.0007","14.7287","0.0007","12.9914","0.0006","90","","107.527","0.002","90","","2586.3","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C52 H48 Br2 Cl4 N2 P2 S2 -","- C52 H48 Br2 Cl4 N2 P2 S2 -","- C104 H96 Br4 Cl8 N4 P4 S4 -","2","0.5","","Paul Kelly; Mark R Bailey; Mark R.J.Elsegood; Liam M.Gilby; Kathryn E.Holmes; Michael J.Papageorgiou; Sarah Pedron-Haba","Reactions of mono- and bis-N-bromosulfimides with thio-ether crowns, phosphines and selenides","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0333","0.0269","","","0.0746","0.0784","","","","","","1.026","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050292","9.984","0.002","28.483","0.006","13.85","0.003","90","","92.243","0.004","90","","3935.8","1.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C102 H84 B2 N2 P2 S2 -","- C102 H84 B2 N2 P2 S2 -","- C204 H168 B4 N4 P4 S4 -","2","0.5","","Paul Kelly; Mark R Bailey; Mark R.J.Elsegood; Liam M.Gilby; Kathryn E.Holmes; Michael J.Papageorgiou; Sarah Pedron-Haba","Reactions of mono- and bis-N-bromosulfimides with thio-ether crowns, phosphines and selenides","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1896","0.0854","","","0.1908","0.287","","","","","","1.081","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050293","9.4252","0.0005","14.7382","0.0008","18.3414","0.001","90","","95.367","0.002","90","","2536.6","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C56 H52 Br2 N2 O2 P2 S2 -","- C56 H52 Br2 N2 O2 P2 S2 -","- C112 H104 Br4 N4 O4 P4 S4 -","2","0.5","","Paul Kelly; Mark R Bailey; Mark R.J.Elsegood; Liam M.Gilby; Kathryn E.Holmes; Michael J.Papageorgiou; Sarah Pedron-Haba","Reactions of mono- and bis-N-bromosulfimides with thio-ether crowns, phosphines and selenides","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0836","0.0507","","","0.126","0.1455","","","","","","1.033","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050294","10.008","0.0017","10.0428","0.0017","20.281","0.003","103.872","0.003","96.43","0.003","95.884","0.003","1948.7","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H45 B N2 S4 -","- C44 H45 B N2 S4 -","- C88 H90 B2 N4 S8 -","2","1","","Paul Kelly; Mark R Bailey; Mark R.J.Elsegood; Liam M.Gilby; Kathryn E.Holmes; Michael J.Papageorgiou; Sarah Pedron-Haba","Reactions of mono- and bis-N-bromosulfimides with thio-ether crowns, phosphines and selenides","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0792","0.0452","","","0.0984","0.1119","","","","","","1.055","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050295","8.0966","0.0005","15.47","0.0009","16.7219","0.001","90","","97.16","0.002","90","","2078.2","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 Br N S Se -","- C24 H20 Br N S Se -","- C96 H80 Br4 N4 S4 Se4 -","4","1","","Paul Kelly; Mark R Bailey; Mark R.J.Elsegood; Liam M.Gilby; Kathryn E.Holmes; Michael J.Papageorgiou; Sarah Pedron-Haba","Reactions of mono- and bis-N-bromosulfimides with thio-ether crowns, phosphines and selenides","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0435","0.038","","","0.0857","0.0871","","","","","","1.302","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050296","11.439","0.0007","16.4905","0.001","19.0299","0.0011","90","","102.904","0.002","90","","3499","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C90 H74 B2 N2 S2 Se2 -","- C90 H74 B2 N2 S2 Se2 -","- C180 H148 B4 N4 S4 Se4 -","2","0.5","","Paul Kelly; Mark R Bailey; Mark R.J.Elsegood; Liam M.Gilby; Kathryn E.Holmes; Michael J.Papageorgiou; Sarah Pedron-Haba","Reactions of mono- and bis-N-bromosulfimides with thio-ether crowns, phosphines and selenides","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0712","0.0389","","","0.0949","0.1046","","","","","","1.018","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050297","19.693","0.009","8.996","0.005","20.591","0.008","90","","97.57","0.03","90","","3616","3","200","","200","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Cu(F3)2](ClO4)2-0.67(H2O)","","- C34 H33.35 Cl2 Cu N12 O8.67 -","- C34 H32 Cl2 Cu N12 O8.673 -","- C136 H128 Cl8 Cu4 N48 O34.692 -","4","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao","Syntheses, crystal structures and properties of copper(II) and cadmium(II) complexes containing novel tripodal ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71075","MoKα","","0.1579","0.056","","","0.0885","0.108","","","","","","0.744","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050298","8.86","0.006","10.518","0.007","12.331","0.008","81.71","0.05","76.18","0.05","82.76","0.05","1099.2","1.2","200","","200","","","","","","","","","5","P -1","-P 1","2","","[Cu(F3)2][Cu(OCOCH2COO)2]-6(H2O)","","- C40 H48 Cu2 N12 O14 -","- C40 H48 Cu2 N12 O14 -","- C40 H48 Cu2 N12 O14 -","1","0.5","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao","Syntheses, crystal structures and properties of copper(II) and cadmium(II) complexes containing novel tripodal ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71075","MoKα","","0.0625","0.0379","","","0.0766","0.0803","","","","","","0.881","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050299","12.301","0.013","12.992","0.017","13.221","0.014","70.85","0.09","66.48","0.08","78.79","0.08","1825","4","200","","200","","","","","","","","","5","P -1","-P 1","2","","[Cd(F3)2](NO3)2-H2O","","- C34 H34 Cd N14 O7 -","- C34 H32 Cd N14 O7 -","- C68 H64 Cd2 N28 O14 -","2","1","","Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao","Syntheses, crystal structures and properties of copper(II) and cadmium(II) complexes containing novel tripodal ligand","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71075","MoKα","","0.1558","0.0472","","","0.0659","0.0744","","","","","","0.663","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050300","10.5172","0.0005","13.5574","0.0006","14.6025","0.0007","117.086","0.001","95.729","0.001","103.286","0.001","1753.19","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H33 N6 O6 Ru -","- C39 H33 N6 O6 Ru -","- C78 H66 N12 O12 Ru2 -","2","1","","Das, Anindya; Peng, Shie-Ming; Lee, Gene-Hsiang; Bhattacharya, Samaresh","Synthesis, structure and electrochemical properties of a group of ruthenium(iii) complexes of N-(aryl)picolinamide","New Journal of Chemistry","2004","28","6","712","","10.1039/b317018g","","","0.71073","MoKα","","0.0368","0.0323","","","0.082","0.0844","","","","","","1.086","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050301","8.043","0.001","15.116","0.0012","8.934","0.0011","90","","96.65","0.012","90","","1078.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5-dimethylpyrazole 1:1 adduct with phenol","","- C11 H14 N2 O -","- C11 H14 N2 O -","- C44 H56 N8 O4 -","4","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0787","0.036","","","0.09","0.1033","","","","","","1","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050302","11.901","0.002","9.9022","0.0019","18.667","0.004","90","","90","","90","","2199.8","0.7","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,5-dimetylpyrazole 1:1 adduct with hydroquinone","","- C11 H14 N2 O2 -","- C11 H14 N2 O2 -","- C88 H112 N16 O16 -","8","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0444","0.0362","","","0.0912","0.096","","","","","","1.023","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050303","19.065","0.002","14.725","0.002","8.583","0.001","90","","114.8","0.02","90","","2187.3","0.6","223","2","223","2","","","","","","","","4","C 1 c 1","C -2yc","9","","3,3',5,5'-tetramethyl-4,4'-bipyrazole 1:2 adduct with phenol","","- C22 H26 N4 O2 -","- C22 H26 N4 O2 -","- C88 H104 N16 O8 -","4","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0481","0.0426","","","0.1196","0.1258","","","","","","1.036","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050304","7.3717","0.0007","14.1921","0.0014","16.4357","0.0016","98.782","0.002","94.46","0.002","103.055","0.002","1644.1","0.3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","3,3',5,5'-tetramethyl-4,4'-bipyrazole 1:1 adduct with hydroquinone","","- C16 H20 N4 O2 -","- C16 H20 N4 O2 -","- C64 H80 N16 O8 -","4","2","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0891","0.0512","","","0.1345","0.1514","","","","","","0.946","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050305","18.27","0.003","8.5281","0.0011","21.054","0.004","90","","90","","90","","3280.4","0.9","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,3',5,5'-Tetramethyl-4,4'-bipyrazolyl 1:1 complex with Resorcinol","","- C16 H20 N4 O2 -","- C16 H20 N4 O2 -","- C128 H160 N32 O16 -","8","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0724","0.0492","","","0.1277","0.1405","","","","","","1.086","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050306","29.564","0.003","46.197","0.006","8.5541","0.001","90","","90","","90","","11683","2","223","2","223","2","","","","","","","","4","F d d 2","F 2 -2d","43","","3,3',5,5'-Tetramethyl-4,4'-bipyrazolyl 2:1 adduct with Floroglucine, Monohydrate","","- C26 H36 N8 O4 -","- C26 H36 N8 O4 -","- C416 H576 N128 O64 -","16","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0549","0.0432","","","0.1057","0.111","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050307","20.736","0.004","15.807","0.003","16.385","0.003","90","","116.93","0.03","90","","4788","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C52 H64 N16 O4 -","- C52 H60 N16 O4 -","- C208 H240 N64 O16 -","4","0.5","","Liu, Simin; Wu, Xiaojun; Zhang, Shiwei; Yao, Junhua; Liang, Feng; Wu, Chengtai","Facile synthesis of novel macrocyclic polyamines derived from diphenylglycolurilElectronic supplementary information (ESI) available: ESI mass spectra of 5a, 6, alone and with added Ni(CH3COO)2, and 7. See http://www.rsc.org/suppdata/nj/b4/b400123k/","New Journal of Chemistry","2004","28","5","562","","10.1039/b400123k","","","0.71073","MoKα","","0.1268","0.0579","","","0.1435","0.1615","","","","","","0.835","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050308","10.4525","0.0004","13.0911","0.0005","17.7535","0.0006","81.517","0.001","78.849","0.002","70.818","0.001","2241.84","0.14","120","2","120","2","","","","","","","","7","P -1","-P 1","2","[Br(PPh3)(Py)Pd]2","Bromo(triphenylposphine)(2-pyridine)Paladium dimer","","- C51.5 H41.5 Br2 F N2.5 P2 Pd2 -","- C51.5 H41.5 Br2 F N2.5 P2 Pd2 -","- C103 H83 Br4 F2 N5 P4 Pd4 -","2","1","","Andrew Beeby; Sylvia Bettington; Ian J. S. Fairlamb; Andrés E. Goeta; Anant R. Kapdi; Elina H. Niemelä; Amber L. Thompson","A new precatalyst for the Suzuki reaction—a pyridyl-bridged dinuclear palladium complex as a source of mono-ligated palladium(0)","New J. Chem.","2004","28","5","600","605","10.1039/b401077a","","","0.71073","MoKα","","0.068","0.0431","","","0.0898","0.1002","","","","","","1.035","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050309","11.571","0.002","11.724","0.002","14.461","0.002","90","","90","","90","","1961.8","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-Methyl-2,4-dibromo-piridinium iodide","","- C6 H6 Br2 I N -","- C6 H6 Br2 I N -","- C48 H48 Br16 I8 N8 -","8","1","","Logothetis, Thomas A.; Meyer, Franck; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe","Crystal engineering of brominated tectons: N-methyl-3,5-dibromo-pyridinium iodide gives particularly short C?Br?I halogen bondingElectronic supplementary information (ESI) available: rotatable 3D versions of Fig. 1 and Fig. 3. See http://www.rsc.org/suppdata/nj/b4/b401421a/","New Journal of Chemistry","2004","28","6","760","","10.1039/b401421a","","","0.71073","MoKα","","0.0399","0.027","","","0.0679","0.0736","","","","","","1.039","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050310","12.4208","0.0009","12.684","0.0012","14.2246","0.0015","97.844","0.005","115.241","0.005","104.18","0.005","1889.7","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","gyefebh","","","- C86 H96 B2 Fe2 O4 P6 -","- C96.5 H84 B Fe2 P6 -","- C96.5 H84 B Fe2 P6 -","1","0.5","","Guilera, Gemma; Sean McGrady, G.; Steed, Jonathan W.; Kaltsoyannis, Nikolas","Expanding metallaborane chemistry: an octahedral BH6 moiety supported through M?H?B bridges","New Journal of Chemistry","2004","28","4","444","","10.1039/b401442c","","","0.71073","MoKα","","0.1704","0.1341","","","0.2043","0.2147","","","","","","1.318","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050311","14.304","0.001","14.304","0.001","42.791","0.007","90","","90","","120","","7581.9","1.5","294","2","294","2","","","","","","","","7","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C34 H69 Cl Cr Cu2 N18 O4.5 -","- C34 H68 Cl Cr Cu2 N18 O4.5 -","- C204 H408 Cl6 Cr6 Cu12 N108 O27 -","6","0.5","","Zheng Xu; Song Gao; Xiao-Ping Shen; Gui Yin; Kai-Bei Yu","Crystal structure and magnetic behavior of a three-dimensional cyano-bridged assembly [CuL1]2[Cr(CN)6]ClO4¡Á0.5H2O (L1= 3,10-dipropyl-1,3,5,8,10,12- hexaazacyclotetradecane)","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1425","0.0435","","","0.0797","0.0951","","","","","","0.8","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050312","19.114","0.004","21.214","0.004","31.878","0.006","90","","94.56","0.03","90","","12885","4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H124 Gd2 N16 O84 P2 W18 -","- C48 H104 Gd2 N16 O84 P2 W18 -","- C192 H416 Gd8 N64 O336 P8 W72 -","4","0.5","","Jingyang Niu; Dong-jie Guo; Jingping Wang; Jun-wei Zhao","Controlled assembly of polyoxometalate-based composite materials containing zero- and one-dimensional structures","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1031","0.0793","","","0.1803","0.1919","","","","","","1.119","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050313","19.229","0.004","23.776","0.005","24.237","0.005","90","","98.09","0.03","90","","10971","4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C40.5 H94.5 Gd2 N13.5 O75.5 P2 W18 -","- C40.5 H70.9 Gd2 N13.5 O75.5 P2 W18 -","- C162 H283.6 Gd8 N54 O302 P8 W72 -","4","1","","Jingyang Niu; Dong-jie Guo; Jingping Wang; Jun-wei Zhao","Controlled assembly of polyoxometalate-based composite materials containing zero- and one-dimensional structures","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0534","0.0391","","","0.0591","0.062","","","","","","1.038","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050314","14.137","0.003","14.661","0.003","26.806","0.005","80.63","0.03","81.65","0.03","68.01","0.03","5061.9","1.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H80 Ce2 N6 O81 P2 W18 -","- C30 H54 Ce2 N6 O81 P2 W18 -","- C60 H108 Ce4 N12 O162 P4 W36 -","2","1","","Jingyang Niu; Dong-jie Guo; Jingping Wang; Jun-wei Zhao","Controlled assembly of polyoxometalate-based composite materials containing zero- and one-dimensional structures","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0767","0.0616","","","0.1345","0.1412","","","","","","1.091","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050315","7.5335","0.0011","7.5335","0.0011","71.976","0.014","90","","90","","90","","4084.9","1.2","173","2","173","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C21 H26 Cl N O6 -","- C21 H26 Cl N O6 -","- C168 H208 Cl8 N8 O48 -","8","1","","John Smith; Elizabeth Balchin; Mike Bearpark; Anthony J. Horsewill; D. Malcolme-Lawes; M.Rowe; Jonathan Steed; David Stephenson; Weimin Wu","The Unusual Solid State Structure of Heroin Hydrochloride Monohydrate and its Selective Detection Using NQR Spectroscopy.","New J.Chem.(Nouv.J.Chim.)","2004","28","","1309","1314","10.1039/b401797h","","","0.71073","MoKα","","0.2057","0.0778","","","0.0943","0.1267","","","","","","1","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050316","7.1111","0.0012","7.8561","0.0013","9.031","0.0016","75.614","0.003","68.57","0.004","76.107","0.004","448.63","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H9 Co N O7 -","- C7 H5 Co N O7 -","- C14 H10 Co2 N2 O14 -","2","1","","Jingyang Niu; Dong-jie Guo; Jingping Wang; Jun-wei Zhao","Controlled assembly of polyoxometalate-based composite materials containing zero- and one-dimensional structures","New J.Chem.(Nouv.J.Chim.)","2004","28","","980","987","10.1039/b401769b","","","0.71073","MoKα","","0.118","0.0889","","","0.2229","0.2615","","","","","","1.022","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050317","16.9596","0.0004","8.8949","0.0002","11.6793","0.0003","90","","94.87","0.03","90","","1755.51","0.07","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,4,7,10-tetraazacyclododecane-dihydrogenbromide-dihydrate","1,4,7,10-tetraazacyclododecane-dihydrogenbromide-dihydrate","","- C8 H28 Br4 N4 O2 -","- C8 H26 Br4 N4 O2 -","- C32 H104 Br16 N16 O8 -","4","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0724","0.0447","","","0.1029","0.1134","","","","","","0.98","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050318","25.4408","0.0004","8.0708","0.0003","16.7769","0.0002","90","","103.915","0.001","90","","3343.67","0.14","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,4,7,10-tetraazacyclododecane-dihydrogentriiodide-diiodine-diacetonitrile","1,4,7,10-tetraazacyclododecane-dihydrogentriiodide-diiodine-diacetonitrile","","- C12 H28 I10 N6 -","- C12 H28 I10 N6 -","- C48 H112 I40 N24 -","4","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0672","0.0428","","","0.0927","0.1032","","","","","","1.019","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050319","7.2793","0.0002","8.0716","0.0003","11.4099","0.0003","87.859","0.002","77.59","0.002","88.234","0.001","654.1","0.03","123","2","123","2","","","","","","","","5","P -1","-P 1","2","1,4,7,10,13,16-hexaazacyclooctadecane-hexahydrogenchloride- tetrahydrate","1,4,7,10,13,16-hexaazacyclooctadecane-hexahydrogenchloride-tetrahydrate","","- C12 H44 Cl6 N6 O4 -","- C12 H44 Cl6 N6 O4 -","- C12 H44 Cl6 N6 O4 -","1","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0855","0.0472","","","0.0873","0.1005","","","","","","0.973","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050320","21.5782","0.0001","6.2908","0.0005","17.4204","0.0006","90","","90","","90","","2364.7","0.2","123","2","123","2","","","","","","","","5","P n a 21","P 2c -2n","33","1,4,7,10,13,16-hexaazacyclooctadecane-tetrahydrogenbromide- dihydrate","1,4,7,10,13,16-hexaazacyclooctadecane-tetrahydrogenbromide-dihydrate","","- C12 H38 Br4 N6 O2 -","- C12 H33 Br4 N6 O2 -","- C48 H132 Br16 N24 O8 -","4","1","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0881","0.0628","","","0.1499","0.1631","","","","","","1.015","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050321","8.1626","0.0002","22.7532","0.0005","8.2545","0.0002","90","","92.97","0.001","90","","1531.01","0.06","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4,7,10,13,16-hexaazacyclooctadecane-dihydrogentriiodide- dihydrogeniodide","1,4,7,10,13,16-hexaazacyclooctadecane-dihydrogentriiodide-dihydrogeniodide","","- C12 H34 I8 N6 -","- C12 H34 I8 N6 -","- C24 H68 I16 N12 -","2","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0602","0.0452","","","0.1092","0.1177","","","","","","1.03","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050322","9.059","0.001","7.515","0.001","12.102","0.004","90","","92.33","0.01","90","","823.2","0.3","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,5-dimethyl-3,6-bis-phenylethynylpyrazine","","","- C22 H16 N2 -","- C22 H16 N2 -","- C44 H32 N4 -","2","0.5","","Zhao, Liang; Perepichka, Igor F.; Türksoy, Figen; Batsanov, Andrei S.; Beeby, Andrew; Findlay, Karen S.; Bryce, Martin R.","2,5-Di(aryleneethynyl)pyrazine derivatives: synthesis, structural and optoelectronic properties, and light-emitting device","New Journal of Chemistry","2004","28","8","912","918","10.1039/B401867M","","","0.71073","MoKα","","0.0514","0.0383","","","0.1049","0.1145","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7050323","17.329","0.004","7.318","0.003","6.679","0.002","90","","109.1","0.02","90","","800.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","bis(mu-dicyanoamide)-bis(pyridine-N-oxide)-cobalt(ii)","bis(mu-dicyanoamide)-bis(pyridine-N-oxide)-cobalt(II)","","- C14 H10 Co N8 O2 -","- C14 H10 Co N8 O2 -","- C28 H20 Co2 N16 O4 -","2","0.25","","Nirmalendu Ray Chaudhuri; Debajyoti Ghoshal; Tian-Huey Lu; Tapas Kumar Maji; Golam Mostafa; Joan Ribas; E.Zangrando","Synthesis, crystal structure and magnetic behavior of three polynuclear complexes, [Co(pyo)2(dca)2]n, [Co3(ac)4(bpe)3(dca)2]n and [{Co(male)(H2O)2}(H2O)]n (pyo, pyridine-N-oxide; dca, dicyanamide; ac, acetate; bpe, 1,2-bis-(4-pyridyl)ethane and male, maleate)","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","Mokα","","0.0363","0.0357","","","0.0965","0.0971","","","","","","1.071","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050324","13.6306","0.0012","22.1417","0.0019","17.3317","0.0015","90","","106.304","0.002","90","","5020.4","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H48 Co3 N12 O8 -","- C48 H48 Co3 N12 O8 -","- C192 H192 Co12 N48 O32 -","4","1","","Nirmalendu Ray Chaudhuri; Debajyoti Ghoshal; Tian-Huey Lu; Tapas Kumar Maji; Golam Mostafa; Joan Ribas; E.Zangrando","Synthesis, crystal structure and magnetic behavior of three polynuclear complexes, [Co(pyo)2(dca)2]n, [Co3(ac)4(bpe)3(dca)2]n and [{Co(male)(H2O)2}(H2O)]n (pyo, pyridine-N-oxide; dca, dicyanamide; ac, acetate; bpe, 1,2-bis-(4-pyridyl)ethane and male, maleate)","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.2355","0.0576","","","0.0603","0.0828","","","","","","0.826","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050325","30.445","0.006","14.098","0.003","29.3","0.006","90","","116.28","0.03","90","","11276","4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C81 H112 Cl2 Mn12 O56 -","- C81 H112 Cl2 Mn12 O56 -","- C324 H448 Cl8 Mn48 O224 -","4","0.5","","Joulia Larionova; Rodolphe Clerac; Bruno Donnadieu; Christian Guerin; Bernard Henner; Lollita Lecren; A.Meyer; Alexander V. Pokrovskii; Stephanie Willemin","Synthesis and Characterisation of Magnetic Organic Inorganic Nanocomposites Based on [Mn12O12(CH2C(CH3)COO)16(H2O)4] Building Block.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0456","0.0402","","","0.0903","0.0931","","","","","","1.082","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050326","6.9151","0.0001","17.3434","0.0003","17.8375","0.0003","116.613","0.005","94.225","0.005","90.319","0.005","1905.64","0.1","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C37 H28 Cl2 Hg N2 O6 -","- C37 H24 Cl2 Hg N2 O6 -","- C74 H48 Cl4 Hg2 N4 O12 -","2","1","","Mir Wais Hosseini; Marc Henry","Molecular tectonics: geometry and energy based analysis of coordination networks","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","Mo-Kα","","0.059","0.043","","0.117","","0.067","","","1.221","","","1.176","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7050327","13.306","0.003","10.422","0.002","11.153","0.002","90","","90","","90","","1546.6","0.5","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","bis((-)-sparteine)dichlorodicopper(I)","bis((-)-sparteine)dichlorodicopper(I)","","- C30 H52 Cl2 Cu2 N4 -","- C30 H52 Cl2 Cu2 N4 -","- C60 H104 Cl4 Cu4 N8 -","2","0.5","","A.Johansson; M.Vestergren; M.Hakansson; B.Gustafsson; S.Jagner","Unexpected structural similarity between the chlorocopper(I) unit and the methyllithium and phenyllithium units. First complexes between (-)-sparteine and copper(I) chloride: synthesis and structural characterisation.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0333","0.0299","","","0.0733","0.0747","","","","","","1.009","","","","has coordinates","171772","2020-10-21","18:00:00",""
"7050328","8.3278","0.0018","16.118","0.003","12.848","0.003","90","","100.39","0.008","90","","1696.3","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","bis((-)-sparteine)tetrachlorotetracopper(I)","bis((-)-sparteine)tetrachlorotetracopper(I)","","- C30 H52 Cl4 Cu4 N4 -","- C30 H52 Cl4 Cu4 N4 -","- C60 H104 Cl8 Cu8 N8 -","2","1","","A.Johansson; M.Vestergren; M.Hakansson; B.Gustafsson; S.Jagner","Unexpected structural similarity between the chlorocopper(I) unit and the methyllithium and phenyllithium units. First complexes between (-)-sparteine and copper(I) chloride: synthesis and structural characterisation.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0592","0.0527","","","0.142","0.1457","","","","","","1.058","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050329","10.497","0.003","10.87","0.003","11.355","0.003","70.836","0.004","87.853","0.004","65.793","0.004","1109.1","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H35 Eu2 N7 O14 -","- C48 H35 Eu2 N7 O14 -","- C48 H35 Eu2 N7 O14 -","1","0.5","","Liu Chong-Bo; Lin-Pei Jin; Shaozhe Lu; Chang-Yan Sun","Supramolecular Architecture of New Lanthanide Coordination Polymers of 2-Aminoterephthalic Acid and 1,10-Phenanthroline","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.045","0.033","","","0.0673","0.0714","","","","","","1.006","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050330","10.6876","0.0009","11.0638","0.0008","11.4747","0.0009","69.08","0.006","87.883","0.006","65.576","0.006","1144.15","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H17.5 La N3.5 O7 -","- C24 H17.5 La N3.5 O7 -","- C48 H35 La2 N7 O14 -","2","1","","Liu Chong-Bo; Lin-Pei Jin; Shaozhe Lu; Chang-Yan Sun","Supramolecular Architecture of New Lanthanide Coordination Polymers of 2-Aminoterephthalic Acid and 1,10-Phenanthroline","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0471","0.0336","","","0.0656","0.0701","","","","","","1.005","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050331","10.4948","0.0016","11.0961","0.001","19.497","0.002","73.554","0.007","85.545","0.008","84.474","0.008","2164.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H33 Er2 N7 O13 -","- C48 H33 Er2 N7 O13 -","- C96 H66 Er4 N14 O26 -","2","1","","Liu Chong-Bo; Lin-Pei Jin; Shaozhe Lu; Chang-Yan Sun","Supramolecular Architecture of New Lanthanide Coordination Polymers of 2-Aminoterephthalic Acid and 1,10-Phenanthroline","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0877","0.0461","","","0.0718","0.0836","","","","","","0.971","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050332","10.518","0.003","11.091","0.004","19.544","0.006","73.846","0.004","85.663","0.005","84.416","0.005","2176.7","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H33 N7 O13 Tb2 -","- C48 H33 N7 O13 Tb2 -","- C96 H66 N14 O26 Tb4 -","2","1","","Liu Chong-Bo; Lin-Pei Jin; Shaozhe Lu; Chang-Yan Sun","Supramolecular Architecture of New Lanthanide Coordination Polymers of 2-Aminoterephthalic Acid and 1,10-Phenanthroline","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0626","0.0347","","","0.0558","0.0625","","","","","","1.057","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050333","12.998","0.003","15.816","0.003","21.168","0.005","90","","106.996","0.01","90","","4161.7","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C88 H66 N13 O25.5 Yb4 -","- C88 H48 N13 O25.5 Yb4 -","- C176 H96 N26 O51 Yb8 -","2","0.5","","Liu Chong-Bo; Lin-Pei Jin; Shaozhe Lu; Chang-Yan Sun","Supramolecular Architecture of New Lanthanide Coordination Polymers of 2-Aminoterephthalic Acid and 1,10-Phenanthroline","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.091","0.0431","","","0.0767","0.0901","","","","","","0.974","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050334","10.514","0.003","12.374","0.004","12.384","0.004","109.481","0.005","100.36","0.005","91.607","0.005","1487.5","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H22 Au2 Mn N8 O2 -","- C29 H22 Au2 Mn N8 O2 -","- C58 H44 Au4 Mn2 N16 O4 -","2","1","","Dai-Zheng Liao; Peng Cheng; Wen Dong; Zong-Hui Jiang; Zhan-Quan Liu; Hai-Bin Song; Ya-Qiu Sun; Qing-Mei Wang; Shi-Ping Yan; Bin Yu; Hui-Bo Zhou","Synthesis, crystal structures and luminescent properties of two supramolecular assemblies containing [Au(CN)2]- building block","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0709","0.0389","","","0.0848","0.0988","","","","","","1.023","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7050335","19.875","0.015","6.493","0.005","10.459","0.008","90","","100.438","0.011","90","","1327.4","1.7","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C8 H15 Au N6 O -","- C8 H15 Au N6 O -","- C32 H60 Au4 N24 O4 -","4","0.5","","Dai-Zheng Liao; Peng Cheng; Wen Dong; Zong-Hui Jiang; Zhan-Quan Liu; Hai-Bin Song; Ya-Qiu Sun; Qing-Mei Wang; Shi-Ping Yan; Bin Yu; Hui-Bo Zhou","Synthesis, crystal structures and luminescent properties of two supramolecular assemblies containing [Au(CN)2]- building block","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0861","0.0617","","","0.1488","0.167","","","","","","1.022","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050336","13.731","0.003","4.9553","0.001","18.029","0.004","90","","90","","90","","1226.7","0.4","200","","200","","","","","","","","","3","P n a 21","P 2c -2n","33","beta-Guanidinium dicyanamide","beta-Guanidinium dicyanamide","","- C3 H6 N6 -","- C3 H6 N6 -","- C24 H48 N48 -","8","2","","Wolfgang Schnick; Bettina V. Lotsch","Towards novel C-N materials: Crystal structures of two polymorphs of guanidinium dicyanamide and their thermal conversion into melamine.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0687","0.0423","","","0.0967","0.11","","","","","","1.043","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050337","19.249","0.004","4.9599","0.001","13.724","0.003","90","","110.46","0.03","90","","1227.5","0.4","200","","200","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","alpha-Guanidinium dicyanamide","alpha-Guanidinium dicyanamide","","- C3 H6 N6 -","- C3 H6 N6 -","- C24 H48 N48 -","8","2","","Wolfgang Schnick; Bettina V. Lotsch","Towards novel C-N materials: Crystal structures of two polymorphs of guanidinium dicyanamide and their thermal conversion into melamine.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.086","0.0474","","","0.1118","0.129","","","","","","1.038","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050338","11.5758","0.0007","12.2739","0.0005","17.2195","0.001","95.111","0.004","94.37","0.002","90.744","0.004","2429.3","0.2","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","[Ti3(OiPr)11][FeCl4]","","","- C33 H77 Cl4 Fe O11 Ti3 -","- C33 H77 Cl4 Fe O11 Ti3 -","- C66 H154 Cl8 Fe2 O22 Ti6 -","2","1","","Jaisa Fernandes Soares; David J. Evans; Geraldo R. Friedermann; Peter B. Hitchcock; G. Jeffery Leigh; Giovana G. Nunes; Dayane M. Reis; Eduardo L. Sa","Iron(III) and Titanium(IV) Oxoalkoxide Chemistry: Synthetic, Structural, Magnetochemical and Spectroscopic Studies of [Ti3(m3-OPri)2(m-OPri)3(OPri)6][FeCl4] and [Fe5(m5-O)(m-OPri)8Cl5]","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","x-ray","0.71073","MoKα","","0.0762","0.0558","","","0.1247","0.1367","","","","","","1.03","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050339","12.0547","0.0003","9.9251","0.0002","16.7734","0.0005","90","","91.861","0.001","90","","2005.78","0.09","173","2","173","2","","","","","","","synthesis as described","5","P 1 2/n 1","-P 2yac","13","[Fe5Cl5(O){OiPr}8]","","","- C24 H56 Cl5 Fe5 O9 -","- C24 H56 Cl5 Fe5 O9 -","- C48 H112 Cl10 Fe10 O18 -","2","0.5","","Jaisa Fernandes Soares; David J. Evans; Geraldo R. Friedermann; Peter B. Hitchcock; G. Jeffery Leigh; Giovana G. Nunes; Dayane M. Reis; Eduardo L. Sa","Iron(III) and Titanium(IV) Oxoalkoxide Chemistry: Synthetic, Structural, Magnetochemical and Spectroscopic Studies of [Ti3(m3-OPri)2(m-OPri)3(OPri)6][FeCl4] and [Fe5(m5-O)(m-OPri)8Cl5]","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","x-ray","0.71073","MoKα","","0.0902","0.0557","","","0.1221","0.1388","","","","","","1.091","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050340","15.4622","0.0003","15.4621","0.0003","19.2214","0.0004","90","","90","","90","","4595.42","0.16","173","2","173","2","","","","","","","synthesis as described","5","P 4/n :1","P 4ab -1ab","85","","","","- C31 H64 Cl5 Fe5 O9 -","- C31 H64 Cl5 Fe5 O9 -","- C124 H256 Cl20 Fe20 O36 -","4","0.5","","Jaisa Fernandes Soares; David J. Evans; Geraldo R. Friedermann; Peter B. Hitchcock; G. Jeffery Leigh; Giovana G. Nunes; Dayane M. Reis; Eduardo L. Sa","Iron(III) and Titanium(IV) Oxoalkoxide Chemistry: Synthetic, Structural, Magnetochemical and Spectroscopic Studies of [Ti3(m3-OPri)2(m-OPri)3(OPri)6][FeCl4] and [Fe5(m5-O)(m-OPri)8Cl5]","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","x-ray","0.71073","MoKα","","0.0937","0.066","","","0.15","0.1702","","","","","","1.168","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050341","38.387","0.017","18.997","0.008","26.326","0.011","90","","128.062","0.005","90","","15116","11","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C77 H43 Cl7 Gd N12 O -","- C77 H41 Cl7 Gd N12 O -","- C616 H328 Cl56 Gd8 N96 O8 -","8","1","","Dennis K.P.Ng; Ming Bai; Chi-Fung Choi; Takamitsu Fukuda; Jianzhuang Jiang; Nagao Kobayashi; R.Li; Dongbo Liang; Fanli Lu; Changqin Ma; Xuan Sun; Peihua Zhu","Synthesis, Spectroscopic Properties, and Electrochemistry of Heteroleptic Rare Earth Double-Decker Complexes with Phthalocyaninato and meso-Tetrakis(4-chlorophenyl)porphyrinato Ligands","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1478","0.0802","","","0.234","0.296","","","","","","1.085","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050342","12.111","0.0002","15.9535","0.0003","19.4105","0.0004","91.725","0.001","93.531","0.001","110.335","0.001","3504.63","0.11","150","2","150","2","","","","","","","","7","P -1","-P 1","2","bis-cyclotriveratrylenepotassium penta-bromo-1-carbaborane 2,2,2-trifluorothenaol solvate","","","- C59 H71 B9 Br5 F6 K O14 -","- C59 H71 B9 Br5 F6 K O14 -","- C118 H142 B18 Br10 F12 K2 O28 -","2","1","","R.Ahmad","Propeller-shaped chain and 2D grid coordination polymers with the host molecule cyclotriveratrylene and (CB9H5Br5)-","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0827","0.0625","","","0.1547","0.1672","","","","","","1.028","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050343","15.958","0.0002","27.329","0.0004","19.386","0.0003","90","","90.226","0.001","90","","8454.5","0.2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","acetonitrile cyclotriveratrylene penta-bromo-1-carbaborane rubidium(i)","","","- C60 H76 B18 Br10 N2 O12 Rb2 -","- C60 H76 B18 Br10 N2 O12 Rb2 -","- C240 H304 B72 Br40 N8 O48 Rb8 -","4","1","","R.Ahmad","Propeller-shaped chain and 2D grid coordination polymers with the host molecule cyclotriveratrylene and (CB9H5Br5)-","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.086","0.051","","","0.1182","0.1355","","","","","","1.02","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050344","10.90867","0.00064","6.80368","0.00033","20.2917","0.0011","90","","101.234","0.0032","90","","1477.18","0.14","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(R)-p-tolyl-methyl-sulfoxide 3,7,12-triketo-5ß-cholan-24-oic acid","","","- C32 H44 O6 S -","- C32 H44 O6 S -","- C64 H88 O12 S2 -","2","1","","Norberto Masciocchi; Olga Bortolini; Giancarlo Fantin; Marco Fogagnolo; Simona Galli; Angelo Sironi","Structural and Analytical Powder Diffraction Studies of the Enantioselective Inclusion of Chiral Arylmethylsulfoxides in Dehydrocholic Acid Co-Crystals","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050345","11.29099","0.00077","6.80314","0.00038","19.5173","0.0012","90","","92.6367","0.0039","90","","1497.62","0.16","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(S)-p-tolyl-methyl-sulfoxide 3,7,12-triketo-5ß-cholan-24-oic acid","","","- C32 H44 O6 S -","- C32 H44 O6 S -","- C64 H88 O12 S2 -","2","1","","Norberto Masciocchi; Olga Bortolini; Giancarlo Fantin; Marco Fogagnolo; Simona Galli; Angelo Sironi","Structural and Analytical Powder Diffraction Studies of the Enantioselective Inclusion of Chiral Arylmethylsulfoxides in Dehydrocholic Acid Co-Crystals","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050346","11.0918","0.0013","6.75768","0.00064","20.5605","0.0023","90","","102.46","0.0065","90","","1504.81","0.28","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(R)-p-tolyl-methoxy-sulfoxide 3,7,12-triketo-5ß-cholan-24-oic acid","","","- C32 H44 O7 S -","- C32 H44 O7 S -","- C64 H88 O14 S2 -","2","1","","Norberto Masciocchi; Olga Bortolini; Giancarlo Fantin; Marco Fogagnolo; Simona Galli; Angelo Sironi","Structural and Analytical Powder Diffraction Studies of the Enantioselective Inclusion of Chiral Arylmethylsulfoxides in Dehydrocholic Acid Co-Crystals","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050347","10.9476","0.0012","6.79373","0.00076","20.2718","0.0024","90","","101.389","0.0074","90","","1478.03","0.29","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","(R)-p-tolyl-bromo-sulfoxide 3,7,12-triketo-5ß-cholan-24-oic acid","","","- C31 H41 Br O6 S -","- C31 H41 Br O6 S -","- C62 H82 Br2 O12 S2 -","2","1","","Norberto Masciocchi; Olga Bortolini; Giancarlo Fantin; Marco Fogagnolo; Simona Galli; Angelo Sironi","Structural and Analytical Powder Diffraction Studies of the Enantioselective Inclusion of Chiral Arylmethylsulfoxides in Dehydrocholic Acid Co-Crystals","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050348","11.3389","0.0022","6.8185","0.0012","19.4289","0.0036","90","","93.532","0.019","90","","1499.28","0.48","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","(S)-p-tolyl-bromo-sulfoxide 3,7,12-triketo-5ß-cholan-24-oic acid","","","- C31 H41 Br O6 S -","- C31 H41 Br O6 S -","- C62 H82 Br2 O12 S2 -","2","1","","Norberto Masciocchi; Olga Bortolini; Giancarlo Fantin; Marco Fogagnolo; Simona Galli; Angelo Sironi","Structural and Analytical Powder Diffraction Studies of the Enantioselective Inclusion of Chiral Arylmethylsulfoxides in Dehydrocholic Acid Co-Crystals","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050349","10.9989","0.0011","6.763","0.00061","19.8905","0.0022","90","","92.525","0.011","90","","1478.13","0.26","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(S)-tolyl-sulfoxide 3,7,12-triketo-5ß-cholan-24-oic acid","","","- C31 H42 O6 S -","- C31 H42 O6 S -","- C62 H84 O12 S2 -","2","1","","Norberto Masciocchi; Olga Bortolini; Giancarlo Fantin; Marco Fogagnolo; Simona Galli; Angelo Sironi","Structural and Analytical Powder Diffraction Studies of the Enantioselective Inclusion of Chiral Arylmethylsulfoxides in Dehydrocholic Acid Co-Crystals","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","1.5418","CuKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050350","9.188","0.0008","11.936","0.0006","20.407","0.0015","89.07","0.0018","79.492","0.003","71.746","0.006","2087.7","0.3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H40.5 N12.5 O2 Zn -","- C49 H38 N12.5 O2 Zn -","- C98 H76 N25 O4 Zn2 -","2","1","","Israel Goldberg; Mikki Vinodu","Complexes of hexamethylenetetramine with zinc-tetraarylporphyrins, and their assembly modes in crystals as clathrates and hydrogen-bonding network polymers","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.09","0.0594","","","0.1398","0.1569","","","","","","1.039","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050351","10.36","0.0004","11.498","0.0006","15.361","0.0008","76.002","0.002","89.056","0.003","82.936","0.003","1761.81","0.15","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H72 N12 O12 Zn -","- C60 H52 N12 O8 Zn -","- C60 H52 N12 O8 Zn -","1","0.5","","Israel Goldberg; Mikki Vinodu","Complexes of hexamethylenetetramine with zinc-tetraarylporphyrins, and their assembly modes in crystals as clathrates and hydrogen-bonding network polymers","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0729","0.0526","","","0.1411","0.1513","","","","","","0.997","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050352","18.789","0.0003","27.742","0.0005","12.473","0.0007","90","","90","","90","","6501.5","0.4","110","2","110","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C71 H64.5 N14.5 O9 Zn -","- C56 H52 N12 O4 Zn -","- C224 H208 N48 O16 Zn4 -","4","0.5","","Israel Goldberg; Mikki Vinodu","Complexes of hexamethylenetetramine with zinc-tetraarylporphyrins, and their assembly modes in crystals as clathrates and hydrogen-bonding network polymers","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0937","0.0549","","","0.1475","0.1588","","","","","","0.904","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050353","14.411","0.002","12.2057","0.0017","11.357","0.0016","90","","96.061","0.002","90","","1986.5","0.5","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 Fe O P S2 -","- C20 H23 Fe O P S2 -","- C80 H92 Fe4 O4 P4 S8 -","4","1","","Derek Woollins; Ian P. Gray; Alexandra M. Z. Slawin","Synthesis and Characterisation of disulfides and esters derived from their sodium organodithiophosphonate salts.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0267","0.0238","","","0.057","0.0588","","","","","","1.054","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050354","12.2407","0.0009","13.557","0.002","14.531","0.002","90","","90","","90","","2411.4","0.5","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(N-methyl-salicylideneiminato-O,N)-diethyl-boron(III)","","- C12 H18 B N O -","- C12 H18 B N O -","- C96 H144 B8 N8 O8 -","8","1","","Lewinski, Janusz; Dranka, Maciej; Justyniak, Iwona","The self-assembly switching of the group 13 tetrahedral Schiff base complexes by changing the character of coordination centre","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.093","0.0552","","","0.1009","0.1123","","","","","","1.077","","","","has coordinates","208199","2020-10-21","18:00:00",""
"7050355","22.3787","0.0008","10.7423","0.0006","15.2876","0.0009","90","","123.09","0.002","90","","3079.1","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(N-phenyl-salicylideneiminato-O,N)-diethyl-boron(III)","","- C17 H20 B N O -","- C17 H20 B N O -","- C136 H160 B8 N8 O8 -","8","1","","Lewinski, Janusz; Dranka, Maciej; Justyniak, Iwona","The self-assembly switching of the group 13 tetrahedral Schiff base complexes by changing the character of coordination centre","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1102","0.0481","","","0.107","0.1344","","","","","","1.033","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7050356","8.7294","0.0007","12.1861","0.001","15.3426","0.0012","72.435","0.001","79.668","0.001","89.855","0.002","1528.5","0.2","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H27 Cu N11 O S2 -","- C25 H27 Cu N11 O S2 -","- C50 H54 Cu2 N22 O2 S4 -","2","1","","Ray, Umasankar; Banerjee, Debasis; Mostafa, Golam; Lu, Tian-Huey; Sinha, Chittaranjan","Copper coordination compounds of chelating imidazole-azo-aryl ligand. The molecular structures of bis[1-ethyl-2-(p-tolylazo)imidazole]-bis-(azido)copper(ii) and bis[1-methyl-2-(phenylazo)imidazole]-bis(thiocyanato)copper(ii)","New Journal of Chemistry","2004","28","12","1437","","10.1039/b406445c","","","0.71073","MoK\α","","0.0839","0.0474","","","0.1369","0.1529","","","","","","0.892","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050357","11.8632","0.0008","17.6782","0.0013","26.703","0.002","90","","90","","90","","5600.2","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H28 Cu N14 -","- C24 H28 Cu N14 -","- C192 H224 Cu8 N112 -","8","1","","Ray, Umasankar; Banerjee, Debasis; Mostafa, Golam; Lu, Tian-Huey; Sinha, Chittaranjan","Copper coordination compounds of chelating imidazole-azo-aryl ligand. The molecular structures of bis[1-ethyl-2-(p-tolylazo)imidazole]-bis-(azido)copper(ii) and bis[1-methyl-2-(phenylazo)imidazole]-bis(thiocyanato)copper(ii)","New Journal of Chemistry","2004","28","12","1437","","10.1039/b406445c","","","0.71073","MoK\α","","0.1149","0.0546","","","0.1076","0.1249","","","","","","0.992","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050358","8.0657","0.0005","9.7732","0.0007","23.754","0.001","84.167","0.006","90.429","0.007","82.825","0.007","1847.81","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Complex of 1,3,5-benzene-tris(methylenephosphonic acid).","","- C21 H45 N9 O18 P6 -","- C21 H45 N9 O18 P6 -","- C42 H90 N18 O36 P12 -","2","1","","C.Fernandez; P.-A.Jaffres; V.Montouillout; J.Sopkova-de Oliveira Santos; D.Villemin","Assembly of benzene-1,3,5-tris(methylenephosphonic acid) and guanidinium salt : Single crystal-X-ray characterisation and 31P solid state NMR investigations.","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0422","0.0344","","","0.0988","0.1234","","","","","","1.098","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7050359","8.0243","0.0016","12.953","0.003","15.781","0.003","95.61","0.03","104.3","0.03","98.47","0.03","1556.7","0.5","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H36 Fe2 N O5 Zn -","- C35 H36 Fe2 N O5 Zn -","- C70 H72 Fe4 N2 O10 Zn2 -","2","1","","Hongwei Hou; Yaoting Fan; Gang Li; Zi-Feng Li; Xiangru Meng","Novel Zinc(II) Coordination Polymers Constructed From Ferrocenyl Carboxylate Ligands","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0589","0.0339","","","0.0611","0.0659","","","","","","0.914","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050360","16.836","0.003","19.452","0.004","7.4853","0.0015","90","","90","","90","","2451.5","0.9","291","2","291","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C28 H26 Fe2 O4 Zn -","- C28 H26 Fe2 O4 Zn -","- C112 H104 Fe8 O16 Zn4 -","4","0.5","","Hongwei Hou; Yaoting Fan; Gang Li; Zi-Feng Li; Xiangru Meng","Novel Zinc(II) Coordination Polymers Constructed From Ferrocenyl Carboxylate Ligands","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0626","0.038","","","0.0728","0.0774","","","","","","0.967","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050361","32.676","0.005","3.964","0.001","7.502","0.001","90","","98.47","0.01","90","","961.1","0.3","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","2-methoxy-4,6-dimethyl-5-formaylbenzaldehyde","","","- C11 H12 O3 -","- C11 H12 O3 -","- C44 H48 O12 -","4","1","","J. Narasimha Moorthy; R.Natarajan; Prasenjit Mal; P.Venugopalan","First example of a helical nanotube sustained by weak C-H∙∙∙O/N hydrogen bonds: Remarkable self-assembly of an o-anisaldehyde","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.052","0.0447","","","0.1188","0.126","","","","","","1.008","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050362","7.574","0.001","8.315","0.001","12.782","0.002","84.56","0.01","79.32","0.01","63.27","0.01","706.44","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2-benzyloxy-4,6-dimethyl-5-cyanobenzaldehyde","","","- C17 H15 N O2 -","- C17 H15 N O2 -","- C34 H30 N2 O4 -","2","1","","J. Narasimha Moorthy; R.Natarajan; Prasenjit Mal; P.Venugopalan","First example of a helical nanotube sustained by weak C-H∙∙∙O/N hydrogen bonds: Remarkable self-assembly of an o-anisaldehyde","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0628","0.0461","","","0.1261","0.136","","","","","","1.05","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050363","12.3728","0.0013","24.512","0.003","3.9548","0.0004","90","","90","","90","","1199.4","0.2","100","2","100","2","","","","","","","","4","P b a 2","P 2 -2ab","32","","2-methoxy-4,6-dimethyl-5-cyanobenzaldehyde -pentane solvate","","- C16 H23 N O2 -","- C16 H11 N O2 -","- C64 H44 N4 O8 -","4","1","","J. Narasimha Moorthy; R.Natarajan; Prasenjit Mal; P.Venugopalan","First example of a helical nanotube sustained by weak C-H∙∙∙O/N hydrogen bonds: Remarkable self-assembly of an o-anisaldehyde","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0707","0.0688","","","0.1774","0.1795","","","","","","1.012","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7050364","7.8375","0.0014","10.1625","0.0018","12.272","0.002","82.819","0.003","83.055","0.003","82.805","0.003","956.7","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2-methoxy-4,6-dimethyl-5-cyanobenzaldehyde","","- C11 H11 N O2 -","- C11 H11 N O2 -","- C44 H44 N4 O8 -","4","2","","J. Narasimha Moorthy; R.Natarajan; Prasenjit Mal; P.Venugopalan","First example of a helical nanotube sustained by weak C-H∙∙∙O/N hydrogen bonds: Remarkable self-assembly of an o-anisaldehyde","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0607","0.0477","","","0.1181","0.1271","","","","","","1.012","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050365","19.0609","0.0015","10.4108","0.0008","28.69","0.002","90","","91.537","0.002","90","","5691.2","0.7","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","4'-Methoxyphenyloxocarbonium hexafluoroantimonate","4'-Methoxyphenyloxocarbonium hexafluoroantimonate","","- C8 H7 F6 O2 Sb -","- C8 H7 F6 O2 Sb -","- C160 H140 F120 O40 Sb20 -","20","2.5","","Jay Kochi; Milya G. Davlieva; Sergey V. Lindeman","Structural Effects of Carbon-Monoxide Coordination to Carbon Centers. p and s Bindings in Aliphatic Acyl versus Aromatic Aroyl Cations","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0773","0.0661","","","0.1626","0.1693","","","","","","1.035","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050366","12.5856","0.0015","12.3958","0.0015","13.0791","0.0015","90","","92.252","0.002","90","","2038.9","0.4","123","2","123","2","","","","","","","chemical synthesis","5","P 1 21/n 1","-P 2yn","14","4'-Fluorophenyloxocarbonium hexafluoroantimonate","4'-Fluorophenyloxocarbonium hexafluoroantimonate","","- C7 H4 F7 O Sb -","- C7 H4 F7 O Sb -","- C56 H32 F56 O8 Sb8 -","8","2","","Jay Kochi; Milya G. Davlieva; Sergey V. Lindeman","Structural Effects of Carbon-Monoxide Coordination to Carbon Centers. p and s Bindings in Aliphatic Acyl versus Aromatic Aroyl Cations","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0813","0.0437","","","0.0914","0.1056","","","","","","1.005","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050367","7.6218","0.0006","12.7753","0.0009","18.2425","0.0014","90","","90.641","0.001","90","","1776.2","0.2","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Pentamethylphenyloxocarbonium hexafluoroantimonate, dichloromethane monosolvate","Pentamethylphenyloxocarbonium hexafluoroantimonate, dichloromethane monosolvate","","- C13 H17 Cl2 F6 O Sb -","- C13 H17 Cl2 F6 O Sb -","- C52 H68 Cl8 F24 O4 Sb4 -","4","1","","Jay Kochi; Milya G. Davlieva; Sergey V. Lindeman","Structural Effects of Carbon-Monoxide Coordination to Carbon Centers. p and s Bindings in Aliphatic Acyl versus Aromatic Aroyl Cations","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0328","0.0295","","","0.0723","0.0739","","","","","","1.093","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050368","9.2849","0.0005","25.0381","0.0012","14.9209","0.0007","90","","104.665","0.001","90","","3355.8","0.3","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2',4',6'-Trimethylphenyloxocarbonium hexachloroantimonate","2',4',6'-Trimethylphenyloxocarbonium hexachloroantimonate","","- C10 H11 Cl6 O Sb -","- C10 H11 Cl6 O Sb -","- C80 H88 Cl48 O8 Sb8 -","8","2","","Jay Kochi; Milya G. Davlieva; Sergey V. Lindeman","Structural Effects of Carbon-Monoxide Coordination to Carbon Centers. p and s Bindings in Aliphatic Acyl versus Aromatic Aroyl Cations","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0343","0.0276","","","0.063","0.0661","","","","","","1.041","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050369","11.7482","0.0007","10.2038","0.0006","12.4473","0.0008","90","","93.428","0.001","90","","1489.47","0.16","123","2","123","2","","","","","","","chemical synthesis","5","P 1 21/c 1","-P 2ybc","14","4'-Methylphenyloxocarbonium hexachloroantimonate","4'-Methylphenyloxocarbonium hexachloroantimonate","","- C8 H7 Cl6 O Sb -","- C8 H7 Cl6 O Sb -","- C32 H28 Cl24 O4 Sb4 -","4","1","","Jay Kochi; Milya G. Davlieva; Sergey V. Lindeman","Structural Effects of Carbon-Monoxide Coordination to Carbon Centers. p and s Bindings in Aliphatic Acyl versus Aromatic Aroyl Cations","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0223","0.0202","","","0.0496","0.0508","","","","","","1.011","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050370","9.63","0.002","21.727","0.004","17.275","0.003","90","","96.69","0.001","90","","3589.9","1.2","120","","120","","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H44 N3 O21 P4 Sm -","- C18 H44 N3 O21 P4 Sm -","- C72 H176 N12 O84 P16 Sm4 -","4","0.5","","Lees, Anthony M. J.; Kresinski, Roman A.; Platt, Andrew W. G.","Complexes of (EtO)2P(O)CH2P(O)(OEt)2 with lanthanide nitrates","New Journal of Chemistry","2004","28","12","1457","","10.1039/b408536a","","x-ray","0.71073","MoKα","","0.0448","0.0429","","","0.1153","0.1159","","","","","","1.352","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050371","8.8205","0.0011","20.0885","0.0006","20.63","0.0014","90","","91.716","0.016","90","","3653.8","0.5","0","","293","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H44 La N3 O21 P4 -","- C18 H44 La N3 O21 P4 -","- C72 H176 La4 N12 O84 P16 -","4","1","","Lees, Anthony M. J.; Kresinski, Roman A.; Platt, Andrew W. G.","Complexes of (EtO)2P(O)CH2P(O)(OEt)2 with lanthanide nitrates","New Journal of Chemistry","2004","28","12","1457","","10.1039/b408536a","","x-ray","0.71069","MoKα","","0.0464","0.0365","","","0.0833","0.0853","","","","","","0.984","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050372","18.0389","0.0009","13.1731","0.0006","19.2678","0.0009","90","","100.525","0.001","90","","4501.5","0.4","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H52 N4 O8 -","- C48 H52 N4 O8 -","- C192 H208 N16 O32 -","4","1","","O.G.Barton; M.Schmidtmann; A.Muller; J.Mattay","Diaminotriazine substituted 1,3-alternate Calix[4]arenes","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0691","0.0491","","","0.1298","0.1469","","","","","","1.026","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050373","14.2874","0.0006","14.6477","0.0006","20.236","0.0008","84.746","0.001","81.894","0.001","72.131","0.001","3985.1","0.3","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C72 H104 N20 O16 -","- C75.5 H104 N20 O16 -","- C151 H208 N40 O32 -","2","1","","O.G.Barton; M.Schmidtmann; A.Muller; J.Mattay","Diaminotriazine substituted 1,3-alternate Calix[4]arenes","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0937","0.0681","","","0.1774","0.1996","","","","","","1.031","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050374","24.3057","0.0009","17.3007","0.0006","22.946","0.0009","90","","115.739","0.001","90","","8691.6","0.6","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H54 N2 O8 -","- C46 H54 N2 O8 -","- C368 H432 N16 O64 -","8","2","","O.G.Barton; M.Schmidtmann; A.Muller; J.Mattay","Diaminotriazine substituted 1,3-alternate Calix[4]arenes","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0767","0.046","","","0.1069","0.1244","","","","","","1.045","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050375","19.7097","0.0007","20.11","0.0007","25.8943","0.0009","90","","111.219","0.001","90","","9567.7","0.6","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H52 I4 O8 -","- C44 H52 I4 O8 -","- C352 H416 I32 O64 -","8","2","","O.G.Barton; M.Schmidtmann; A.Muller; J.Mattay","Diaminotriazine substituted 1,3-alternate Calix[4]arenes","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0344","0.0223","","","0.0529","0.0582","","","","","","0.961","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050376","14.3264","0.0006","16.9472","0.0007","20.0115","0.0009","90","","90","","90","","4858.6","0.4","183","2","183","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C50 H62 N10 O8 -","- C50 H62 N10 O8 -","- C200 H248 N40 O32 -","4","1","","O.G.Barton; M.Schmidtmann; A.Muller; J.Mattay","Diaminotriazine substituted 1,3-alternate Calix[4]arenes","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0495","0.0409","","","0.103","0.1083","","","","","","1.057","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050377","16.142","0.0003","18.9857","0.0004","11.1379","0.0002","90","","90","","90","","3413.4","0.11","120","2","120","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C21 H22 N2 -","- C21 H22 N2 -","- C168 H176 N16 -","8","2","","Suresh Das; Shibu Abraham; Riju Davis; Nigam P. Rath","Observation of a Non-Conventional Horner-Wadsworth-Emmons Olefination Product and the Effect of the Lateral Ethyl Substitution on its Solid State Fluorescence","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1577","0.0609","","","0.1277","0.1658","","","","","","0.971","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050378","20.5271","0.0004","8.3909","0.0001","16.6116","0.0002","90","","90","","90","","2861.2","0.07","123","2","123","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1,4,7,10,13,16-hexaazoniacyclooctadecane-tetra(hydrogensulfate)-sulfate- monohydrate","","- C12 H42 N6 O21 S5 -","- C12 H42 N6 O21 S5 -","- C48 H168 N24 O84 S20 -","4","1","","Leone Spiccia; Milton T. W. Hearn; Andrew C. Warden; Mark Warren","Binding of Inorganic Oxoanions to Macrocyclic Ligands: Interactions of Sulfate and Dithionate with Protonated Forms of [18]aneN6","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.074","0.0448","","","0.086","0.0951","","","","","","0.98","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050379","7.9597","0.0002","11.2322","0.0003","12.5897","0.0004","90","","100.673","0.001","90","","1106.11","0.05","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,4,7,10,13,16-hexaazoniacyclooctadecane-tris(sulfate)","","- C12 H36 N6 O12 S3 -","- C12 H36 N6 O12 S3 -","- C24 H72 N12 O24 S6 -","2","0.5","","Leone Spiccia; Milton T. W. Hearn; Andrew C. Warden; Mark Warren","Binding of Inorganic Oxoanions to Macrocyclic Ligands: Interactions of Sulfate and Dithionate with Protonated Forms of [18]aneN6","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0712","0.0428","","","0.0972","0.108","","","","","","1.032","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050380","6.4044","0.0002","20.6316","0.0005","10.197","0.0004","90","","94.455","0.001","90","","1343.29","0.07","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1,4,7,10,13,16-hexaazoniacyclooctadecane-tetrachloride-disulfate-dihydrate","","- C12 H42 Cl4 N6 O10 S2 -","- C12 H42 Cl4 N6 O10 S2 -","- C24 H84 Cl8 N12 O20 S4 -","2","0.5","","Leone Spiccia; Milton T. W. Hearn; Andrew C. Warden; Mark Warren","Binding of Inorganic Oxoanions to Macrocyclic Ligands: Interactions of Sulfate and Dithionate with Protonated Forms of [18]aneN6","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0656","0.0412","","","0.0844","0.0924","","","","","","1.043","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050381","13.1554","0.0003","11.4761","0.0004","8.7203","0.0003","90","","97.56","0.03","90","","1305.07","0.07","123","2","123","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","1,4,7,10,13,16-hexaazacyclooctdecane-1,4,13,16-azonia-bisdithionate-dihydrate","","- C12 H38 N6 O14 S4 -","- C12 H34 N6 O13 S4 -","- C24 H68 N12 O26 S8 -","2","0.25","","Leone Spiccia; Milton T. W. Hearn; Andrew C. Warden; Mark Warren","Binding of Inorganic Oxoanions to Macrocyclic Ligands: Interactions of Sulfate and Dithionate with Protonated Forms of [18]aneN6","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.075","0.0509","","","0.1389","0.1526","","","","","","1.086","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050382","5.3858","0.0003","13.3905","0.0009","13.4835","0.0006","90","","96.434","0.009","90","","966.29","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H15 N O2 S -","- C7 H15 N O2 S -","- C28 H60 N4 O8 S4 -","4","1","","Lech Kozerski; Brunon Kwiecień; Robert Kawęcki; Zofia Urbańczyk-Lipkowska; Wojciech Bocian; Elżbieta Bednarek; Jerzy Sitkowski; Jan Maurin; Leszek Pazderski; Poul E. Hansen","Hydrogen bonds in “push-pull” enamines","New J. Chem.","2004","28","12","1562","1567","10.1039/b409254f","","","1.54178","CuKα","","0.0643","0.0634","","","0.1447","0.1474","","","","","","1.034","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050383","5.764","0.005","16.888","0.012","6.447","0.004","90","","115.2","0.07","90","","567.8","0.8","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C9 H17 N O2 S -","- C9 H17 N O2 S -","- C18 H34 N2 O4 S2 -","2","1","","Lech Kozerski; Brunon Kwiecień; Robert Kawęcki; Zofia Urbańczyk-Lipkowska; Wojciech Bocian; Elżbieta Bednarek; Jerzy Sitkowski; Jan Maurin; Leszek Pazderski; Poul E. Hansen","Hydrogen bonds in “push-pull” enamines","New J. Chem.","2004","28","12","1562","1567","10.1039/b409254f","","","0.71073","MoKα","","0.1155","0.0531","","","0.1334","0.1522","","","","","","0.965","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050384","20.7206","0.0006","20.5047","0.0005","11.9981","0.0003","90","","93.101","0.001","90","","5090.2","0.2","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","[CL3Ti{(CyN)2CC6H4C(NCySiMe3)(NHCy)}]{Ti2Cl9]","","","- C35 H58 Cl12 N4 Si Ti3 -","- C35 H58 Cl12 N4 Si Ti3 -","- C140 H232 Cl48 N16 Si4 Ti12 -","4","1","","Grundy, Joanna; Coles, Martyn P.; Hitchcock, Peter B.","Ambiphilic ligands from the 1,4-benzenebis(amidine) framework","New Journal of Chemistry","2004","28","10","1195","1197","10.1039/b409256b","","x-ray","0.71073","MoKα","","0.0866","0.0508","","","0.0888","0.0996","","","","","","1.029","","","","has coordinates","218968","2020-10-21","18:00:00",""
"7050385","7.2878","0.0005","14.4364","0.0008","17.4246","0.001","72.557","0.005","85.278","0.005","82.046","0.005","1730.49","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[8-(3'-(3,5-dibenzyloxy-benzyloxy)-2'-hydroxyphenyl)- (5,6)-benzo-4,7-diazaocta-2,7-dien-1-onato(2-)]nickel(II)","","- C44 H36 N2 Ni O5 -","- C44 H36 N2 Ni O5 -","- C88 H72 N4 Ni2 O10 -","2","1","","Dariusz Pawlica; Marek Marszałek; Grzegorz Mynarczuk; Lesław Sieroń; Julita Eilmes","New unsymmetrical Schiff base Ni(II) complexes as scaffolds for dendritic and amino acid superstructures","New J. Chem.","2004","28","12","1615","1621","10.1039/b409298h","","x-ray","0.71073","MoKα","","0.0817","0.0334","","","0.0524","0.0612","","","","","","0.675","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050386","23.2759","0.0003","8.4381","0.0001","25.9355","0.0003","90","","96.476","0.001","90","","5061.34","0.11","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[8-(3'-Ac-(D,L)-alanyloxy)-2'-hydroxyphenyl)-(5,6)-benzo -4,7-diazaocta-2,7-dien-1-onato(2-)]nickel(II)","","- C28 H25 N3 Ni O5 -","- C28 H25 N3 Ni O5 -","- C224 H200 N24 Ni8 O40 -","8","1","","Dariusz Pawlica; Marek Marszałek; Grzegorz Mynarczuk; Lesław Sieroń; Julita Eilmes","New unsymmetrical Schiff base Ni(II) complexes as scaffolds for dendritic and amino acid superstructures","New J. Chem.","2004","28","12","1615","1621","10.1039/b409298h","","","1.54178","CuKα","","0.0368","0.0342","","","0.0992","0.1016","","","","","","1.05","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050387","21.8152","0.0003","7.5781","0.0001","22.956","0.0004","90","","114.209","0.0007","90","","3461.28","0.09","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","[8-(3'-Boc-(L)-phenylalanyloxy-2'-hydroxyphenyl)-(5,6) -benzo-3-methyl-1-phenyl-4,7-diazaocta-2,7-dien-1 -onato(2-)]nickel(II) dihydrate","","- C37 H39 N3 Ni O8 -","- C37 H39 N3 Ni O8 -","- C148 H156 N12 Ni4 O32 -","4","2","","Dariusz Pawlica; Marek Marszałek; Grzegorz Mynarczuk; Lesław Sieroń; Julita Eilmes","New unsymmetrical Schiff base Ni(II) complexes as scaffolds for dendritic and amino acid superstructures","New J. Chem.","2004","28","12","1615","1621","10.1039/b409298h","","","1.54178","CuKα","","0.0606","0.0437","","","0.1121","0.1205","","","","","","1.03","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050388","7.8681","0.001","10.356","0.002","13.39","0.002","85.431","0.013","78.603","0.011","72.667","0.014","1020.7","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 Cu3 N O12 -","- C21 H14 Cu3 N O12 -","- C42 H28 Cu6 N2 O24 -","2","1","","Yan-Zhen Zheng; Ming-Liang Tong; Xiao-Ming Chen","Controlled hydrothermal synthesis of copper(II or I,II) coordination polymers via pH-dependent in-situ metal/ligand redox reactions","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0468","0.0392","","","0.0916","0.1046","","","","","","1.151","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050389","10.7251","0.0012","10.8401","0.0013","14.7967","0.0017","91.429","0.002","94.101","0.002","118.737","0.002","1501.1","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H21 Cu2 N3 O8 -","- C20.6667 H14 Cu1.33333 N2 O5.33333 -","- C62 H42 Cu4 N6 O16 -","3","1.5","","Yan-Zhen Zheng; Ming-Liang Tong; Xiao-Ming Chen","Controlled hydrothermal synthesis of copper(II or I,II) coordination polymers via pH-dependent in-situ metal/ligand redox reactions","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.1484","0.0858","","","0.2103","0.2386","","","","","","1.055","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050390","11.3502","0.0008","16.1501","0.0011","11.3658","0.0008","90","","101.935","0.001","90","","2038.4","0.2","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H15 Cu2 N3 O11 -","- C19 H15 Cu2 N3 O11 -","- C76 H60 Cu8 N12 O44 -","4","0.5","","Yan-Zhen Zheng; Ming-Liang Tong; Xiao-Ming Chen","Controlled hydrothermal synthesis of copper(II or I,II) coordination polymers via pH-dependent in-situ metal/ligand redox reactions","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.032","0.0289","","","0.0812","0.0832","","","","","","1.064","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050391","18.022","0.004","15.912","0.003","18.556","0.004","90","","90","","90","","5321.2","1.8","180","2","180","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H33 N2 O16 Tb -","- C19 H33 N2 O16 Tb -","- C152 H264 N16 O128 Tb8 -","8","1","","Yan-Zhen Zheng; Ming-Liang Tong; Xiao-Ming Chen","Controlled hydrothermal synthesis of copper(II or I,II) coordination polymers via pH-dependent in-situ metal/ligand redox reactions","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71073","MoKα","","0.0672","0.0357","","","0.0642","0.0734","","","","","","1.029","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050392","8.3873","0.0006","8.3873","0.0006","10.5853","0.0012","90","","90","","90","","744.64","0.11","150","2","150","2","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","caesium penta-bromo-monocarbadecaborane","","","- C H5 B9 Br5 Cs -","- C H5 B9 Br5 Cs -","- C2 H10 B18 Br10 Cs2 -","2","0.125","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.6883","synchrotron","","0.0617","0.0613","","","0.1211","0.1222","","","","","","1.241","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050393","15.0967","0.0003","9.246","0.0002","12.5568","0.0003","90","","97.112","0.001","90","","1739.24","0.07","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","caesium hexa-bromo-monocarbadodecaborane","","","- C H6 B11 Br6 Cs -","- C H6 B11 Br6 Cs -","- C4 H24 B44 Br24 Cs4 -","4","1","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.71073","MoKα","","0.0448","0.0376","","","0.0917","0.0958","","","","","","1.034","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050394","8.917","0.006","9.765","0.003","10.26","0.005","90.08","0.05","111.32","0.04","106.14","0.05","794.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H40 Cl2 N6 O12 -","- C24 H36 Cl2 N6 O12 -","- C24 H36 Cl2 N6 O12 -","1","0.5","","G.Ambrosi; M.Formica; L.Giorgi; S.Lucarini; P.Paoli; P.Rossi","","New J.Chem.(Nouv.J.Chim.)","2004","","","","","","","","0.71069","MoKα","","0.2043","0.0927","","","0.2571","0.3469","","","","","","1.039","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050395","35.96","0.03","24.41","0.02","25.89","0.02","90","","126.99","0.05","90","","18152","3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C228 H218 O13 -","- C228 H218 O13 -","- C912 H872 O52 -","4","0.5","","Nicola Armaroli; Gianluca Accorsi; Yannick Rio; Paola Ceroni; Veronica Vicinelli; Richard Welter; Tao Gu; Mohamed Saddik; Michel Holler; Jean-François Nierengarten","Electronic properties of oligophenylenevinylene and oligophenyleneethynylene arrays constructed on the upper rim of a calix[4]arene core","New J. Chem.","2004","28","12","1627","1637","10.1039/b415063p","","","0.71069","MoKα","","0.1941","0.1119","","","0.2164","0.2534","","","","","","1.046","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050396","42.5519","0.0005","42.5519","0.0005","8.7407","0.0005","90","","90","","120","","13706.1","0.8","150","","150","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C30 H31 Cl3 O P Ta -","- C30 H31 Cl3 O P Ta -","- C540 H558 Cl54 O18 P18 Ta18 -","18","1","","Morise, Xavier; Green, Malcolm L. H.; Braunstein, Pierre; Rees, Leigh H.; Vei, Ino C.","Monocyclopentadienyl complexes of niobium, tantalum and tungsten containing heterodifunctional P,O ligands","New Journal of Chemistry","2003","27","1","32","38","10.1039/b202983a","","","0.71073","MoKα","","","0.0281","","","","0.0298","","","","","","1.0695","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050397","8.4611","0.0001","16.6441","0.0003","16.8443","0.0003","92.6314","0.0008","99.3326","0.0009","94.1166","0.0011","2330.71","0.07","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C50 H42 Cl6 O2 P2 Ta2 -","- C50 H42 Cl6 O2 P2 Ta2 -","- C100 H84 Cl12 O4 P4 Ta4 -","2","1","","Morise, Xavier; Green, Malcolm L. H.; Braunstein, Pierre; Rees, Leigh H.; Vei, Ino C.","Monocyclopentadienyl complexes of niobium, tantalum and tungsten containing heterodifunctional P,O ligands","New Journal of Chemistry","2003","27","1","32","38","10.1039/b202983a","","","0.71073","MoKα","","","0.0314","","","","0.0366","","","","","","1.0798","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050398","7.876","0.001","26.392","0.001","12.65","0.001","90","","97.01","0.01","90","","2609.8","0.4","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28.5 H25 Cl3 Nb O P -","- C28.5 H25 Cl3 Nb O P -","- C114 H100 Cl12 Nb4 O4 P4 -","4","1","","Morise, Xavier; Green, Malcolm L. H.; Braunstein, Pierre; Rees, Leigh H.; Vei, Ino C.","Monocyclopentadienyl complexes of niobium, tantalum and tungsten containing heterodifunctional P,O ligands","New Journal of Chemistry","2003","27","1","32","38","10.1039/b202983a","","","0.71069","MoKα","","","0.0515","","","","0.0543","","","","","","0.8072","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050399","5.0566","0.0007","14.156","0.002","28.558","0.004","90","","93.492","0.008","90","","2040.4","0.5","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 N O5 S -","- C23 H25 N O5 S -","- C92 H100 N4 O20 S4 -","4","1","","Fedorov, Yu. V.; Fedorova, O. A.; Andryukhina, E. N.; Gromov, S. P.; Alfimov, M. V.; Kuzmina, L. G.; Churakov, A. V.; Howard, J. A. K.; Aaron, J.-J.","Ditopic complex formation of the crown-containing 2-styrylbenzothiazole","New Journal of Chemistry","2003","27","2","280","","10.1039/b205305e","","","0.71073","MoKα","","0.1213","0.0522","","0.1372","0.1046","","","","1.005","1.116","1.116","","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050400","9.431","0.0005","11.654","0.0006","13.4464","0.0007","88.27","0.003","81.119","0.003","76.369","0.003","1419","0.13","102","2","102","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H28 Ag2 N4 O11 S -","- C25 H28 Ag2 N4 O11 S -","- C50 H56 Ag4 N8 O22 S2 -","2","1","","Fedorov, Yu. V.; Fedorova, O. A.; Andryukhina, E. N.; Gromov, S. P.; Alfimov, M. V.; Kuzmina, L. G.; Churakov, A. V.; Howard, J. A. K.; Aaron, J.-J.","Ditopic complex formation of the crown-containing 2-styrylbenzothiazole","New Journal of Chemistry","2003","27","2","280","","10.1039/b205305e","","","0.71073","MoKα","","0.108","0.055","","0.1278","0.1062","","","","1.011","1.116","1.116","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050401","16.81","0.003","17.682","0.003","24.199","0.004","90","0.014","90","0.014","90","0.014","7193","2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H38 Cl Fe3 N2 O24 -","- C22 H34 Cl Fe3 N2 O24 -","- C176 H272 Cl8 Fe24 N16 O192 -","8","1","","Supriya, Sabbani; Das, Samar K.","A cyclic (H <sub>2</sub> O) <sub>4</sub> cluster characterized in the solid state disappears on heating and regenerates from water vapor: A supramolecular reversible gas–solid reaction","New J. Chem.","2003","27","11","1568","1574","10.1039/B303539P","","","","","","","","","","","","","","","","","","","","","has coordinates","282903","2023-04-28","12:31:17",""
"7050402","14.816","0.003","17.296","0.004","18.66","0.005","90","","106.21","0.03","90","","4592","2","293","2","293","2","","","","","","","synthesis","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H52 Cl2 N2 P2 Ru -","- C51 H52 Cl2 N2 P2 Ru -","- C204 H208 Cl8 N8 P8 Ru4 -","4","0.5","","Crochet, Pascale; Gimeno, José; Borge, Javier; García-Granda, Santiago","Novel ruthenium(ii) complexes containing imino- or aminophosphine ligands for catalytic transfer hydrogenation","New Journal of Chemistry","2003","27","2","414","","10.1039/b206119h","","","0.71073","MoKα","","0.0655","0.0414","","","0.1069","0.1175","","","","","","1.049","","","","has coordinates,has disorder","180058","2020-10-21","18:00:00",""
"7050403","14.539","0.003","12.62","0.002","12.114","0.003","90","","103.4","0.01","90","","2162.2","0.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H10 Mn2 Mo N12 O2 -","- C16 H10 Mn2 Mo N12 O2 -","- C64 H40 Mn8 Mo4 N48 O8 -","4","0.5","","Herrera, Juan Manuel; Armentano, Donatella; de Munno, Giovanni; Lloret, Francesc; Julve, Miguel; Verdaguer, Michel","[Mnii2(bpym)(H2O)8]4+ and [Miv(CN)8]4‒ (M = Mo and W) as building blocks in designing bpym- and cyanide-bridged bimetallic three-dimensional networks (bpym = 2,2'-bipyrimidine)Electronic supplementary information (ESI) available: χMT vs. T for 2. See http://www.rsc.org/suppdata/nj/b2/b206124b/","New Journal of Chemistry","2003","27","1","128","","10.1039/b206124b","","","0.71073","MoKα","","0.0386","0.0326","","","0.0859","0.0877","","","","","","0.997","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050404","14.542","0.002","12.608","0.002","12.126","0.002","90","","103.46","0.01","90","","2162.2","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H10 Mn2 N12 O2 W -","- C16 H10 Mn2 N12 O2 W -","- C64 H40 Mn8 N48 O8 W4 -","4","0.5","","Herrera, Juan Manuel; Armentano, Donatella; de Munno, Giovanni; Lloret, Francesc; Julve, Miguel; Verdaguer, Michel","[Mnii2(bpym)(H2O)8]4+ and [Miv(CN)8]4‒ (M = Mo and W) as building blocks in designing bpym- and cyanide-bridged bimetallic three-dimensional networks (bpym = 2,2'-bipyrimidine)Electronic supplementary information (ESI) available: χMT vs. T for 2. See http://www.rsc.org/suppdata/nj/b2/b206124b/","New Journal of Chemistry","2003","27","1","128","","10.1039/b206124b","","","0.71073","MoKα","","0.0263","0.0244","","","0.0608","0.0613","","","","","","1.002","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050405","11.0831","0.0004","12.6428","0.0005","18.4421","0.0007","88.638","0.0011","88.8047","0.0011","68.2782","0.0012","2399.76","0.16","113","","113","","","","","","","","","6","P -1","-P 1","2","","","","- C48 H76 N P3 Ru Si2 -","- C48 H75 N P3 Ru Si2 -","- C96 H150 N2 P6 Ru2 Si4 -","2","1","","Lori A. Watson; Joseph N. Coalter III; Oleg Ozerov; Maren Pink; John C. Huffman; Kenneth G. Caulton","Amido/phosphine pincer hydrides of ruthenium","New J. Chem.","2003","27","2","263","273","10.1039/b206202j","","","0.71073","MoKα","","","0.0461","","","","0.0379","","","","","","0.7811","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050406","14.8336","0.0003","13.018","0.0003","31.9522","0.0007","90","","90","","90","","6170.1","0.2","113","2","113","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C22 H56 Cl N P2 Ru Si2 -","- C22 H56 Cl N P2 Ru Si2 -","- C176 H448 Cl8 N8 P16 Ru8 Si16 -","8","1","","Lori A. Watson; Joseph N. Coalter III; Oleg Ozerov; Maren Pink; John C. Huffman; Kenneth G. Caulton","Amido/phosphine pincer hydrides of ruthenium","New J. Chem.","2003","27","2","263","273","10.1039/b206202j","","","0.71073","MoKα","","0.0506","0.0305","","","0.0685","0.0776","","","","","","1.086","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050407","26.831","0.004","5.9583","0.0008","16.576","0.002","90","","99.967","0.003","90","","2610","0.6","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H15 N2 O2.5 S -","- C13 H15 N2 O2.5 S -","- C104 H120 N16 O20 S8 -","8","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0428","0.0384","","","0.092","0.0943","","","","","","1.212","","","","has coordinates","274641","2022-04-22","16:38:19",""
"7050408","30.505","0.002","8.0095","0.0005","27.3093","0.0018","90","","123.815","0.003","90","","5543.8","0.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H30 N4 O5 S2 Zn -","- C27 H30 N4 O5 S2 Zn -","- C216 H240 N32 O40 S16 Zn8 -","8","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0754","0.0474","","","0.0961","0.107","","","","","","1.07","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7050409","8.2956","0.0008","9.7213","0.001","13.0352","0.0013","93.193","0.004","95.817","0.004","107.145","0.004","995.27","0.17","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H12 F6 N4 O4 S2 Zn -","- C14 H12 F6 N4 O4 S2 Zn -","- C28 H24 F12 N8 O8 S4 Zn2 -","2","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0309","0.0272","","","0.0664","0.0685","","","","","","1.064","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7050410","7.9725","0.0002","9.4317","0.0002","14.7462","0.0004","81.984","0.001","81.13","0.001","81.744","0.001","1076.38","0.05","105","2","105","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H16 F6 N4 O4 S2 Zn -","- C16 H16 F6 N4 O4 S2 Zn -","- C32 H32 F12 N8 O8 S4 Zn2 -","2","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.032","0.0299","","","0.0835","0.0853","","","","","","1.073","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7050411","13.9278","0.0001","16.1724","0.0001","16.418","0.0001","92.1781","0.0003","104.258","0.0003","103.091","0.0003","3473.77","0.04","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C57 H66 Cl6 Cu3 N20 O6 -","- C57 H66 Cl6 Cu3 N20 O6 -","- C114 H132 Cl12 Cu6 N40 O12 -","2","1","","de Hoog, Paul; Gamez, Patrick; Roubeau, Olivier; Lutz, Martin; Driessen, Willem L.; Spek, Anthony L.; Reedijk, Jan","Novel zigzag 1D coordination polymer from copper(ii) chloride and N,N'-{2,4-di[(di-pyridin-2-yl)amine]-1,3,5-triazine}ethylenediamine exhibiting ferromagnetic interactions","New Journal of Chemistry","2003","27","1","18","","10.1039/b206344a","","","0.71073","MoKα","","0.0551","0.0439","","","0.128","0.134","","","","","","1.097","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050412","10.017","0.001","9.245","0.002","11.062","0.001","90","","112.073","0.007","90","","949.3","0.2","296.2","","296.2","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H30 O2 -","- C22 H30 O2 -","- C44 H60 O4 -","2","1","","Banwell, Martin G.; Hockless, David C. R.; McLeod, Malcolm D.","Chemoenzymatic total syntheses of the sesquiterpene (‒)-patchoulenoneAspects of this work have been reported in preliminary form: M. Banwell and M. McLeod, Chem. Commun., 1998, 1851.","New Journal of Chemistry","2003","27","1","50","","10.1039/b206372g","","","1.5418","CuKα","","0.108","0.0417","","0.0394","","0.0329","","","1.511","","","1.79","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050413","41.966","0.001","34.575","0.001","9.741","0.001","90","","90","","90","","14133.9","1.5","173","","173","","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C35 H32 Fe N2 O5 P2 -","- C35 H27 Fe N2 O5 P2 -","- C560 H432 Fe16 N32 O80 P32 -","16","1","","Braunstein, Pierre; Clerc, Guislaine; Morise, Xavier","Cyclopropanation and Diels‒Alder reactions catalyzed by the first heterobimetallic complexes with bridging phosphinooxazoline ligands","New Journal of Chemistry","2003","27","1","68","72","10.1039/b206410n","","","0.71073","Mo-Kα","","0.085","0.046","","0.106","","0.079","","","1.802","","","1.361","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7050414","24.4623","0.0007","14.3872","0.0006","12.4708","0.0004","90","","111.598","0.004","90","","4080.9","0.3","173","","173","","","","","","","","","10","C 1 2/m 1","-C 2y","12","Compound 2 1.5 CH2Cl2","","","- C73 H70 B2 Cl6 Cu2 F8 Fe2 N4 O10 P4 -","- C68.5 H64 B Cl3 Cu F6 Fe N4 O7 P4 -","- C137 H128 B2 Cl6 Cu2 F12 Fe2 N8 O14 P8 -","2","0.25","","Braunstein, Pierre; Clerc, Guislaine; Morise, Xavier","Cyclopropanation and Diels‒Alder reactions catalyzed by the first heterobimetallic complexes with bridging phosphinooxazoline ligands","New Journal of Chemistry","2003","27","1","68","72","10.1039/b206410n","","","0.71073","Mo-Kα","","0.066","0.046","","0.062","","0.057","","","1.254","","","1.153","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050415","14.582","0.004","15.677","0.005","25.158","0.008","87.217","0.006","75.768","0.006","78.204","0.007","5457","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C102 H106 Cl4 Cu4 Mn2 N22 O29 -","- C102 H100 Cl4 Cu4 Mn2 N22 O29 -","- C204 H200 Cl8 Cu8 Mn4 N44 O58 -","2","1","","Liu, Zhi-Liang; Li, Li-Cun; Zhang, Lei; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping","A novel heterospin polynuclear complex containing both macrocyclic and imino nitroxide radical ligands: {[CuL(H2O)](CuL)Mn(IM-2Py)}{[CuL(MeOH)](CuL)Mn(IM-2Py)}(ClO4)4·MeOH","New Journal of Chemistry","2003","27","3","583","","10.1039/b206475h","","","0.71073","MoKα","","0.3005","0.0834","","","0.1701","0.2585","","","","","","0.937","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050416","9.983","0.014","11.145","0.014","27.83","0.04","90","","94.836","0.01","90","","3085","7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H36 Cl N5 O8 Ru S -","- C25 H36 Cl N5 O8 Ru S -","- C100 H144 Cl4 N20 O32 Ru4 S4 -","4","1","","Pal, Pankaj K.; Drew, Michael G. B.; Datta, Dipankar","Tuning of intramolecular electron transfer between Ru(ii) and the disulfide bond","New Journal of Chemistry","2003","27","2","197","","10.1039/b206476f","","","0.71073","MoKα","","0.1115","0.0769","","","0.2148","0.2379","","","","","","1.033","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050417","10.046","0.014","12.988","0.017","15.224","0.017","68.989","0.01","75.212","0.01","68.217","0.01","1705","4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H26 Cl2 N6 O9 Ru S2 -","- C30 H24 Cl2 N6 O9 Ru S2 -","- C60 H48 Cl4 N12 O18 Ru2 S4 -","2","1","","Pal, Pankaj K.; Drew, Michael G. B.; Datta, Dipankar","Tuning of intramolecular electron transfer between Ru(ii) and the disulfide bond","New Journal of Chemistry","2003","27","2","197","","10.1039/b206476f","","","0.71073","MoKα","","0.1647","0.0887","","","0.2518","0.2837","","","","","","1.056","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050418","12.759","0.017","17.05","0.02","19.59","0.02","90","","94.377","0.01","90","","4249","9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H28 Cl6 N6 O8 Ru S2 -","- C36 H24 Cl6 N6 O8 Ru S2 -","- C144 H96 Cl24 N24 O32 Ru4 S8 -","4","1","","Pal, Pankaj K.; Drew, Michael G. B.; Datta, Dipankar","Tuning of intramolecular electron transfer between Ru(ii) and the disulfide bond","New Journal of Chemistry","2003","27","2","197","","10.1039/b206476f","","","0.71073","MoKα","","0.1466","0.0784","","","0.2244","0.2547","","","","","","1.05","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050419","8.217","0.005","13.703","0.005","16.31","0.005","90","0.005","92.176","0.005","90","0.005","1835.1","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 Fe2 Mo O6 S2 -","- C16 H10 Fe2 Mo O6 S2 -","- C64 H40 Fe8 Mo4 O24 S8 -","4","1","","Auvray, Nicolas; Braunstein, Pierre; Mathur, Sanjay; Veith, Michael; Shen, Hao; Hüfner, Stefan","Thin films by metal organic deposition of Fe‒Mo‒S molecular clusters: synthesis and crystal structure of [Cp2MoFe2(µ3-S)2(CO)6]","New Journal of Chemistry","2003","27","1","155","","10.1039/b206923g","","","0.71069","MoKα","","0.0522","0.032","","","0.1018","0.1091","","","","","","0.94","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050420","6.9118","0.0002","8.1756","0.0002","21.0256","0.0005","90","","90","","90","","1188.12","0.05","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H20 Cl2 N2 -","- C9 H20 Cl2 N2 -","- C36 H80 Cl8 N8 -","4","1","","Bolm, Carsten; Schiffers, Ingo; Atodiresei, Iuliana; Ozcubukcu, Salih; Raabe, Gerhard","A novel asymmetric synthesis of highly enantiomerically enriched norbornane-type diamine derivatives","New Journal of Chemistry","2003","27","1","14","","10.1039/b206943c","","","0.71073","MoKα","","0.062","0.043","","0.212","","0.048","","","4.385","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050421","5.9188","0.0017","12.03","0.004","11.026","0.003","90","","104.17","0.02","90","","761.2","0.4","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Compound 2","","- C10 H7 N -","- C10 H7 N -","- C40 H28 N4 -","4","1","","Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B.","Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/","New Journal of Chemistry","2003","27","1","140","","10.1039/b206946f","","","1.5412","CuKα","","0.0658","0.0498","","","0.1252","0.1359","","","","","","1.055","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050422","3.878","0.0011","5.947","0.0012","15.8","0.005","90","","93.46","0.03","90","","363.72","0.17","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Compound 3","","- C10 H5 F -","- C10 H5 F -","- C20 H10 F2 -","2","0.5","","Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B.","Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/","New Journal of Chemistry","2003","27","1","140","","10.1039/b206946f","","","1.54178","CuKα","","0.0599","0.0453","","","0.1141","0.1215","","","","","","1.112","","","","has coordinates,has disorder","180058","2020-10-21","18:00:00",""
"7050423","3.8535","0.0007","5.906","0.001","16.221","0.005","90","","95.23","0.03","90","","367.63","0.15","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Compound 4","","- C10 H4 F2 -","- C10 H4 F2 -","- C20 H8 F4 -","2","0.5","","Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B.","Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/","New Journal of Chemistry","2003","27","1","140","","10.1039/b206946f","","","1.54178","CuKα","","0.0303","0.028","","","0.071","0.073","","","","","","1.144","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050424","5.7642","0.0009","11.4632","0.0018","6.112","0.001","90","","99.27","0.02","90","","398.58","0.11","180","2","180","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","Compound 5","","- C10 H2 F4 -","- C10 H2 F4 -","- C20 H4 F8 -","2","0.5","","Khan, Muhammad S.; Al-Mandhary, Muna R. A.; Al-Suti, Mohammed K.; Corcoran, Timothy C.; Al-Mahrooqi, Yaqoub; Attfield, J. Paul; Feeder, Neil; David, William I. F.; Shankland, Kenneth; Friend, Richard H.; Köhler, Anna; Marseglia, Elisabeth A.; Tedesco, Emilio; Tang, Chiu C.; Raithby, Paul R.; Collings, Jonathan C.; Roscoe, Karl P.; Batsanov, Andrei S.; Stimson, Lorna M.; Marder, Todd B.","Synthesis and optical characterisation of platinum(ii) poly-yne polymers incorporating substituted 1,4-diethynylbenzene derivatives and an investigation of the intermolecular interactions in the diethynylbenzene molecular precursorsElectronic supplementary information (ESI) available: atomic cooordinates for 6 and 7. See http://www.rsc.org/suppdata/nj/b2/b206946f/","New Journal of Chemistry","2003","27","1","140","","10.1039/b206946f","","","1.54178","CuKα","","0.078","0.0353","","","0.0717","0.0834","","","","","","1.086","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050425","15.32","0.03","20.7","0.03","18.71","0.03","90","","96.19","0.01","90","","5899","17","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C28.5 H25 Cl2 Cu N6 O4 -","- C28.5 H25 Cl2 Cu N6 O4 -","- C228 H200 Cl16 Cu8 N48 O32 -","8","2","","Chowdhury, Shubhamoy; Iveson, Peter B.; Drew, Michael G. B.; Tocher, Derek A.; Datta, Dipankar","A novel copper(i) complex that is a monomeric single helix in solid state but a dimeric double helix in solution","New Journal of Chemistry","2003","27","2","193","","10.1039/b207057j","","","0.71073","MoKα","","0.2344","0.0907","","","0.1916","0.2517","","","","","","1.008","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050426","28.01","0.04","15.3","0.02","20.37","0.03","90","","127.937","0.01","90","","6885","17","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H28 Ag Cl N6 O6 -","- C28 H24 Ag Cl N6 O5.98 -","- C224 H192 Ag8 Cl8 N48 O47.84 -","8","1","","Chowdhury, Shubhamoy; Iveson, Peter B.; Drew, Michael G. B.; Tocher, Derek A.; Datta, Dipankar","A novel copper(i) complex that is a monomeric single helix in solid state but a dimeric double helix in solution","New Journal of Chemistry","2003","27","2","193","","10.1039/b207057j","","","0.71073","MoKα","","0.1298","0.0756","","","0.2224","0.2586","","","","","","1.017","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050427","10.5048","0.0008","10.1302","0.0006","18.3692","0.0013","90","","104.724","0.009","90","","1890.6","0.2","200","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,2-bis(1H-benzimidazolonium-2-yl)ethane tetrachlorocobaltate(II)","","- C16 H16 Cl4 Co N4 -","- C16 H16 Cl4 Co N4 -","- C64 H64 Cl16 Co4 N16 -","4","0.5","","Matthews, Craig J.; Broughton, Vanessa; Bernardinelli, Gérald; Melich, Xavier; Brand, Guy; Willis, Anthony C.; Williams, Alan F.","Molecular bricklaying: the protonated benzimidazole moiety as a synthon for crystal engineering","New Journal of Chemistry","2003","27","2","354","","10.1039/b207073a","","","0.71073","MoKα","","","0.033","","","","0.039","","","","","","1.942","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050428","10.6142","0.0006","10.2541","0.0009","18.4091","0.0011","90","","105.005","0.007","90","","1935.3","0.2","250","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,2-bis(1H-benzimidazolonium-2-yl)ethane tetrachloromanganate(II)","","- C16 H16 Cl4 Mn N4 -","- C16 H16 Cl4 Mn N4 -","- C64 H64 Cl16 Mn4 N16 -","4","0.5","","Matthews, Craig J.; Broughton, Vanessa; Bernardinelli, Gérald; Melich, Xavier; Brand, Guy; Willis, Anthony C.; Williams, Alan F.","Molecular bricklaying: the protonated benzimidazole moiety as a synthon for crystal engineering","New Journal of Chemistry","2003","27","2","354","","10.1039/b207073a","","","0.71073","MoKα","","","0.028","","","","0.032","","","","","","1.463","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050429","17.1984","0.0013","17.9232","0.0009","7.1133","0.0005","90","","101.599","0.008","90","","2147.9","0.3","200","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","1,2-bis(1H-benzimidazolonium-2-yl)ethane tetrachlorocuprate(II) methanol solvate.","","- C17 H20 Cl4 Cu N4 O -","- C17 H20 Cl4 Cu N4 O -","- C68 H80 Cl16 Cu4 N16 O4 -","4","1","","Matthews, Craig J.; Broughton, Vanessa; Bernardinelli, Gérald; Melich, Xavier; Brand, Guy; Willis, Anthony C.; Williams, Alan F.","Molecular bricklaying: the protonated benzimidazole moiety as a synthon for crystal engineering","New Journal of Chemistry","2003","27","2","354","","10.1039/b207073a","","","0.71073","MoKα","","","0.035","","","","0.036","","","","","","1.791","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050430","7.6181","0.0005","14.6719","0.0007","18.3996","0.0013","90","","93.294","0.008","90","","2053.2","0.2","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,2-bis(1H-benzimidazolonium-2-yl)propane tetrachlorocobaltate(II)","","- C17 H18 Cl4 Co N4 -","- C17 H18 Cl4 Co N4 -","- C68 H72 Cl16 Co4 N16 -","4","1","","Matthews, Craig J.; Broughton, Vanessa; Bernardinelli, Gérald; Melich, Xavier; Brand, Guy; Willis, Anthony C.; Williams, Alan F.","Molecular bricklaying: the protonated benzimidazole moiety as a synthon for crystal engineering","New Journal of Chemistry","2003","27","2","354","","10.1039/b207073a","","","0.71073","MoKα","","","0.026","","","","0.028","","","","","","1.372","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050431","18.468","0.003","7.214","0.002","15.603","0.003","90","","91.87","0.02","90","","2077.7","0.8","296.2","","296.2","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 N2 O -","- C12 H12 N2 O -","- C96 H96 N16 O8 -","8","1","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.7107","MoKα","","0.0486","0.049","","0.061","","0.061","","","2.809","","","2.81","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050432","10.1248","0.0007","17.625","0.002","11.9239","0.0012","90","","90","0.3","90","","2127.8","0.4","273.2","","273.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H12 N2 O -","- C12 H12 N2 O -","- C96 H96 N16 O8 -","8","1","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.5608","AgKα","","0.0638","0.064","","0.053","","0.053","","","1.682","","","1.68","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050433","9.674","0.003","16.94","0.004","6.157","0.001","90","","101.6","0.02","90","","988.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C12 H16 Fe2 N4 O13 -","- C12 H6 Fe2 N4 O13 -","- C24 H12 Fe4 N8 O26 -","2","0.25","","Armentano, Donatella; de Munno, Giovanni; Lloret, Francesc; Julve, Miguel; Curély, Jacques; Babb, Amy M.; Lu, Jack Y.","Oxalate and 2,2'-bipyrimidine as bis-chelating ligands in the honeycomb layered compound {[Fe2(bpym)(ox)2]·5H2O}n","New Journal of Chemistry","2003","27","1","161","","10.1039/b207241f","","","0.71073","MoKα","","0.068","0.0482","","","0.1006","0.1092","","","","","","1.043","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050434","12.688","0.0018","12.853","0.011","18.6","0.03","72.04","0.09","79.76","0.12","62.95","0.09","2567","5","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C12 H37 Mo12 N6 O49 P -","- C12 H15 Mo12 N6 O49 P -","- C24 H30 Mo24 N12 O98 P2 -","2","1","","Vitoria, Pablo; Ugalde, María; Gutiérrez-Zorrilla, Juan M.; Román, Pascual; Luque, Antonio; San Felices, Leire; García-Tojal, Javier","Organic‒inorganic hybrids based on four-electron reduced Keggin β-isomer phosphododecamolybdates and diazines","New Journal of Chemistry","2003","27","2","399","","10.1039/b207243b","","x-ray","0.7107","MoKα","","0.0553","0.0482","","","0.132","0.1343","","","","","","1.214","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050435","17.149","0.003","12.0363","0.0017","27.041","0.005","90","","107.92","0.02","90","","5310.8","1.7","293","2","","","","","","","","","see text","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H39 Mo12 N6 O50 P -","- C12 H14 Mo12 N6 O50 P -","- C48 H56 Mo48 N24 O200 P4 -","4","1","","Vitoria, Pablo; Ugalde, María; Gutiérrez-Zorrilla, Juan M.; Román, Pascual; Luque, Antonio; San Felices, Leire; García-Tojal, Javier","Organic‒inorganic hybrids based on four-electron reduced Keggin β-isomer phosphododecamolybdates and diazines","New Journal of Chemistry","2003","27","2","399","","10.1039/b207243b","","","0.71073","MoKα","","","0.1056","","","","0.2872","","","","","","1.049","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050436","10.182","0.001","21.356","0.003","21.703","0.003","90","","100.55","0.01","90","","4639.5","1","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H27 Mo12 N5 O45 P -","- C10 H12 Mo12 N5 O45 P -","- C40 H48 Mo48 N20 O180 P4 -","4","1","","Vitoria, Pablo; Ugalde, María; Gutiérrez-Zorrilla, Juan M.; Román, Pascual; Luque, Antonio; San Felices, Leire; García-Tojal, Javier","Organic‒inorganic hybrids based on four-electron reduced Keggin β-isomer phosphododecamolybdates and diazines","New Journal of Chemistry","2003","27","2","399","","10.1039/b207243b","","x-ray","0.7107","MoKα","","0.0691","0.0494","","","0.1336","0.1393","","","","","","1.092","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050437","19.4095","0.0004","24.4145","0.0005","15.8976","0.0002","90","","109.026","0.001","90","","7121.9","0.2","123","1","123","1","","","","","","","see text","3","C 1 2 1","C 2y","5","","","","- C97 H208 O97 -","- C97 H158 O96.5 -","- C194 H316 O193 -","2","0.5","","Braga, Susana S.; Gonçalves, Isabel S.; Herdtweck, E.; Teixeira-Dias, José J. C.","Solid state inclusion compound of S-ibuprofen in β-cyclodextrin: structure and characterisationElectronic supplementary information (ESI) available: crystal and data collection parameters and relevant O⋯O contacts (divided in six different groups) for βCD∶S-Ibu. See: http://www.rsc.org/suppdata/nj/b2/b207272f/","New Journal of Chemistry","2003","27","3","597","","10.1039/b207272f","","","0.71073","MoKα","","0.0726","0.0717","","","0.1951","0.1968","","","","","","1.022","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050438","7.465","0.0015","7.8137","0.0016","9.6921","0.0019","73.16","0.004","68.71","0.003","87.818","0.004","502.73","0.18","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H30 N2 O14 -","- C12 H30 N2 O14 -","- C12 H30 N2 O14 -","1","0.5","","Calleja, Maria; Mason, Sax A.; Prince, Paul D.; Steed, Jonathan W.; Wilkinson, Clive","Anisotropic thermal expansion in 18-crown-6·2 H2O·2 HNO3","New Journal of Chemistry","2003","27","1","28","","10.1039/b207292k","","","0.71073","MoKα","","0.0493","0.0367","","","0.0803","0.084","","","","","","1.054","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050439","7.56","0.0015","7.9619","0.0015","9.7801","0.0017","73.314","0.006","67.323","0.007","87.935","0.008","518.44","0.17","250","2","250","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H30 N2 O14 -","- C12 H30 N2 O14 -","- C12 H30 N2 O14 -","1","0.5","","Calleja, Maria; Mason, Sax A.; Prince, Paul D.; Steed, Jonathan W.; Wilkinson, Clive","Anisotropic thermal expansion in 18-crown-6·2 H2O·2 HNO3","New Journal of Chemistry","2003","27","1","28","","10.1039/b207292k","","neutron","0.839","neutron","","0.0534","0.0352","","","0.0683","0.0772","","","","","","1.091","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050440","14.806","0.003","19.827","0.004","12.186","0.003","92.49","0.01","113.65","0.02","81.35","0.01","3239","1.3","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","?","- C73 H72 Cl3 N4 O4 -","- C146 H144 Cl6 N8 O8 -","2","1","","Simaan, Samah; Agbaria, Kasim; Thondorf, Iris; Biali, Silvio E.","Conformation of syn- and anti-phenylquinazoline calix[4]arene diethers","New Journal of Chemistry","2003","27","2","236","","10.1039/b207533d","","","0.7107","MoKalpha","","","0.095","","","0.108","","","","","3.11","3.11","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050441","13.031","0.005","13.368","0.005","11.333","0.004","108.68","0.02","111.11","0.02","61.57","0.02","1592.7","1.1","293.2","","293.2","","","","","","","","","5","P -1","-P 1","2","","","","?","- C37 H36 Cl2 N2 O2 -","- C74 H72 Cl4 N4 O4 -","2","1","","Simaan, Samah; Agbaria, Kasim; Thondorf, Iris; Biali, Silvio E.","Conformation of syn- and anti-phenylquinazoline calix[4]arene diethers","New Journal of Chemistry","2003","27","2","236","","10.1039/b207533d","","","0.7107","MoKalpha","","","0.089","","","0.116","","","","","2.11","2.11","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050442","23.363","0.0001","8.554","0.0001","10.984","0.0002","90","","90","","90","","2195.12","0.05","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C17 H30 Cl F4 N Ni P2 -","- C17 H30 Cl F4 N Ni P2 -","- C68 H120 Cl4 F16 N4 Ni4 P8 -","4","1","","Sladek, Marianna I.; Braun, Thomas; Neumann, Beate; Stammler, Hans-Georg","3-Fluoropyridyl nickel complexes as useful tools for the selective synthesis of new 2,4,5,6-tetrafluoropyridines: a route complementing the established methods to access fluorinated pyridines","New Journal of Chemistry","2003","27","2","313","","10.1039/b207943g","","","0.71073","MoKα","","0.0216","0.0205","","","0.0508","0.0513","","","","","","1.042","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050443","23.461","0.0003","8.722","0.0004","10.868","0.0009","90","","90","","90","","2223.9","0.2","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C18 H33 F4 N Ni P2 -","- C18 H33 F4 N Ni P2 -","- C72 H132 F16 N4 Ni4 P8 -","4","1","","Sladek, Marianna I.; Braun, Thomas; Neumann, Beate; Stammler, Hans-Georg","3-Fluoropyridyl nickel complexes as useful tools for the selective synthesis of new 2,4,5,6-tetrafluoropyridines: a route complementing the established methods to access fluorinated pyridines","New Journal of Chemistry","2003","27","2","313","","10.1039/b207943g","","","0.71073","MoKα","","0.0521","0.0337","","","0.0762","0.0846","","","","","","1.087","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050444","14.65","0.003","16.525","0.003","18.089","0.004","90","","90","","90","","4379.2","1.5","294","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H18 I3 P -","- C19 H18 I3 P -","- C152 H144 I24 P8 -","8","1","","Chow, Hong; Dean, Philip A. W.; Craig, Donald C.; Lucas, Nigel T.; Scudder, Marcia L.; Dance, Ian G.","The subtle tetramorphism of MePh3P+I3‒","New Journal of Chemistry","2003","27","4","704","","10.1039/b208112a","","","0.71073","MoKα","","","0.046","","","","0.05","","","","","","1.32","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050445","11.957","0.007","12.089","0.008","16.199","0.009","87.5","0.03","75.27","0.03","69.4","0.03","2117","2","294","","","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H18 I3 P -","- C19 H18 I3 P -","- C76 H72 I12 P4 -","4","2","","Chow, Hong; Dean, Philip A. W.; Craig, Donald C.; Lucas, Nigel T.; Scudder, Marcia L.; Dance, Ian G.","The subtle tetramorphism of MePh3P+I3‒","New Journal of Chemistry","2003","27","4","704","","10.1039/b208112a","","","0.71073","MoKα","","","0.048","","","","0.062","","","","","","1.62","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050446","19.77","0.008","11.978","0.003","18.715","0.008","90","","107.1","0.03","90","","4236","3","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 I3 P -","- C19 H18 I3 P -","- C152 H144 I24 P8 -","8","2","","Chow, Hong; Dean, Philip A. W.; Craig, Donald C.; Lucas, Nigel T.; Scudder, Marcia L.; Dance, Ian G.","The subtle tetramorphism of MePh3P+I3‒","New Journal of Chemistry","2003","27","4","704","","10.1039/b208112a","","","0.71073","MoKα","","","0.068","","","","0.083","","","","","","1.84","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050447","11.9142","0.0007","37.93","0.002","11.4083","0.0007","90","","115.129","0.001","90","","4667.5","0.5","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H66 O13 Ti3 -","- C38 H66 O13 Ti3 -","- C152 H264 O52 Ti12 -","4","1","","Mijatovic, Ivan; Kickelbick, Guido; Puchberger, Michael; Schubert, Ulrich","Preservation of the cluster core upon formation of Ti3O(OPri)8(benzoate)2 from Ti3O(OR)10","New Journal of Chemistry","2003","27","1","3","","10.1039/b208255a","","","0.71073","MoKα","","0.0655","0.0517","","","0.1178","0.1242","","","","","","1.061","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050448","43.363","0.0016","5.873","0.0002","16.173","0.0008","90","","100.367","0.002","90","","4051.6","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H27 N3 S16 -","- C29 H27 N3 S16 -","- C116 H108 N12 S64 -","4","0.5","","Bouguessa, Sabrina; Hervé, Katel; Golhen, Stéphane; Ouahab, Lahcène; Fabre, Jean-Marc","Synthesis, redox behaviour and X-ray structure of bis-TTF containing a pyridine unit as a potential building block in the construction of conducting magnetic materials","New Journal of Chemistry","2003","27","3","560","","10.1039/b208624g","","","0.71073","MoKα","","0.1155","0.0647","","","0.1784","0.2141","","","","","","1.044","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050449","13.389","0.0014","16.3111","0.0016","10.999","0.0011","90","","91.352","0.002","90","","2401.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H48 Cu3 N8 O18 -","- C42 H48 Cu3 N8 O18 -","- C84 H96 Cu6 N16 O36 -","2","0.5","","Sain, Saugata; Kumar Maji, Tapas; Mostafa, Golam; Lu, Tian-Huey; Ray Chaudhuri, Nirmalendu","A novel layered and pillared topology in a 3D open framework: synthesis, crystal structure and magnetic propertiesElectronic supplementary information (ESI) available: Fig. S1: showing the brick-walled shaped view of the [{Cu3(malonate)2(H2O)2}]n layer; Fig. S2: space-filled diagram showing channels viewed down x-axis. See http://www.rsc.org/suppdata/nj/b2/b208650f/","New Journal of Chemistry","2003","27","2","185","","10.1039/b208650f","","","0.71073","MoKα","","0.109","0.0479","","","0.0965","0.111","","","","","","0.891","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050450","6.8309","0.0005","16.047","0.0013","22.8001","0.0011","90","","90","","90","","2499.2","0.3","180","2","180","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","CTA/An","cyclohexane-1,3cis,5cis-tricaboxylic acid‒acetonitrile(1/1)'","","- C11 H15 N O6 -","- C11 H15 N O6 -","- C88 H120 N8 O48 -","8","1","","Shan, Ning; Bond, Andrew D.; Jones, William","Supramolecular architectures of cyclohexane-1, 3cis, 5cis-tricarboxylic acid in acid∶base complexes","New Journal of Chemistry","2003","27","2","365","","10.1039/b208686g","","","0.71069","MoKα","","0.095","0.0535","","","0.1164","0.1369","","","","","","1.04","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050451","8.8501","0.0005","11.0316","0.0008","11.8635","0.0007","90.185","0.003","95.174","0.004","92.475","0.004","1152.42","0.13","180","2","180","2","","","","","","","","4","P -1","-P 1","2","CTA/oPh/2MeOH","cyclohexane-1,3cis,5cis-tricaboxylic acid‒ 1,10-phenathroline‒methonal(1/1/2)'","","- C23 H28 N2 O8 -","- C23 H28 N2 O8 -","- C46 H56 N4 O16 -","2","1","","Shan, Ning; Bond, Andrew D.; Jones, William","Supramolecular architectures of cyclohexane-1, 3cis, 5cis-tricarboxylic acid in acid∶base complexes","New Journal of Chemistry","2003","27","2","365","","10.1039/b208686g","","","0.71073","MoKα","","0.0601","0.0448","","","0.111","0.1216","","","","","","1.016","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050452","5.625","0.0002","23.8851","0.0018","11.2217","0.0009","90","","100.109","0.005","90","","1484.27","0.17","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","CTA/APY","cyclohexane-1,3cis,5cis-tricaboxylic acid‒ 2-aminopyrimidine (1/1)","","- C13 H17 N3 O6 -","- C13 H17 N3 O6 -","- C52 H68 N12 O24 -","4","1","","Shan, Ning; Bond, Andrew D.; Jones, William","Supramolecular architectures of cyclohexane-1, 3cis, 5cis-tricarboxylic acid in acid∶base complexes","New Journal of Chemistry","2003","27","2","365","","10.1039/b208686g","","","0.71073","MoKα","","0.0697","0.0445","","","0.1021","0.1116","","","","","","1.025","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050453","10.9547","0.0004","14.4867","0.0006","10.4289","0.0004","90","","93.987","0.002","90","","1651.03","0.11","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","CTA/HMTA","cyclohexane-1,3cis,5cis-tricaboxylic acid‒ hexamethylenetetramine(1/1)","","- C15 H24 N4 O6 -","- C15 H24 N4 O6 -","- C60 H96 N16 O24 -","4","1","","Shan, Ning; Bond, Andrew D.; Jones, William","Supramolecular architectures of cyclohexane-1, 3cis, 5cis-tricarboxylic acid in acid∶base complexes","New Journal of Chemistry","2003","27","2","365","","10.1039/b208686g","","","0.71073","MoKα","","0.0603","0.0449","","","0.124","0.1332","","","","","","1.101","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050454","9.3399","0.0009","11.1211","0.0012","23.606","0.002","89.342","0.012","85.858","0.011","75.866","0.012","2371.5","0.4","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H19 N2 O S -","- C17 H18.3333 N2 O S -","- C102 H110 N12 O6 S6 -","6","3","","Coronado, Eugenio; Giménez-Saiz, Carlos; Nicolas, Mael; Romero, Francisco M.; Rusanov, Eduard; Stoeckli-Evans, Helen","Synthesis, crystal structures and electronic properties of imidazoline nitroxide radicals bearing active groups in electropolymerisation","New Journal of Chemistry","2003","27","3","490","","10.1039/b208762f","","","0.71073","MoKα","","0.1332","0.0538","","","0.1139","0.1344","","","","","","0.789","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050455","10.1447","0.0008","13.1725","0.0008","11.4922","0.0008","90","","114.697","0.008","90","","1395.24","0.19","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H18 N3 O2 -","- C15 H18 N3 O2 -","- C60 H72 N12 O8 -","4","1","","Coronado, Eugenio; Giménez-Saiz, Carlos; Nicolas, Mael; Romero, Francisco M.; Rusanov, Eduard; Stoeckli-Evans, Helen","Synthesis, crystal structures and electronic properties of imidazoline nitroxide radicals bearing active groups in electropolymerisation","New Journal of Chemistry","2003","27","3","490","","10.1039/b208762f","","","0.71073","MoKα","","0.0466","0.03","","","0.0815","0.0921","","","","","","0.654","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050456","23.949","0.002","8.2983","0.0009","12.3808","0.0013","90","","105.442","0.002","90","","2371.7","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H15 N2 O2 S -","- C11 H15 N2 O2 S -","- C88 H120 N16 O16 S8 -","8","1","","Coronado, Eugenio; Giménez-Saiz, Carlos; Nicolas, Mael; Romero, Francisco M.; Rusanov, Eduard; Stoeckli-Evans, Helen","Synthesis, crystal structures and electronic properties of imidazoline nitroxide radicals bearing active groups in electropolymerisation","New Journal of Chemistry","2003","27","3","490","","10.1039/b208762f","","","0.71069","MoKα","","0.0537","0.0439","","","0.1214","0.1316","","","","","","1.032","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050457","6.1174","0.0007","6.6674","0.0007","11.3145","0.0011","90","","90","","90","","461.49","0.08","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C2 H3 Cl O S -","- C2 H3 Cl O S -","- C8 H12 Cl4 O4 S4 -","4","0.5","","Romano, Rosana M.; Della Védova, Carlos O.; Downs, Anthony J.; Parsons, Simon; Smith, Caroline","Structural and vibrational properties of ClC(O)SY compounds with Y = Cl and CH3","New Journal of Chemistry","2003","27","3","514","","10.1039/b209005h","","","0.71073","MoKα","","0.0192","0.0181","","","0.046","0.0466","","","","","","1.12","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050458","6.034","0.003","10.311","0.006","7.226","0.009","90","","99.72","0.06","90","","443.1","0.7","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C Cl2 O S -","- C Cl2 O S -","- C4 Cl8 O4 S4 -","4","1","","Romano, Rosana M.; Della Védova, Carlos O.; Downs, Anthony J.; Parsons, Simon; Smith, Caroline","Structural and vibrational properties of ClC(O)SY compounds with Y = Cl and CH3","New Journal of Chemistry","2003","27","3","514","","10.1039/b209005h","","","0.71073","MoKα","","0.0956","0.066","","","0.165","0.1859","","","","","","1.07","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050459","13.117","0.002","16.848","0.003","13.008","0.006","112.21","0.02","95.65","0.02","83.44","0.01","2639.2","1.4","","","298","","","","","","","","Local laboratory","7","P -1","-P 1","2","","","","- C47 H64 I K N6 O9 S2 -","- C47 H64 I K N6 O9 S2 -","- C94 H128 I2 K2 N12 O18 S4 -","2","1","","Tozawa, Tomokazu; Tachikawa, Tatsuya; Tokita, Sumio; Kubo, Yuji","Chirality induction in a dibenzo-30-crown-10 congener promoted by an ion-pair coordinated self-assembly","New Journal of Chemistry","2003","27","2","221","","10.1039/b209033c","","","0.71073","MoKα","","0.204","0.076","","0.095","0.053","0.03","","","2.513","2.311","2.311","2.311","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050460","11.849","0.007","12.894","0.003","14.747","0.006","66.36","0.03","73.83","0.04","72.44","0.03","1935.5","1.6","295","","295","","","","","","","","?","6","P -1","-P 1","2","","","","- C41 H49 F N2 O7 S -","- C41 H49 F N2 O7 S -","- C82 H98 F2 N4 O14 S2 -","2","1","","Cossy, Janine; Mirguet, Olivier; Pardo, Domingo Gomez; Desmurs, Jean-Roger","Diastereoselective conjugate addition of organocuprates to chiral racemic olefinic amido esters. Formal total synthesis of paroxetine","New Journal of Chemistry","2003","27","3","475","","10.1039/b209181j","","","0.71069","MoKα","","","0.0549","","","0.067","","","","","1.1397","1.1397","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050461","18.963","0.002","10.2805","0.0012","24.556","0.003","90","","100.16","0.002","90","","4712.1","0.9","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H30 B Ir N6 O -","- C23 H30 B Ir N6 O -","- C184 H240 B8 Ir8 N48 O8 -","8","1","","Santos, Laura L.; Mereiter, Kurt; Paneque, Margarita; Slugovc, Christian; Carmona, Ernesto","C‒H bond activation reactions by TpMe2Ir(iii) centres. Generation of Fischer-type carbenes and development of a catalytic system for H/D exchange","New Journal of Chemistry","2003","27","1","107","","10.1039/b209324c","","","0.71073","MoKα","","0.0242","0.0188","","","0.0386","0.04","","","","","","1.094","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050462","5.201","0.0007","8.8753","0.0013","9.2841","0.0013","62.449","0.002","75.388","0.002","81.657","0.003","367.47","0.09","298","2","298","2","","","","","","","","4","P -1","-P 1","2","5-Nitrosalicylic acid","5-Nitrosalicylic acid","","- C7 H5 N O5 -","- C7 H5 N O5 -","- C14 H10 N2 O10 -","2","1","","Senthil Kumar, V. S.; Nangia, Ashwini; Kirchner, Michael T.; Boese, Roland","Supramolecular synthesis of brick wall and honeycomb networks from the T-shaped molecule 5-nitrosalicylic acid","New Journal of Chemistry","2003","27","2","224","","10.1039/b209350b","","","0.71073","MoKα","","0.0615","0.0583","","","0.1693","0.1802","","","","","","1.077","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050463","5.3656","0.0011","22.995","0.005","7.9984","0.0016","90","","90.79","0.03","90","","986.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Dioxane solvate of 5-Nitrosalicylic acid","Dioxane solvate of 5-Nitrosalicylic acid","","- C9 H9 N O6 -","- C9 H9 N O6 -","- C36 H36 N4 O24 -","4","1","","Senthil Kumar, V. S.; Nangia, Ashwini; Kirchner, Michael T.; Boese, Roland","Supramolecular synthesis of brick wall and honeycomb networks from the T-shaped molecule 5-nitrosalicylic acid","New Journal of Chemistry","2003","27","2","224","","10.1039/b209350b","","","0.71073","MoKα","","0.0643","0.0343","","","0.0854","0.1038","","","","","","1.078","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050464","10.358","0.008","7.68","0.005","23.191","0.017","90","","102.903","0.01","90","","1798","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H20 Cu N9 O3 -","- C13 H20 Cu N9 O3 -","- C52 H80 Cu4 N36 O12 -","4","1","","Li, Licun; Liu, Zhiliang; Turner, Scott S.; Liao, Daizheng; Jiang, Zonghui; Yan, Shiping","The first one-dimensional copper(ii)-radical system with alternating double end-on and end-to-end azido bridges","New Journal of Chemistry","2003","27","4","752","","10.1039/b209397a","","","0.71073","MoKα","","0.1377","0.0501","","","0.0836","0.1076","","","","","","0.974","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050465","16.553","0.002","10.5323","0.0015","17.341","0.003","90","","104.43","0.003","90","","2927.9","0.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C27 H22 Co N4 O10 P2 V2 -","- C27 H22 Co N4 O10 P2 V2 -","- C108 H88 Co4 N16 O40 P8 V8 -","4","0.5","","Fu, Rui-Biao; Hu, Sheng-Min; Fu, Zhi-Yong; Zhang, Jian-Jun; Wu, Xin-Tao","Hydrothermal synthesis and crystal structure of two hetero-transition metal polymers: [Co(1,10-phen)2(V2O4) (O3PCH2CH2CH2PO3)]n and [{Co(1,10-phen)2}2(V4O10) (O3PCH2CH2CH2CH2PO3)(2H2O)]n","New Journal of Chemistry","2003","27","2","230","","10.1039/b209564e","","","0.71073","MoKα","","0.094","0.057","","","0.1306","0.1525","","","","","","1.071","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050466","10.2132","0.0003","11.7055","0.0005","12.3666","0.0005","75.594","0.002","82.445","0.002","86.071","0.002","1418.53","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H44 Co2 N8 O18 P2 V4 -","- C52 H40 Co2 N8 O18 P2 V4 -","- C52 H40 Co2 N8 O18 P2 V4 -","1","0.5","","Fu, Rui-Biao; Hu, Sheng-Min; Fu, Zhi-Yong; Zhang, Jian-Jun; Wu, Xin-Tao","Hydrothermal synthesis and crystal structure of two hetero-transition metal polymers: [Co(1,10-phen)2(V2O4) (O3PCH2CH2CH2PO3)]n and [{Co(1,10-phen)2}2(V4O10) (O3PCH2CH2CH2CH2PO3)(2H2O)]n","New Journal of Chemistry","2003","27","2","230","","10.1039/b209564e","","","0.71073","MoKα","","0.0872","0.0567","","","0.1029","0.1197","","","","","","1.106","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050467","11.884","0.001","9.501","0.001","19.445","0.002","90","","105.11","0.02","90","","2119.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 Ag Cl N12 O4 -","- C16 H12 Ag Cl N12 O4 -","- C64 H48 Ag4 Cl4 N48 O16 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia","Silver(i) polymeric coordination frameworks assembled with the new multimodal ligand 2,2'-azobispyrazine","New Journal of Chemistry","2003","27","3","483","","10.1039/b209580g","","","0.71073","MoKα","","0.0272","0.0226","","0.0531","0.0523","","","","0.925","","","","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050468","14.944","0.002","12.364","0.002","15.211","0.003","90","","118.5","0.02","90","","2469.9","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16.5 H13 Ag Cl F6 N12 Sb -","- C16.5 H13 Ag Cl F6 N12 Sb -","- C66 H52 Ag4 Cl4 F24 N48 Sb4 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia","Silver(i) polymeric coordination frameworks assembled with the new multimodal ligand 2,2'-azobispyrazine","New Journal of Chemistry","2003","27","3","483","","10.1039/b209580g","","","0.71073","MoKα","","0.1114","0.046","","0.1125","0.1008","","","","1.258","","","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050469","10.451","0.002","9.45","0.002","24.193","0.006","90","","90","","90","","2389.3","0.9","293","2","293","2","","","","","","","","7","P n 21 a","P -2ac -2n","33","","","","- C8 H8 Ag2 B2 F8 N6 O -","- C8 H6 Ag2 B2 F8 N6 O -","- C32 H24 Ag8 B8 F32 N24 O4 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia","Silver(i) polymeric coordination frameworks assembled with the new multimodal ligand 2,2'-azobispyrazine","New Journal of Chemistry","2003","27","3","483","","10.1039/b209580g","","","0.71073","MoKα","","0.1259","0.0981","","0.2959","0.2773","","","","1.136","","","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050470","7.788","0.0013","14.259","0.002","36.544","0.006","90","","90","","90","","4058.2","1.1","293","2","293","2","","","","","","","","6","P b c 21","P 2c -2b","29","","","","- C24 H18 Ag4 Cl4 N18 O16 -","- C24 H18 Ag4 Cl4 N18 O16 -","- C96 H72 Ag16 Cl16 N72 O64 -","4","1","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.; Rizzato, Silvia","Silver(i) polymeric coordination frameworks assembled with the new multimodal ligand 2,2'-azobispyrazine","New Journal of Chemistry","2003","27","3","483","","10.1039/b209580g","","","0.71073","MoKα","","0.0976","0.0876","","0.2495","0.2403","","","","1.08","","","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050471","28.368","0.005","26.078","0.004","11.095","0.0018","90","","90","","90","","8208","2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C84 H68 La N12 -","- C84 La N12 -","- C336 La4 N48 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.2083","0.0605","","","0.1152","0.1694","","","","","","0.882","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050472","29.062","0.008","26.502","0.007","10.962","0.003","90","","90","","90","","8443","4","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C45 H38 N4 O0.25 Pr0.5 -","- C45 H38 N4 O0.25 Pr0.5 -","- C360 H304 N32 O2 Pr4 -","8","1","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.1196","0.0736","","","0.1714","0.1949","","","","","","1.115","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7050473","28.618","0.008","26.329","0.008","10.987","0.003","90","","90","","90","","8279","4","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C90 H76 N8 Nd O0.5 -","- C88 H72 N8 Nd -","- C352 H288 N32 Nd4 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.1205","0.0843","","","0.1809","0.1973","","","","","","1.186","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7050474","28.55","0.004","26.489","0.003","10.9353","0.0014","90","","90","","90","","8269.9","1.8","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C84 H68 N12 Tb -","- C84 N12 Tb -","- C336 N48 Tb4 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.1155","0.0521","","","0.1153","0.1424","","","","","","0.937","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050475","28.589","0.013","26.655","0.013","10.922","0.005","90","","90","","90","","8323","7","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C84 H68 Dy N12 -","- C84 Dy N12 -","- C336 Dy4 N48 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.2334","0.0475","","","0.0552","0.1017","","","","","","0.701","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050476","28.546","0.005","26.529","0.005","10.915","0.002","90","","90","","90","","8266","3","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C84 H68 Ho N12 -","- C84 Ho N12 -","- C336 Ho4 N48 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.116","0.0622","","","0.1553","0.186","","","","","","0.955","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050477","28.617","0.005","26.626","0.005","10.918","0.002","90","","90","","90","","8319","3","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C84 H68 Er N12 -","- C84 Er N12 -","- C336 Er4 N48 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.131","0.05","","","0.0848","0.1076","","","","","","0.861","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050478","28.632","0.014","26.669","0.013","10.938","0.005","90","","90","","90","","8352","7","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C88 H72 N8 Tm -","- C88 H72 N8 Tm -","- C352 H288 N32 Tm4 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.1013","0.0752","","","0.1885","0.2009","","","","","","1.236","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7050479","28.739","0.006","26.832","0.005","10.866","0.002","90","","90","","90","","8379","3","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C84 H68 N12 Yb -","- C84 N12 Yb -","- C336 N48 Yb4 -","4","0.5","","Bian, Yongzhong; Wang, Daqi; Wang, Rongming; Weng, Linhong; Dou, Jianmin; Zhao, Dongyuan; Ng, Dennis K. P.; Jiang, Jianzhuang","Structural studies of the whole series of lanthanide double-decker compounds with mixed 2,3-naphthalocyaninato and octaethylporphyrinato ligands","New Journal of Chemistry","2003","27","5","844","","10.1039/b209882m","","","0.71073","MoKα","","0.1665","0.0422","","","0.044","0.0715","","","","","","0.644","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050480","13.075","0.003","14.159","0.003","15.026","0.003","97.5","0.03","111.62","0.03","117.04","0.03","2149","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H40 As3 O7 P -","- C46 H40 As3 O7 P -","- C92 H80 As6 O14 P2 -","2","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050481","17.155","0.003","18.028","0.004","18.48","0.004","90","","90","","90","","5715","2","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C18 H38 As Cl3 In Li O5 -","- C18 H38 As Cl3 In Li O5 -","- C144 H304 As8 Cl24 In8 Li8 O40 -","8","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050482","8.4986","0.0006","22.694","0.002","16.2467","0.0011","90","","105.137","0.004","90","","3024.7","0.4","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C32 H30 As2 Mg O6 -","- C32 H30 As2 Mg O6 -","- C128 H120 As8 Mg4 O24 -","4","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050483","27.506","0.003","10.44","0.002","19.595","0.003","90","","121.486","0.012","90","","4798.5","1.3","150","2","150","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C46 H78 Na O6 Sb -","- C46 H78 Na O6 Sb -","- C184 H312 Na4 O24 Sb4 -","4","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050484","14.44","0.003","19.134","0.004","19.562","0.004","90","","109.36","0.03","90","","5099.1","1.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H83 As Na O7 -","- C48 H78 As Na O7 -","- C192 H312 As4 Na4 O28 -","4","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180058","2020-10-21","18:00:00",""
"7050485","12.5803","0.001","7.6097","0.0007","19.678","0.002","90","","103.446","0.01","90","","1832.2","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H40 As2 Na2 O8 -","- C36 H40 As2 Na2 O8 -","- C72 H80 As4 Na4 O16 -","2","0.5","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","291143","2024-04-09","08:48:42",""
"7050486","8.5317","0.0003","9.7835","0.0005","11.7665","0.0006","112.465","0.003","102.759","0.003","96.788","0.003","862.55","0.07","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C18 H20 As Li O3 -","- C36 H40 As2 Li2 O6 -","- C36 H40 As2 Li2 O6 -","1","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050487","12.5633","0.0003","7.5209","0.0006","18.9855","0.0008","90","","105.605","0.002","90","","1727.8","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 As Li O4 -","- C18 H20 As Li O4 -","- C72 H80 As4 Li4 O16 -","4","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","0.034","","","0.0683","","","","","","","","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050488","11.736","0.0005","17.3904","0.0008","12.5818","0.0006","90","","98.619","0.003","90","","2538.9","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 Li O3 Sb -","- C26 H38 Li O3 Sb -","- C104 H152 Li4 O12 Sb4 -","4","1","","Cameron Jones; Stephen Bruce; David E. Hibbs; Jon Steed; Ryan C. Thomas; Thomas C. WIlliams","The synthesis and structural characterisation of 2-arsa- and 2-stiba-1,3-dionato complexes of s- and p-block elements","New Journal of Chemistry","2003","","","","","10.1039/b210043f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180058","2020-10-21","18:00:00",""
"7050489","9.3565","0.0001","17.3925","0.0002","12.5085","0.0002","90","","90","","90","","2035.54","0.05","233","2","233","2","","","","","","","","3","P n a 21","P 2c -2n","33","dtbpm","","","- C17 H38 P2 -","- C17 H38 P2 -","- C68 H152 P8 -","4","1","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.0542","0.0405","","0.1299","0.1103","","","","1.083","1.058","1.058","","","","","has coordinates,has disorder","180058","2020-10-21","18:00:00",""
"7050490","9.718","0.002","10.423","0.002","12.775","0.001","98.21","0.01","96.84","0.01","105.23","0.01","1219","0.4","100","","100","","","","","","","","see paper","3","P -1","-P 1","2","dcpm","","","- C25 H46 P2 -","- C25 H46 P2 -","- C50 H92 P4 -","2","1","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.0555","0.045","","","0.1294","0.1386","","","","","","1.182","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050491","11.1753","0.0005","9.8062","0.0004","20.3041","0.0008","90","","94.633","0.001","90","","2217.8","0.16","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","ctbpm","","","- C21 H42 P2 -","- C21 H42 P2 -","- C84 H168 P8 -","4","1","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.1158","0.0529","","","0.0949","0.1168","","","","","","1.014","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050492","6.2975","0.0002","33.5911","0.0004","10.2346","0.0002","90","","105.314","0.001","90","","2088.15","0.08","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","ptbpm","","","- C21 H30 P2 -","- C21 H30 P2 -","- C84 H120 P8 -","4","1","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.087","0.0461","","","0.0882","0.1012","","","","","","1.011","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050493","8.5","","10.1304","0.0002","12.9111","0.0002","90","","106.18","","90","","1067.72","0.03","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","dtbpe","","","- C18 H40 P2 -","- C18 H40 P2 -","- C36 H80 P4 -","2","0.5","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.0484","0.0335","","","0.086","0.0943","","","","","","1.035","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050494","9.5711","0.0002","25.0934","0.0004","17.6357","0.0001","90","","105.061","0.001","90","","4090.1","0.11","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","dtbpmO2","","","- C17 H38 O2 P2 -","- C17 H38 O2 P2 -","- C136 H304 O16 P16 -","8","2","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.0614","0.0407","","","0.0981","0.1091","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050495","16.7907","0.0001","19.1459","0.0002","18.2699","0.0002","90","","113.552","0.001","90","","5384.02","0.1","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","dtbpmH+","","","- C49 H51 B F24 P2 -","- C49 H51 B F24 P2 -","- C196 H204 B4 F96 P8 -","4","1","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.1002","0.047","","","0.098","0.1184","","","","","","1.006","","","","has coordinates,has disorder","180058","2020-10-21","18:00:00",""
"7050496","18.2861","0.0003","9.9887","0.0002","17.3272","0.0003","90","","113.857","0.001","90","","2894.47","0.09","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","dtbpmCl+","","","- C18 H40 Cl6 Fe P2 -","- C18 H40 Cl6 Fe P2 -","- C72 H160 Cl24 Fe4 P8 -","4","1","","Eisenträger, Frank; Göthlich, Alexander; Gruber, Irene; Heiss, Helmut; Kiener, Christoph A.; Krüger, Carl; Ulrich Notheis, J.; Rominger, Frank; Scherhag, Gunter; Schultz, Madeleine; Straub, Bernd F.; Volland, Martin A. O.; Hofmann, Peter","Sterically crowded diphosphinomethane ligands: molecular structures, UV-photoelectron spectroscopy and a convenient general synthesis of tBu2PCH2PtBu2 and related species","New Journal of Chemistry","2003","27","3","540","550","10.1039/b210114a","","","0.71073","MoKα","","0.1835","0.1019","","","0.2307","0.2771","","","","","","1.132","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050497","14.2005","0.0005","10.6963","0.0004","13.9689","0.0005","90","","113.406","0.001","90","","1947.18","0.12","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,3,5,6-Tetra-(4-t-Butylphenyl)-1,4-di-iodobenzene","","","- C46 H52 I2 -","- C46 H52 I2 -","- C92 H104 I4 -","2","0.5","","Shah, Shashin; Eichler, Barrett E.; Smith, Rhett C.; Power, Philip P.; Protasiewicz, John D.","Synthesis and solid state structures of increasingly sterically crowded 1,4-diiodo-2,3,5,6-tetraarylbenzenes: a new series of bulky benzenes and aryls","New Journal of Chemistry","2003","27","2","442","","10.1039/b210577b","","","0.71073","MoKα","","0.0663","0.0336","","","0.0659","0.0758","","","","","","0.899","","","","has coordinates","180058","2020-10-21","18:00:00",""
"7050498","8.3261","0.0006","31.196","0.002","31.772","0.002","90","","90","","90","","8252.5","1","293","2","293","2","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","2,3,5,6-Tetramesityl-1,4-di-iodobenzene.0.5toluene","","","- C45.5 H48 I2 -","- C45.5 H44 I2 -","- C364 H352 I16 -","8","0.25","","Shah, Shashin; Eichler, Barrett E.; Smith, Rhett C.; Power, Philip P.; Protasiewicz, John D.","Synthesis and solid state structures of increasingly sterically crowded 1,4-diiodo-2,3,5,6-tetraarylbenzenes: a new series of bulky benzenes and aryls","New Journal of Chemistry","2003","27","2","442","","10.1039/b210577b","","","0.71073","MoKα","","0.0928","0.0567","","","0.1268","0.1385","","","","","","1.077","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050499","16.229","0.002","16.5","0.002","13.1236","0.0016","90","","110.941","0.009","90","","3282.1","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C69 H52 I2 -","- C68 H12 I2 -","- C136 H24 I4 -","2","0.5","","Shah, Shashin; Eichler, Barrett E.; Smith, Rhett C.; Power, Philip P.; Protasiewicz, John D.","Synthesis and solid state structures of increasingly sterically crowded 1,4-diiodo-2,3,5,6-tetraarylbenzenes: a new series of bulky benzenes and aryls","New Journal of Chemistry","2003","27","2","442","","10.1039/b210577b","","","0.71073","MoKα","","0.1188","0.0721","","","0.1791","0.2103","","","","","","1.003","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050500","11.259","0.002","15.053","0.003","15.134","0.003","103.65","0.03","111.31","0.03","98.96","0.03","2237.9","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H55 F3 N3 O5 Pt S -","- C44 H53 F3 N3 O5 Pt S -","- C88 H106 F6 N6 O10 Pt2 S2 -","2","1","","Tao, Chi-Hang; Wong, Keith Man-Chung; Zhu, Nianyong; Yam, Vivian Wing-Wah","Versatile precursors for multinuclear platinum(ii) alkynyl assembly—synthesis, structural characterization and electrochemical studies of luminescent platinum(ii) alkynyl complexes","New Journal of Chemistry","2003","27","1","150","","10.1039/b210772b","","","0.71069","MoKα","","0.0968","0.082","","","0.2109","0.2241","","","","","","1.018","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050501","19.125","0.002","7.8428","0.0009","19.805","0.002","90","","107.921","0.012","90","","2826.5","0.6","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H31 N2 O2 P Zr -","- C34 H31 N2 O2 P Zr -","- C136 H124 N8 O8 P4 Zr4 -","4","1","","Cadierno, Victorio; Zablocka, Maria; Donnadieu, Bruno; Igau, Alain; Majoral, Jean-Pierre","Zircona-phosphazine complexes: synthesis and X-ray determination","New Journal of Chemistry","2003","27","4","675","","10.1039/b210773m","","","0.71073","MoKα","","0.0305","0.0237","","","0.0579","0.0601","","","","","","1.021","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050502","19.426","0.002","14.881","0.003","21.824","0.002","90","","116.88","0.007","90","","5627.2","1.4","297.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H17 N4 O2 -","- C14 H17 N4 O2 -","- C224 H272 N64 O32 -","16","2","","Nagashima, Hideaki; Hashimoto, Noriko; Inoue, Hidenari; Yoshioka, Naoki","Coexistence of an antiferromagnetically coupled dimer and isolated paramagnetic spin in 4-azaindol-2-yl nitronyl nitroxide crystalElectronic supplementary information available: final atomic positions, calculated atomic spin population, calculated optimized structure of 2 and the dimeric structures used to calculate J. See http://www.rsc.org/suppdata/nj/b2/b210820h/","New Journal of Chemistry","2003","27","5","805","","10.1039/b210820h","","","0.71073","MoKα","","","0.0492","","","","0.1667","","","","","","1.056","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050503","8.0963","0.0009","15.2585","0.0017","8.2235","0.0009","90","","113.024","0.002","90","","934.98","0.18","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","N,N-Dimethylthioformamidium hexachlorohafniate(IV)","","","- C6 H16 Cl6 Hf N2 S2 -","- C6 H16 Cl6 Hf N2 S2 -","- C12 H32 Cl12 Hf2 N4 S4 -","2","0.5","","Hagfeldt, Camelia; Kessler, Vadim; Persson, Ingmar","The discovery of the N,N-dimethylthioformamidium ion. A structural study of {(CH3)2NCHSH}2[HfCl6] in solid state and solutionElectronic supplementary information (ESI) available: 7 tables and 5 figures of IR, EXAFS and X-ray data as described in the text. See http://www.rsc.org/suppdata/nj/b2/b210969g/","New Journal of Chemistry","2003","27","5","850","","10.1039/b210969g","","","0.71073","MoKα","","0.039","0.0199","","","0.043","0.0459","","","","","","0.772","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050504","19.48","0.002","21.875","0.002","21.415","0.003","90","","109.459","0.008","90","","8604.2","1.7","223","2","223","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Samarium(iii) Tris-(Dimethyl-N-trichloroacetylamidophosphate) Complex with 1,10-Phenanthroline","Samarium(III) Tris-(Dimethyl-N-trichloroacetylamidophosphate) Complex with 1,10-Phenanthroline","","- C24 H26 Cl9 N5 O12 P3 Sm -","- C24 H26 Cl9 N5 O12 P3 Sm -","- C192 H208 Cl72 N40 O96 P24 Sm8 -","8","2","","Grażyna Oczko; Janina Legendziewicz; Victor Trush; Vladimir Amirkhanov","X-Ray analysis and excited state dynamics in a new class of lanthanide mixed chelates of the type LnPhβ3·Phen (Ln=Sm, Eu, Gd, Tb)","New J. Chem.","2003","27","6","948","956","10.1039/b211044j","","","0.71073","MoKα","","0.1317","0.0611","","0.1241","0.0979","","","","1.057","1.158","1.158","","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050505","8.7122","0.0002","12.4992","0.0002","12.9229","0.0003","63.927","0.001","71.742","0.001","73.141","0.001","1181.11","0.04","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C20 H32 O2 Si4 -","- C20 H32 O2 Si4 -","- C40 H64 O4 Si8 -","2","1","","Audrey Moores; Christian Defieber; Nicolas Mézailles; Nicole Maigrot; Louis Ricard; Pascal Le Floch","Siloxa-bridged-cyclophanes featuring benzene, thiophene and pyridine units","New J. Chem.","2003","27","6","994","999","10.1039/b211045h","","","0.71069","MoKα","","0.0361","0.0317","","","0.0949","0.099","","","","","","1.034","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050506","17.0411","0.0003","12.0953","0.0002","16.99","0.0002","90","","114.07","0.001","90","","3197.43","0.09","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H42 O3 Si6 -","- C24 H42 O3 Si6 -","- C96 H168 O12 Si24 -","4","1","","Audrey Moores; Christian Defieber; Nicolas Mézailles; Nicole Maigrot; Louis Ricard; Pascal Le Floch","Siloxa-bridged-cyclophanes featuring benzene, thiophene and pyridine units","New J. Chem.","2003","27","6","994","999","10.1039/b211045h","","","0.71069","MoKα","","0.0529","0.0388","","","0.1027","0.1104","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050507","6.7411","0.0002","8.2744","0.0002","11.4404","0.0001","72.939","0.002","72.984","0.002","73.38","0.001","569.18","0.02","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C16 H28 O2 S2 Si4 -","- C16 H28 O2 S2 Si4 -","- C16 H28 O2 S2 Si4 -","1","0.5","","Audrey Moores; Christian Defieber; Nicolas Mézailles; Nicole Maigrot; Louis Ricard; Pascal Le Floch","Siloxa-bridged-cyclophanes featuring benzene, thiophene and pyridine units","New J. Chem.","2003","27","6","994","999","10.1039/b211045h","","","0.71069","MoKα","","0.0429","0.0346","","","0.0893","0.0967","","","","","","1.026","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050508","23.444","0.005","12.699","0.005","10.521","0.005","90","","90","","90","","3132","2","150","1","150","1","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C22 H40 Br2 N2 O3 Si4 -","- C18 H32 Br2 N2 O2 Si4 -","- C72 H128 Br8 N8 O8 Si16 -","4","0.5","","Audrey Moores; Christian Defieber; Nicolas Mézailles; Nicole Maigrot; Louis Ricard; Pascal Le Floch","Siloxa-bridged-cyclophanes featuring benzene, thiophene and pyridine units","New J. Chem.","2003","27","6","994","999","10.1039/b211045h","","","0.71069","MoKα","","0.0621","0.0455","","","0.1331","0.1388","","","","","","1.082","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050509","8.945","0.003","33.559","0.008","9.959","0.015","90","","96.389","0.01","90","","2971","5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H80 Cr2 Cu3 N24 O4 -","- C42 H66 Cr2 Cu3 N24 O4 -","- C84 H132 Cr4 Cu6 N48 O8 -","2","0.5","","Salah El Fallah, M.; Ribas, Joan; Solans, Xavier; Font-Bardia, Mercé","A new one-dimensional ferromagnet based on copper(ii) and hexacyanochromate(iii), with a rope-ladder chain structure","New Journal of Chemistry","2003","27","5","895","","10.1039/b211276k","","","0.71069","MoKα","","0.0804","0.0571","","","0.1289","0.2131","","","","","","0.771","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050510","11.256","0.001","12.775","0.001","13.9752","0.0008","90","","117.408","0.005","90","","1784","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 Cl2 Fe N2 Pt -","- C16 H22 Cl2 Fe N2 Pt -","- C64 H88 Cl8 Fe4 N8 Pt4 -","4","1","","Sonia Pérez; Concepción López; Amparo Caubet; Xavier Solans; Mercè Font-Bardía","Synthesis, characterisation and study of the reactivity of the first platinum(II) complex having a [C(sp2, ferrocene),N,N']− terdentate ligand","New J. Chem.","2003","27","6","975","982","10.1039/b211346e","","","0.71069","MoKα","","0.0483","0.0392","","","0.1049","0.1166","","","","","","1.129","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050511","11.109","0.005","12.596","0.012","12.484","0.005","90","","110.81","0.04","90","","1632.9","1.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H21 Cl Fe N2 Pt -","- C16 H21 Cl Fe N2 Pt -","- C64 H84 Cl4 Fe4 N8 Pt4 -","4","1","","Sonia Pérez; Concepción López; Amparo Caubet; Xavier Solans; Mercè Font-Bardía","Synthesis, characterisation and study of the reactivity of the first platinum(II) complex having a [C(sp2, ferrocene),N,N']− terdentate ligand","New J. Chem.","2003","27","6","975","982","10.1039/b211346e","","","0.71069","MoKα","","0.0796","0.0442","","","0.1023","0.1169","","","","","","0.933","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050512","9.2775","0.0008","7.7207","0.0006","23.449","0.002","90","","90","","90","","1679.6","0.2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C8 H6 Cd O5 -","- C8 H4 Cd O5 -","- C64 H32 Cd8 O40 -","8","1","","Wang, Shutao; Hou, Yu; Wang, Enbo; Li, Yangguang; Xu, Lin; Peng, Jun; Liu, Shuxia; Hu, Changwen","A novel organic-inorganic hybrid material with fluorescent emission: [Cd(PT)(H2O)]n (PT?=?phthalate)Electronic supplementary information (ESI) available: figures showing the metal-oxygen framework of 1 and its XPS, IR, UV-vis spectra and the decay of the luminescence, as well as the fluorescent excitation and emission spectra of PT. See http://www.rsc.org/suppdata/nj/b2/b211358a/","New Journal of Chemistry","2003","27","7","1144","","10.1039/b211358a","","","0.71073","MoKα","","0.0363","0.0322","","","0.0814","0.084","","","","","","1.077","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050513","19.498","0.009","8.584","0.004","29.979","0.013","90","","90","","90","","5018","4","120","2","120","2","","","","","","","","8","P n a 21","P 2c -2n","33","Di(tetra(dimethylamido)phosphonium)(2+) 1,8- Bis(trichlorostannato)-2,7,9,14,15,20-hexaoxa-3,6,10,13,16,19-hexaaza- 4,5,11,12,17,18-hexachlorobicyclo-(6.6.6)eicosa-3,5,10,12,16,18-hexaene iron(ii) (2-)","","","- C22 H48 Cl12 Fe N14 O6 P2 Sn2 -","- C22 H48 Cl12 Fe N14 O6 P2 Sn2 -","- C88 H192 Cl48 Fe4 N56 O24 P8 Sn8 -","4","1","","Voloshin, Yan Z.; Varzatskii, Oleg A.; Palchik, Aleksei V.; Strizhakova, Nataly G.; Vorontsov, Ivan I.; Antipin, Mikhail Yu.; Kochubey, Dmitry I.; Novgorodov, Boris N.","First trigonal-antiprismatic tris-dichloroglyoximate iron(ii) clathrochelate and its reactivity in nucleophilic substitution reactionsElectronic supplementary information (ESI) available: EXAFS oscillations, k2?(k), and RDA curves of six boron- and tin-capped iron(ii) clathrochelates. See http://www.rsc.org/suppdata/nj/b2/b211623e/","New Journal of Chemistry","2003","27","7","1148","","10.1039/b211623e","","","0.71073","MoKα","","0.0806","0.0541","","","0.1165","0.1269","","","","","","0.927","","","","has coordinates,has disorder","180059","2020-10-21","18:00:00",""
"7050514","18.46","0.03","5.612","0.011","18.46","0.03","90","","100.172","0.01","90","","1882","6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H16 Ag Cl N6 O4 -","- C32 H32 Ag2 Cl2 N12 O8 -","- C64 H64 Ag4 Cl4 N24 O16 -","2","0.25","","Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","A case of four-coordinate silver(i) adopting a high energy planar geometry. Experiment and theory","New Journal of Chemistry","2003","27","5","831","","10.1039/b211898j","","","0.71073","MoKα","","0.1061","0.0675","","","0.201","0.2705","","","","","","1.168","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050515","26.66","0.04","15.4","0.02","21.64","0.03","90","","90.06","","90","","8885","2","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C81.5 H74 Ag3 Cl3 N18 O15.5 -","- C81.5 H74 Ag3 Cl3 N18 O15.5 -","- C326 H296 Ag12 Cl12 N72 O62 -","4","1","","Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","A case of four-coordinate silver(i) adopting a high energy planar geometry. Experiment and theory","New Journal of Chemistry","2003","27","5","831","","10.1039/b211898j","","","0.71073","MoKα","","0.0897","0.0684","","","0.1867","0.2069","","","","","","1","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050516","23.93","0.006","8.041","0.003","25.014","0.005","90","","105.739","0.018","90","","4633","2","132","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","tetrakis(2-allyl-6-methylphenoxo)tricopper(I,II) toluene solvate","tetrakis(2-allyl-6-methylphenoxo)tricopper(I,II) toluene solvate","","- C54 H60 Cu3 O4 -","- C54 H60 Cu3 O4 -","- C216 H240 Cu12 O16 -","4","0.5","","Gustafsson, Björn; Håkansson, Mikael; Jagner, Susan","Copper(ii) is harder than copper(i): a novel mixed-valence example from alkoxide chemistry","New Journal of Chemistry","2003","27","3","459","","10.1039/b211899h","","","0.71073","MoKα","","0.331","0.0638","","","0.1466","0.2307","","","","","","0.948","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050517","12.848","0.002","9.7316","0.0014","21.776","0.005","90","","106.361","0.017","90","","2612.4","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 B Mo N6 O3 -","- C27 H30 B Mo N6 O3 -","- C108 H120 B4 Mo4 N24 O12 -","4","1","","Laye, Rebecca H.; Bell, Zöe R.; Ward, Michael D.","Complexes of 2,2'-biphenol with ruthenium(ii), molybdenum(v), tungsten(v) and tungsten(vi): structures, electrochemistry and spectroscopy","New Journal of Chemistry","2003","27","4","684","","10.1039/b211997h","","","0.71073","MoKα","","0.055","0.038","","","0.0831","0.0887","","","","","","0.986","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050518","15.41","0.003","10.0634","0.0018","17.134","0.004","90","","105.629","0.011","90","","2558.8","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 B N6 O3 W -","- C27 H30 B N6 O3 W -","- C108 H120 B4 N24 O12 W4 -","4","1","","Laye, Rebecca H.; Bell, Zöe R.; Ward, Michael D.","Complexes of 2,2'-biphenol with ruthenium(ii), molybdenum(v), tungsten(v) and tungsten(vi): structures, electrochemistry and spectroscopy","New Journal of Chemistry","2003","27","4","684","","10.1039/b211997h","","","0.71073","MoKα","","0.0612","0.0448","","","0.1014","0.1088","","","","","","1.005","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050519","13.467","0.005","15.593","0.006","15.861","0.006","90","","98.31","0.007","90","","3296","2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H14 Cl2 N2 O Ru0.5 -","- C17 H12 Cl2 N2 O Ru0.5 -","- C136 H96 Cl16 N16 O8 Ru4 -","8","1","","Laye, Rebecca H.; Bell, Zöe R.; Ward, Michael D.","Complexes of 2,2'-biphenol with ruthenium(ii), molybdenum(v), tungsten(v) and tungsten(vi): structures, electrochemistry and spectroscopy","New Journal of Chemistry","2003","27","4","684","","10.1039/b211997h","","","0.71073","MoKα","","0.0461","0.0373","","","0.0955","0.0983","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050520","16.8678","0.0012","17.776","0.002","19.036","0.002","90","","90","","90","","5707.8","1","173","2","173","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C36 H24 O6 W -","- C36 H24 O6 W -","- C288 H192 O48 W8 -","8","1","","Laye, Rebecca H.; Bell, Zöe R.; Ward, Michael D.","Complexes of 2,2'-biphenol with ruthenium(ii), molybdenum(v), tungsten(v) and tungsten(vi): structures, electrochemistry and spectroscopy","New Journal of Chemistry","2003","27","4","684","","10.1039/b211997h","","","0.71073","MoKα","","0.0396","0.0207","","","0.0445","0.0515","","","","","","0.998","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050521","9.985","0.002","22.734","0.005","16.038","0.003","90","","93.85","0.02","90","","3632.4","1.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H24 Cl6 O6 W2 -","- C36 H24 Cl6 O6 W2 -","- C144 H96 Cl24 O24 W8 -","4","1","","Laye, Rebecca H.; Bell, Zöe R.; Ward, Michael D.","Complexes of 2,2'-biphenol with ruthenium(ii), molybdenum(v), tungsten(v) and tungsten(vi): structures, electrochemistry and spectroscopy","New Journal of Chemistry","2003","27","4","684","","10.1039/b211997h","","","0.71073","MoKα","","0.0888","0.04","","","0.0631","0.0736","","","","","","0.926","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050522","21.693","0.004","8.7","0.0017","15.41","0.003","90","","119.2","0.03","90","","2538.7","1.1","112","2","112","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C19 H43 Cl O3 P2 Ru S -","- C19 H43 Cl O2.648 P2 Ru S0.838 -","- C76 H172 Cl4 O10.592 P8 Ru4 S3.352 -","4","0.5","","Marchenko, Alexei V.; Vedernikov, Andrei N.; Huffman, John C.; Caulton, Kenneth G.","Evaluation of energies of isomeric SO2 complexesElectronic supplementary information (ESI) available: DFT geometry optimized structures of isomeric RuCl(CO)(PMe3)2HSO2. See http://www.rsc.org/suppdata/nj/b2/b212025a/","New Journal of Chemistry","2003","27","4","680","","10.1039/b212025a","","","0.71073","MoKα","","0.0318","0.0234","","","0.0502","0.0524","","","","","","0.945","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050523","7.9536","0.001","6.7856","0.001","24.295","0.004","90","","92.585","0.012","90","","1309.9","0.3","150","","150","","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cu N10 -","- C10 H10 Cu N10 -","- C40 H40 Cu4 N40 -","4","1","","Mohamadou, Aminou; van Albada, Gerard A.; Kooijman, Huub; Wieczorek, Birgit; Spek, Anthony L.; Reedijk, Jan","The binding mode of the ambidentate ligand dicyanamide to transition metal ions can be tuned by bisimidazoline ligands with H-bonding donor property at the rear side of the ligandElectronic supplementary information (ESI) available: atomic displacement plot of structure 2. See http://www.rsc.org/suppdata/nj/b2/b212059c/","New Journal of Chemistry","2003","27","6","983","","10.1039/b212059c","","x-ray","0.71073","MoKα","","0.039","0.0273","","","0.0673","0.0714","","","","","","1.038","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050524","6.5873","0.001","8.4512","0.001","9.2834","0.0015","67.977","0.012","81.207","0.013","84.901","0.015","473.19","0.13","150","","150","","","","","","","","see text","4","P -1","-P 1","2","","","","- C16 H20 Cu N14 -","- C16 H20 Cu N14 -","- C16 H20 Cu N14 -","1","0.5","","Mohamadou, Aminou; van Albada, Gerard A.; Kooijman, Huub; Wieczorek, Birgit; Spek, Anthony L.; Reedijk, Jan","The binding mode of the ambidentate ligand dicyanamide to transition metal ions can be tuned by bisimidazoline ligands with H-bonding donor property at the rear side of the ligandElectronic supplementary information (ESI) available: atomic displacement plot of structure 2. See http://www.rsc.org/suppdata/nj/b2/b212059c/","New Journal of Chemistry","2003","27","6","983","","10.1039/b212059c","","x-ray","0.71073","MoKα","","0.0355","0.0299","","","0.073","0.0752","","","","","","1.059","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050525","6.7844","0.001","8.097","0.002","9.462","0.002","67.89","0.008","82.44","0.009","86.531","0.01","477.34","0.17","150","","150","","","","","","","","see text","4","P -1","-P 1","2","","","","- C16 H20 Co N14 -","- C16 H20 Co N14 -","- C16 H20 Co N14 -","1","0.5","","Mohamadou, Aminou; van Albada, Gerard A.; Kooijman, Huub; Wieczorek, Birgit; Spek, Anthony L.; Reedijk, Jan","The binding mode of the ambidentate ligand dicyanamide to transition metal ions can be tuned by bisimidazoline ligands with H-bonding donor property at the rear side of the ligandElectronic supplementary information (ESI) available: atomic displacement plot of structure 2. See http://www.rsc.org/suppdata/nj/b2/b212059c/","New Journal of Chemistry","2003","27","6","983","","10.1039/b212059c","","x-ray","0.71073","MoKα","","0.0267","0.024","","","0.0571","0.0581","","","","","","1.074","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050526","16.4081","0.0016","6.7991","0.0008","17.965","0.002","90","","90","","90","","2004.2","0.4","150","","150","","","","","","","","see text","4","P b c a","-P 2ac 2ab","61","","","","- C16 H20 N14 Ni -","- C16 H20 N14 Ni -","- C64 H80 N56 Ni4 -","4","0.5","","Mohamadou, Aminou; van Albada, Gerard A.; Kooijman, Huub; Wieczorek, Birgit; Spek, Anthony L.; Reedijk, Jan","The binding mode of the ambidentate ligand dicyanamide to transition metal ions can be tuned by bisimidazoline ligands with H-bonding donor property at the rear side of the ligandElectronic supplementary information (ESI) available: atomic displacement plot of structure 2. See http://www.rsc.org/suppdata/nj/b2/b212059c/","New Journal of Chemistry","2003","27","6","983","","10.1039/b212059c","","x-ray","0.71073","MoKα","","0.0392","0.0282","","","0.0731","0.0784","","","","","","1.081","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050527","20.796","0.004","36.322","0.007","23.03","0.005","90","","101.92","0.03","90","","17021","6","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","01sw015","","","- C138 H170 Cl6 O12 U3 -","- C138 H170 Cl6 O12 U3 -","- C552 H680 Cl24 O48 U12 -","4","0.5","","Old, Jamie; Danopoulos, Andreas A.; Winston, Scott","Uranium complexes with dianionic O-methylated calix[4]arene ligands","New Journal of Chemistry","2003","27","4","672","","10.1039/b212092e","","","0.71073","MoKα","","0.1092","0.0685","","","0.1787","0.2183","","","","","","1.061","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050528","23.3866","0.0008","10.9268","0.0004","27.476","0.001","90","","112.065","0.0009","90","","6507","0.4","193.2","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H31 Cl3 N2 Ni O5 -","- C35 H31 Cl3 N2 Ni O5 -","- C280 H248 Cl24 N16 Ni8 O40 -","8","1","","Houjou, Hirohiko; Iwasaki, Atsushi; Ogihara, Tamako; Kanesato, Masatoshi; Akabori, Sadatoshi; Hiratani, Kazuhisa","The architecture of dinuclear Ni and Cu complexes: twisted and parallel forms controlled by the self-assembly of Schiff base ligands","New Journal of Chemistry","2003","27","5","886","","10.1039/b212285p","","","0.7107","MoKα","","","0.0562","","","","0.0659","","","","","","1.239","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050529","15.1713","0.0004","21.355","0.0005","12.5324","0.0003","98.364","0.001","92.0854","0.0006","94.2007","0.0009","4001.75","0.17","193.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C88 H100 Cu2 N4 O11 -","- C88 H100 Cu2 N4 O11 -","- C176 H200 Cu4 N8 O22 -","2","1","","Houjou, Hirohiko; Iwasaki, Atsushi; Ogihara, Tamako; Kanesato, Masatoshi; Akabori, Sadatoshi; Hiratani, Kazuhisa","The architecture of dinuclear Ni and Cu complexes: twisted and parallel forms controlled by the self-assembly of Schiff base ligands","New Journal of Chemistry","2003","27","5","886","","10.1039/b212285p","","","0.7107","MoKα","","","0.0629","","","","0.1171","","","","","","1.645","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050530","15.5858","0.0009","17.5726","0.0009","17.4597","0.0009","90","","99.845","0.002","90","","4711.5","0.4","193.2","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C46 H62 N2 Ni O11 -","- C46 H62 N2 Ni O11 -","- C184 H248 N8 Ni4 O44 -","4","1","","Houjou, Hirohiko; Iwasaki, Atsushi; Ogihara, Tamako; Kanesato, Masatoshi; Akabori, Sadatoshi; Hiratani, Kazuhisa","The architecture of dinuclear Ni and Cu complexes: twisted and parallel forms controlled by the self-assembly of Schiff base ligands","New Journal of Chemistry","2003","27","5","886","","10.1039/b212285p","","","0.7107","MoKα","","","0.0783","","","","0.1103","","","","","","1.688","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050531","7.2563","0.0013","10.6168","0.0016","12.0608","0.0019","103.213","0.012","103.625","0.014","101.443","0.013","847.3","0.3","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H20 Cu N4 O2 -","- C17 H20 Cu N4 O2 -","- C34 H40 Cu2 N8 O4 -","2","1","","Das, Sunirban; Muthukumaragopal, G. P.; Pal, Satyanarayan; Pal, Samudranil","A one-dimensional assembly of a square-planar copper(ii) complex with alternating short and long Cu?Cu distances. Metal ion spin-exchange via ?-? interactions","New Journal of Chemistry","2003","27","7","1102","","10.1039/b212399c","","","0.71073","MoKα","","0.0398","0.0305","","","0.0779","0.0827","","","","","","1.015","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050532","11.437","0.006","12.002","0.004","10.862","0.007","90.7","0.04","90.22","0.05","112.06","0.03","1381.7","1.3","296.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C24 H14 Cu F12 Fe N2 O4 -","- C24 H14 Cu F12 Fe N2 O4 -","- C48 H28 Cu2 F24 Fe2 N4 O8 -","2","1","","Horikoshi, Ryo; Ueda, Mikio; Mochida, Tomoyuki","Side-chain coordination polymers containing redox-active pendants: complexation of ferrocene-based bidentate ligands with M(hfac)2 (hfac?=?1,1,1,5,5,5-hexafluoroacetylacetonate, M?=?Mn, Ni, Cu, Zn) and CuX (X?=?I, Br)","New Journal of Chemistry","2003","27","6","933","","10.1039/b212518h","","","0.7107","MoKα","","","0.0461","","","","0.1457","","","","","","1.014","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050533","12.515","0.002","9.537","0.002","12.683","0.002","90","","112.54","0.01","90","","1398.2","0.4","296.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Cu Fe I N2 -","- C14 H12 Cu Fe I N2 -","- C56 H48 Cu4 Fe4 I4 N8 -","4","1","","Horikoshi, Ryo; Ueda, Mikio; Mochida, Tomoyuki","Side-chain coordination polymers containing redox-active pendants: complexation of ferrocene-based bidentate ligands with M(hfac)2 (hfac?=?1,1,1,5,5,5-hexafluoroacetylacetonate, M?=?Mn, Ni, Cu, Zn) and CuX (X?=?I, Br)","New Journal of Chemistry","2003","27","6","933","","10.1039/b212518h","","","0.7107","MoKα","","","0.0335","","","","0.0974","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050534","16.6049","0.0003","13.7745","0.0003","13.7888","0.0004","90","","102.184","0.001","90","","3082.79","0.13","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H36 Cl Cu2 N5 O9 S -","- C25 H36 Cl Cu2 N5 O9 S -","- C100 H144 Cl4 Cu8 N20 O36 S4 -","4","1","","Choudhury, Chirantan Roy; Dey, Subrata Kumar; Karmakar, Ruma; Wu, Chuan-De; Lu, Can-Zhong; El Fallah, M. Salah; Mitra, Samiran","First report of singly phenoxo-bridged copper(ii) dimeric complexes: synthesis, crystal structure and low-temperature magnetic behaviour studyElectronic supplementary information (ESI) available: structural data for compounds 1, 3, 2. See http://www.rsc.org/suppdata/nj/b3/b300217a/","New Journal of Chemistry","2003","27","9","1360","","10.1039/b300217a","","","0.71073","MoKα","","","0.0821","","","0.141","0.1657","","","","","","1.01","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050535","16.738","0.001","13.286","0.001","14.082","0.001","90","","104.88","","90","","3026.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H36 Cl Cu2 N5 O10 -","- C25 H36 Cl Cu2 N5 O10 -","- C100 H144 Cl4 Cu8 N20 O40 -","4","1","","Choudhury, Chirantan Roy; Dey, Subrata Kumar; Karmakar, Ruma; Wu, Chuan-De; Lu, Can-Zhong; El Fallah, M. Salah; Mitra, Samiran","First report of singly phenoxo-bridged copper(ii) dimeric complexes: synthesis, crystal structure and low-temperature magnetic behaviour studyElectronic supplementary information (ESI) available: structural data for compounds 1, 3, 2. See http://www.rsc.org/suppdata/nj/b3/b300217a/","New Journal of Chemistry","2003","27","9","1360","","10.1039/b300217a","","","0.71073","MoKα","","","0.0512","","","0.1247","0.1377","","","","","","1.08","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050536","16.6748","0.0004","13.3188","0.0003","14.0639","0.0004","90","","104.699","0.001","90","","3021.21","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 Cl Cu2 N7 O9 -","- C24 H36 Cl Cu2 N7 O9 -","- C96 H144 Cl4 Cu8 N28 O36 -","4","1","","Choudhury, Chirantan Roy; Dey, Subrata Kumar; Karmakar, Ruma; Wu, Chuan-De; Lu, Can-Zhong; El Fallah, M. Salah; Mitra, Samiran","First report of singly phenoxo-bridged copper(ii) dimeric complexes: synthesis, crystal structure and low-temperature magnetic behaviour studyElectronic supplementary information (ESI) available: structural data for compounds 1, 3, 2. See http://www.rsc.org/suppdata/nj/b3/b300217a/","New Journal of Chemistry","2003","27","9","1360","","10.1039/b300217a","","","0.71073","MoKα","","","0.0556","","","0.1227","0.1372","","","","","","1.148","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050537","10.1284","0.0004","11.1119","0.0004","11.7224","0.0004","109.519","0.001","95.95","0.001","105.425","0.001","1171.47","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H21 Cd N2 O11 -","- C23 H13 Cd N2 O10.99 -","- C46 H26 Cd2 N4 O21.98 -","2","1","","Dai, Jing-Cao; Hu, Sheng-Min; Wu, Xin-Tao; Fu, Zhi-Yong; Du, Wen-Xin; Zhang, Han-Hui; Sun, Rui-Qing","A novel 2D bilayer architecture generated via ?-? interactions and host?guest molecular recognition: assembly and structure of {[Cd(Htma)(bpy)(H2O)]�(H2tp)0.5�2H2O}n polymer (tma?=?trimesate, bpy?=?4,4?-bipyridine, tp?=?terephthalate)","New Journal of Chemistry","2003","27","6","914","","10.1039/b300223c","","","0.71073","MoKα","","0.0761","0.0563","","","0.1414","0.1615","","","","","","1.076","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050538","18.949","0.002","18.949","0.002","18.949","0.002","117.25","0.02","117.25","0.02","117.25","0.02","2879","6","","","293","2","","","","","","","","4","R -3 :R","-P 3*","148","N-(2'-Methylphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12- dicarboximide","N-(2'-Methylphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboximide","","- C25 H19 N O2 -","- C25 H19 N O2 -","- C150 H114 N6 O12 -","6","1","","Gisbert Grossmann; Marek J. Potrzebowski; Sebastian Olejniczak; Natasza E. Ziółkowska; Grzegorz D. Bujacz; Wlodzimierz Ciesielski; Wiktor Prezdo; Valerii Nazarov; Vladislav Golovko","Structural studies of N-(2'-substituted phenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboximides by X-ray diffraction and NMR spectroscopy—proofs for CH/π interactions in liquid and solid phases","New J. Chem.","2003","27","7","1095","1101","10.1039/b300759f","","","1.54178","CuKα","","0.0486","0.0436","","0.1172","","0.1124","","","","","","1.122","","","","has coordinates,has disorder","180059","2020-10-21","18:00:00",""
"7050539","10.489","0.003","10.626","0.002","17.737","0.003","79.166","0.014","79.92","0.02","89.27","0.02","1911.3","0.7","","","293","2","","","","","","","","4","P -1","-P 1","2","N-(2'-Methoxyphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12- dicarboximide","N-(2'-Methoxyphenyl)-9,10-dihydro-9,10- ethanoanthracene-11,12-dicarboximide","","- C25 H19 N O3 -","- C25 H19 N O3 -","- C100 H76 N4 O12 -","4","2","","Gisbert Grossmann; Marek J. Potrzebowski; Sebastian Olejniczak; Natasza E. Ziółkowska; Grzegorz D. Bujacz; Wlodzimierz Ciesielski; Wiktor Prezdo; Valerii Nazarov; Vladislav Golovko","Structural studies of N-(2'-substituted phenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboximides by X-ray diffraction and NMR spectroscopy—proofs for CH/π interactions in liquid and solid phases","New J. Chem.","2003","27","7","1095","1101","10.1039/b300759f","","","1.54178","CuKα","","0.0521","0.0463","","0.1408","","0.1338","","","","","","1.085","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050540","10.9","0.002","12.637","0.003","15.214","0.004","90","","108.16","0.02","90","","1991.2","0.8","","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(2'-Ethoxyphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12- dicarboximide","N-(2'-Ethoxyphenyl)-9,10-dihydro-9,10- ethanoanthracene-11,12-dicarboximide","","- C26 H21 N O3 -","- C26 H21 N O3 -","- C104 H84 N4 O12 -","4","1","","Gisbert Grossmann; Marek J. Potrzebowski; Sebastian Olejniczak; Natasza E. Ziółkowska; Grzegorz D. Bujacz; Wlodzimierz Ciesielski; Wiktor Prezdo; Valerii Nazarov; Vladislav Golovko","Structural studies of N-(2'-substituted phenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboximides by X-ray diffraction and NMR spectroscopy—proofs for CH/π interactions in liquid and solid phases","New J. Chem.","2003","27","7","1095","1101","10.1039/b300759f","","","1.54178","CuKα","","0.0481","0.044","","0.1254","","0.1207","","","","","","1.064","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050541","12.654","0.006","17.65","0.007","12.543","0.006","90","","90","","90","","2801","2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C25 H34 Mn N10 -","- C25 H34 Mn N10 -","- C100 H136 Mn4 N40 -","4","0.5","","Tong, Ming-Liang; Ru, Jie; Wu, Yin-Miao; Chen, Xiao-Ming; Chang, Ho-Chol; Mochizuki, K.; Kitagawa, S.","Cation-templated construction of three-dimensional α-Po cubic-type [M(dca)3]‒ networks. Syntheses, structures and magnetic properties of A[M(dca)3] (dca = dicyanamide; for A = benzyltributylammonium, M = Mn2+, Co2+; for A = benzyltriethylammonium, M = Mn2+, Fe2+)","New Journal of Chemistry","2003","27","5","779","","10.1039/b300760j","","","0.71073","MoKα","","0.0813","0.0597","","","0.1598","0.1785","","","","","","1.042","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050542","12.536","0.008","17.48","0.001","12.372","0.006","90","","90","","90","","2711","2","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C25 H34 Co N10 -","- C25 H34 Co N10 -","- C100 H136 Co4 N40 -","4","0.5","","Tong, Ming-Liang; Ru, Jie; Wu, Yin-Miao; Chen, Xiao-Ming; Chang, Ho-Chol; Mochizuki, K.; Kitagawa, S.","Cation-templated construction of three-dimensional α-Po cubic-type [M(dca)3]‒ networks. Syntheses, structures and magnetic properties of A[M(dca)3] (dca = dicyanamide; for A = benzyltributylammonium, M = Mn2+, Co2+; for A = benzyltriethylammonium, M = Mn2+, Fe2+)","New Journal of Chemistry","2003","27","5","779","","10.1039/b300760j","","","0.71073","MoKα","","0.0935","0.0578","","","0.1578","0.1812","","","","","","1.064","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050543","12.932","0.006","16.352","0.007","10.625","0.005","90","","90","","90","","2246.8","1.8","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C19 H22 Mn N10 -","- C19 H22 Mn N10 -","- C76 H88 Mn4 N40 -","4","0.5","","Tong, Ming-Liang; Ru, Jie; Wu, Yin-Miao; Chen, Xiao-Ming; Chang, Ho-Chol; Mochizuki, K.; Kitagawa, S.","Cation-templated construction of three-dimensional α-Po cubic-type [M(dca)3]‒ networks. Syntheses, structures and magnetic properties of A[M(dca)3] (dca = dicyanamide; for A = benzyltributylammonium, M = Mn2+, Co2+; for A = benzyltriethylammonium, M = Mn2+, Fe2+)","New Journal of Chemistry","2003","27","5","779","","10.1039/b300760j","","","0.7107","Molybdenum","","0.0563","0.0412","","","0.1056","0.1133","","","","","","1.082","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050544","12.799","0.005","16.229","0.007","10.577","0.005","90","","90","","90","","2197","1.6","298","2","298","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C19 H22 Fe N10 -","- C19 H22 Fe N10 -","- C76 H88 Fe4 N40 -","4","0.5","","Tong, Ming-Liang; Ru, Jie; Wu, Yin-Miao; Chen, Xiao-Ming; Chang, Ho-Chol; Mochizuki, K.; Kitagawa, S.","Cation-templated construction of three-dimensional α-Po cubic-type [M(dca)3]‒ networks. Syntheses, structures and magnetic properties of A[M(dca)3] (dca = dicyanamide; for A = benzyltributylammonium, M = Mn2+, Co2+; for A = benzyltriethylammonium, M = Mn2+, Fe2+)","New Journal of Chemistry","2003","27","5","779","","10.1039/b300760j","","","0.7107","Molybdenum","","0.0586","0.0329","","","0.0802","0.0891","","","","","","1.063","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050545","10.186","0.0004","11.051","0.0003","7.6536","0.0003","90","","119.445","0.002","90","","750.25","0.05","133","5","133","5","","","","","","","","4","C 1 2/c 1","-C 2yc","15","E,E-isophthalaldoxime","","","- C8 H8 N2 O2 -","- C8 H8 N2 O2 -","- C32 H32 N8 O8 -","4","0.5","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.0512","0.0423","","","0.1191","0.1245","","","","","","1.065","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050546","3.897","0.002","14.757","0.009","16.305","0.009","90","","91.668","0.014","90","","937.3","0.9","148","5","148","5","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,3-diacetylbenzemedioxime","","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C40 H48 N8 O8 -","4","1","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.0902","0.0614","","","0.1467","0.1599","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050547","13.1956","0.0015","12.1099","0.0017","11.8156","0.0017","90","","101.412","0.008","90","","1850.8","0.4","123","5","123","5","","","","","","","","4","C 1 2/c 1","-C 2yc","15","E,E-1,3-benzenediamidioxime","","","- C8 H10 N4 O2 -","- C8 H10 N4 O2 -","- C64 H80 N32 O16 -","8","1","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.1092","0.0475","","","0.0946","0.1146","","","","","","0.974","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050548","13.6142","0.0008","4.5032","0.0003","13.1697","0.0008","90","","107.263","0.004","90","","771.03","0.08","173","5","173","5","","","","","","","","4","C 1 2/c 1","-C 2yc","15","E,E-terephathalaldoxime","","","- C8 H8 N2 O2 -","- C8 H8 N2 O2 -","- C32 H32 N8 O8 -","4","0.5","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.0807","0.0443","","","0.0988","0.1149","","","","","","1.028","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050549","8.1553","0.0014","14.208","0.003","8.5134","0.0014","90","","108.525","0.004","90","","935.3","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-diacetylbenzenedioxime","","","- C10 H12 N2 O2 -","- C10 H12 N2 O2 -","- C40 H48 N8 O8 -","4","1","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.3456","0.1139","","","0.2412","0.3258","","","","","","0.782","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050550","8.401","0.006","4.985","0.005","10.714","0.01","90","","107.41","0.07","90","","428.1","0.7","133","5","133","5","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-benzenediamidioxime","","","- C8 H10 N4 O2 -","- C8 H10 N4 O2 -","- C16 H20 N8 O4 -","2","0.5","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.0779","0.0425","","","0.0963","0.1108","","","","","","1.017","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050551","16.6296","0.0017","3.6679","0.0003","10.0529","0.001","90","","90","","90","","613.18","0.1","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","Fumaramidioxime","","","- C4 H8 N4 O2 -","- C4 H8 N4 O2 -","- C16 H32 N16 O8 -","4","1","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.0423","0.0368","","","0.0902","0.094","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050552","4.8552","0.0005","5.1714","0.0002","13.2126","0.0008","90","","100.205","0.006","90","","326.5","0.04","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","succinamidioxime","","","- C4 H10 N4 O2 -","- C4 H10 N4 O2 -","- C8 H20 N8 O4 -","2","0.5","","Eric A. Bruton; Lee Brammer; F. Christopher Pigge; Christer B. Aakeröy; Destin S. Leinen","Hydrogen bond patterns in aromatic and aliphatic dioximes","New J. Chem.","2003","27","7","1084","1094","10.1039/b301045g","","","0.71073","MoKα","","0.052","0.0512","","","0.1383","0.1393","","","","","","1.224","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050553","7.7038","0.0009","11.5864","0.0013","10.7693","0.0012","90","","92.691","0.002","90","","960.2","0.19","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C18 H20 Mn N2 O8 -","- C18 H20 Mn N2 O8 -","- C36 H40 Mn2 N4 O16 -","2","0.5","","Ma, Chengbing; Chen, Changneng; Liu, Qiutian; Liao, Daizheng; Li, Licun; Sun, Licheng","Structural transformation mediated by o-, m-, and p-phthalates from two to three dimensions for manganese/phthalate/4,4'-bpy complexes (4,4'-bpy = 4,4'-bipyridine)","New Journal of Chemistry","2003","27","5","890","","10.1039/b301076g","","","0.71073","MoKα","","","0.043","","","0.1008","0.1173","","","","","","1","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050554","10.116","0.002","11.562","0.002","16.084","0.003","90","","102.99","0.03","90","","1833.1","0.6","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C18.5 H15 Mn N2 O5 -","- C18.5 H12 Mn N2 O5.005 -","- C74 H48 Mn4 N8 O20.02 -","4","1","","Ma, Chengbing; Chen, Changneng; Liu, Qiutian; Liao, Daizheng; Li, Licun; Sun, Licheng","Structural transformation mediated by o-, m-, and p-phthalates from two to three dimensions for manganese/phthalate/4,4'-bpy complexes (4,4'-bpy = 4,4'-bipyridine)","New Journal of Chemistry","2003","27","5","890","","10.1039/b301076g","","","0.71073","MoKα","","","0.0631","","","0.1783","0.196","","","","","","1.016","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050555","9.3349","0.0007","10.3142","0.0008","11.4065","0.0008","92.023","0.001","112.864","0.001","116.479","0.002","876.36","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H12 Mn N2 O4 -","- C18 H12 Mn N2 O4 -","- C36 H24 Mn2 N4 O8 -","2","1","","Ma, Chengbing; Chen, Changneng; Liu, Qiutian; Liao, Daizheng; Li, Licun; Sun, Licheng","Structural transformation mediated by o-, m-, and p-phthalates from two to three dimensions for manganese/phthalate/4,4'-bpy complexes (4,4'-bpy = 4,4'-bipyridine)","New Journal of Chemistry","2003","27","5","890","","10.1039/b301076g","","","0.71073","MoKα","","","0.0568","","","0.1379","0.1542","","","","","","1.021","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050556","12.078","0.002","19.01","0.004","18.01","0.004","90","","97.77","0.03","90","","4097.2","1.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","Na(Ru(L')(N)(H2O)).1.4H2O","","","- C10 H20.8 N3 Na O6.4 Ru -","- C10 H12.8 N3 Na O6.4 Ru -","- C100 H128 N30 Na10 O64 Ru10 -","10","5","","Pal, Pankaj K.; Drew, Michael G. B.; Truter, Mary R.; Tocher, Derek A.; Datta, Dipankar","Light-assisted synthesis of a Ru(vi) nitrido complex by the reaction of azide with a Ru(iii) complex","New Journal of Chemistry","2003","27","5","786","","10.1039/b301150j","","","0.71073","MoKα","","0.066","0.0609","","0.1697","0.1597","","","","1.055","1.061","1.061","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050557","7.0936","0.0006","9.8281","0.0006","10.1197","0.0008","80.231","0.002","81.306","0.003","71.641","0.003","656.28","0.09","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H13 Cu N3 O7 -","- C10 H13 Cu N3 O7 -","- C20 H26 Cu2 N6 O14 -","2","1","","José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve","Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes","New J. Chem.","2003","27","12","1775","1783","10.1039/b301212n","","","0.71073","MoKα","","0.0431","0.0305","","","0.0688","0.0716","","","","","","1.052","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050558","8.4848","0.0004","21.1731","0.0012","9.3035","0.0005","90","","111.533","0.002","90","","1554.72","0.14","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H15 Cu N3 O8 -","- C12 H15 Cu N3 O8 -","- C48 H60 Cu4 N12 O32 -","4","1","","José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve","Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes","New J. Chem.","2003","27","12","1775","1783","10.1039/b301212n","","","0.71073","MoKα","","0.0339","0.0263","","","0.0748","0.0845","","","","","","1.144","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050559","6.9893","0.0004","9.2227","0.0005","9.8112","0.0005","102.266","0.001","106.779","0.001","103.527","0.001","561.45","0.05","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H10 Cu N4 O6 -","- C8 H10 Cu N4 O6 -","- C16 H20 Cu2 N8 O12 -","2","1","","José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve","Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes","New J. Chem.","2003","27","12","1775","1783","10.1039/b301212n","","","0.71073","MoKα","","0.0395","0.0304","","","0.0686","0.0709","","","","","","1.074","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050560","6.7113","0.0004","9.2977","0.0005","11.825","0.0006","106.316","0.001","97.995","0.001","107.84","0.001","653.32","0.06","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H8 Cu N4 O6 -","- C13 H8 Cu N4 O6 -","- C26 H16 Cu2 N8 O12 -","2","1","","José Carranza; Conor Brennan; Jorunn Sletten; Brita Vangdal; Paul Rillema; Francesc Lloret; Miguel Julve","Syntheses, crystal structures and magnetic properties of new oxalato-, croconato- and squarato-containing copper(II) complexes","New J. Chem.","2003","27","12","1775","1783","10.1039/b301212n","","","0.71073","MoKα","","0.0335","0.0296","","","0.0796","0.0813","","","","","","1.073","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050561","12.2414","0.0002","13.1257","0.0002","27.1081","0.0004","90","","90","","90","","4355.65","0.12","173","","173","","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C32 H27 Cl11 Co N4 O8 -","- C31 H24 Cl11 Co0.5 N4 O8 -","- C124 H96 Cl44 Co2 N16 O32 -","4","0.5","","Grosshans, Philippe; Jouaiti, Abdelaziz; Hosseini, Mir Wais; Kyritsakas, Nathalie","Gradual increase in the dimensionality of cobalt and mercury coordination networks based on conformation of tetradentate tectons","New Journal of Chemistry","2003","27","5","793","","10.1039/b301351k","","","0.71073","Mo-Kα","","0.109","0.08","","0.199","","0.093","","","1.453","","","1.069","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050562","24.274","0.0006","10.8173","0.0003","20.6707","0.0006","90","","123.094","0.005","90","","4547.2","0.3","173","","173","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H28 Cl12 Hg2 N4 O8 -","- C32.5 H28 Cl12 Hg2 N4 O8 -","- C130 H112 Cl48 Hg8 N16 O32 -","4","0.5","","Grosshans, Philippe; Jouaiti, Abdelaziz; Hosseini, Mir Wais; Kyritsakas, Nathalie","Gradual increase in the dimensionality of cobalt and mercury coordination networks based on conformation of tetradentate tectons","New Journal of Chemistry","2003","27","5","793","","10.1039/b301351k","","","0.71073","Mo-Kα","","0.08","0.038","","0.195","","0.053","","","1.961","","","1.046","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050563","14.763","0.0003","13.2294","0.0003","20.6902","0.0004","90","","91.285","0.005","90","","4039.9","0.15","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H27 Cl6 Hg2 N4 O9 -","- C30 H24 Cl6 Hg2 N4 O9 -","- C120 H96 Cl24 Hg8 N16 O36 -","4","1","","Grosshans, Philippe; Jouaiti, Abdelaziz; Hosseini, Mir Wais; Kyritsakas, Nathalie","Gradual increase in the dimensionality of cobalt and mercury coordination networks based on conformation of tetradentate tectons","New Journal of Chemistry","2003","27","5","793","","10.1039/b301351k","","","0.71073","Mo-Kα","","0.126","0.06","","0.351","","0.074","","","1.518","","","1.017","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050564","13.0678","0.0009","13.0678","0.0009","25.914","0.001","90","","90","","90","","4425.3","0.5","173","","173","","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C60 H64 Cl10 Co2 N8 O23 -","- C59 H48 Cl10 Co N8 O22.5 -","- C118 H96 Cl20 Co2 N16 O45 -","2","0.25","","Grosshans, Philippe; Jouaiti, Abdelaziz; Hosseini, Mir Wais; Kyritsakas, Nathalie","Gradual increase in the dimensionality of cobalt and mercury coordination networks based on conformation of tetradentate tectons","New Journal of Chemistry","2003","27","5","793","","10.1039/b301351k","","","0.71073","Mo-Kα","","0.186","0.143","","0.323","","0.173","","","1.726","","","1.041","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050565","16.993","0.0005","19.093","0.0005","18.827","0.0006","90","","102.773","0.001","90","","5957.2","0.3","150","1","150","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","compound 2","compound 2","","- C50 H82 Cl6 Cu F6 Fe2 P5 -","- C50 H82 Cl6 Cu F6 Fe2 P5 -","- C200 H328 Cl24 Cu4 F24 Fe8 P20 -","4","1","","Xavier Sava; Mohand Melaimi; Louis Ricard; François Mathey; Pascal Le Floch","Cationic bis-diphosphaferrocene copper and gold complexes","New J. Chem.","2003","27","8","1233","1239","10.1039/b301408h","","","0.7107","MoKα","","0.0672","0.0421","","","0.0998","0.111","","","","","","1.034","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050566","18.61","0.001","19.96","0.001","19.351","0.001","90","","95.044","0.001","90","","7160.2","0.6","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","compound 6","compound 6","","- C64 H112 Au Cl4 Fe3 P4 -","- C64 H112 Au Cl4 Fe3 P4 -","- C256 H448 Au4 Cl16 Fe12 P16 -","4","1","","Xavier Sava; Mohand Melaimi; Louis Ricard; François Mathey; Pascal Le Floch","Cationic bis-diphosphaferrocene copper and gold complexes","New J. Chem.","2003","27","8","1233","1239","10.1039/b301408h","","","0.71069","MoKα","","0.0763","0.0366","","","0.0709","0.0818","","","","","","0.954","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050567","6.759","0.0002","7.403","0.0002","17.319","0.0005","78.267","0.0012","87.281","0.0013","85.421","0.0016","845.34","0.04","110","2","110","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H18 N4 -","- C22 H18 N4 -","- C44 H36 N8 -","2","1","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.1033","0.0569","","","0.14","0.1673","","","","","","1.039","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050568","9.737","0.0001","11.435","0.0002","14.962","0.0003","91.454","0.0006","102.707","0.0007","112.455","0.0013","1490.79","0.05","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H26 Cl2 N6 -","- C35 H26 Cl2 N6 -","- C70 H52 Cl4 N12 -","2","1","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.0991","0.0505","","","0.1166","0.1429","","","","","","1.015","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050569","6.234","0.0001","9.344","0.0002","12.612","0.0003","70.957","0.0009","77.614","0.0009","84.16","0.0015","677.89","0.02","110","2","110","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H20 Cl6 N4 -","- C28 H20 Cl6 N4 -","- C28 H20 Cl6 N4 -","1","0.5","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.0397","0.0313","","","0.0739","0.0784","","","","","","1.032","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050570","18.187","0.0003","13.89","0.0002","20.118","0.0004","90","","107.45","0.0007","90","","4848.27","0.14","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 Ag Cl N5 O4 -","- C24 H21 Ag Cl N5 O4 -","- C192 H168 Ag8 Cl8 N40 O32 -","8","1","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.0569","0.0362","","","0.0846","0.0933","","","","","","1.066","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050571","11.93","0.0002","36.537","0.0005","21.251","0.0004","90","","97.714","0.0005","90","","9179.2","0.3","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C94 H90 Cl4 Cu4 N16 O19 -","- C94.5 H78 Cl4 Cu4 N16 O18.5 -","- C378 H312 Cl16 Cu16 N64 O74 -","4","1","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.157","0.0881","","","0.2265","0.2695","","","","","","1.011","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050572","27.99","0.0003","12.744","0.0002","22.665","0.0003","90","","125.802","0.0006","90","","6557.04","0.16","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H26 Ag Cl3 N6 O4 -","- C35 H26 Ag Cl3 N6 O4 -","- C280 H208 Ag8 Cl24 N48 O32 -","8","1","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.071","0.0415","","","0.0911","0.1026","","","","","","1.02","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050573","12.835","0.0002","41.482","0.0007","13.305","0.0003","90","","110.628","0.0009","90","","6629.7","0.2","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C75 H64 Cl4 Cu2 N12 O8 -","- C74.5 H48 Cl4 Cu2 N12 O8 -","- C298 H192 Cl16 Cu8 N48 O32 -","4","1","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.1475","0.0783","","","0.1779","0.2153","","","","","","0.967","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050574","18.816","0.0003","12.621","0.0002","20.357","0.0004","90","","107.689","0.0007","90","","4605.75","0.14","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H43.5 Cl2 N8.5 O10 Zn -","- C40.25 H31.5 Cl2 N8.5 O9.5 Zn -","- C161 H126 Cl8 N34 O38 Zn4 -","4","1","","Patra, Goutam Kumar; Goldberg, Israel","The synthesis and characterization of a series of bis-bidentate Schiff base ligands and their coordination complexes with silver(i), copper(i) and zinc(ii) d10 metal ionsElectronic supplementary information (ESI) available: Views of the crystal structures of ligands of 1, 2 and 3. See http://www.rsc.org/suppdata/nj/b3/b301632c/","New Journal of Chemistry","2003","27","7","1124","","10.1039/b301632c","","","0.71073","MoKα","","0.1021","0.0678","","","0.1787","0.202","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050575","7.7707","0.0005","13.2573","0.0008","11.5427","0.0007","90","","101.027","0.001","90","","1167.16","0.13","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Baicalein","","","- C15 H10 O5 -","- C15 H10 O5 -","- C60 H40 O20 -","4","1","","David E. Hibbs; Jacob Overgaard; Carlo Gatti; Trevor W. Hambley","The electron density in flavones I. Baicalein","New J. Chem.","2003","27","9","1392","1398","10.1039/b301740k","","","0.71073","MoKα","","0.169","0.043","","","0.033","0.035","","","","","","2.19","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050576","11.888","0.006","7.87","0.004","17.378","0.009","90","","100.736","0.009","90","","1597.4","1.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 Ag F3 N O2 S -","- C15 H12 Ag F3 N O2 S -","- C60 H48 Ag4 F12 N4 O8 S4 -","4","1","","Chen, Chun-Long; Su, Cheng-Yong; Cai, Yue-Peng; Zhang, Hua-Xin; Xu, An-Wu; Kang, Bei-Sheng","A non-interpenetrating 2D coordination polymer from a (CH2)8 spacer-based highly flexible linear ligand and AgCF3CO2Electronic supplementary information (ESI) available: 1H NMR spectra and data for C8TQ and complex 1 and the 3-D structure of complex 1. See http://www.rsc.org/suppdata/nj/b3/b301777j","New Journal of Chemistry","2003","27","5","790","","10.1039/b301777j","","","0.71073","MoKα","","0.0574","0.0421","","","0.1176","0.1295","","","","","","1.064","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050577","39.241","0.0014","12.4804","0.0005","24.5612","0.0009","90","","113.129","0.003","90","","11061.9","0.8","115","2","115","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C115 H82 B2 Cl2 F48 N6 Pt2 -","- C115 H78 B2 Cl2 F48 N6 Pt2 -","- C460 H312 B8 Cl8 F192 N24 Pt8 -","4","0.5","","Vedernikov, Andrei N.; Huffman, John C.; Caulton, Kenneth G.","[2.1.1]-(2,6)-Pyridinophane(L)-controlled alkane C‒H bond cleavage: (L)PtMe2H+ as a precursor to the geometrically “tense” transient (L)PtMe+Electronic supplementary information (ESI) available: complete experimental and characterization data. See http://www.rsc.org/suppdata/nj/b3/b302055j/.","New Journal of Chemistry","2003","27","4","665","","10.1039/b302055j","","","0.71073","MoKα","","","0.0336","","","","0.0432","","","","","","1.541","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050578","13.0056","0.0002","13.7548","0.0001","30.0991","0.0004","90","","90","","90","","5384.41","0.12","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C36 H54 N4 O26 P8 Pb5 -","- C36 H50 N4 O26 P8 Pb5 -","- C144 H200 N16 O104 P32 Pb20 -","4","0.5","","Sun, Zhong-Ming; Mao, Jiang-Gao; Sun, Yan-Qiong; Zeng, Hui-Yi; Clearfield, Abraham","Hydrothermal synthesis, characterization and crystal structures of two new layered lead(ii) diphosphonates","New Journal of Chemistry","2003","27","9","1326","","10.1039/b302240b","","","0.71073","MoKα","","0.0776","0.0516","","","0.1137","0.1287","","","","","","1.117","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050579","7.409","0.0015","7.666","0.0015","7.0421","0.0014","90","","116.04","0.03","90","","359.37","0.15","273","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- B2 H4 O4 -","- B2 H4 O4 -","- B8 H16 O16 -","4","1","","Baber, R. Angharad; Norman, Nicholas C.; Orpen, A. Guy; Rossi, Jean","The solid-state structure of diboronic acid, B2(OH)4","New Journal of Chemistry","2003","27","5","773","","10.1039/b302496m","","","0.71073","MoKα","","0.0735","0.0557","","","0.1261","0.1391","","","","","","1.075","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050580","12.5721","0.0009","12.5721","0.0009","60.565","0.006","90","","90","","120","","8290.3","1.2","296","2","296","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","Gd picolinate","","","- C48 H38 Gd2 N8 Na2 O19 -","- C48 H32 Gd2 N8 Na2 O19 -","- C288 H192 Gd12 N48 Na12 O114 -","6","0.5","","Sendor, Dorota; Hilder, Matthias; Juestel, Thomas; Junk, Peter C.; Kynast, Ulrich H.","One dimensional energy transfer in lanthanoid picolinates. Correlation of structure and spectroscopy","New Journal of Chemistry","2003","27","7","1070","","10.1039/b302499g","","","0.71073","MoKα","","0.0823","0.0815","","","0.1822","0.1825","","","","","","1.366","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050581","12.6063","0.0006","12.6063","0.0006","60.457","0.004","90","","90","","120","","8320.6","0.8","296","2","296","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","picolinates","","","- C48 H38 Eu2 N8 Na2 O19 -","- C48 H32 Eu2 N8 Na2 O19 -","- C288 H192 Eu12 N48 Na12 O114 -","6","0.5","","Sendor, Dorota; Hilder, Matthias; Juestel, Thomas; Junk, Peter C.; Kynast, Ulrich H.","One dimensional energy transfer in lanthanoid picolinates. Correlation of structure and spectroscopy","New Journal of Chemistry","2003","27","7","1070","","10.1039/b302499g","","","0.71073","MoKα","","0.0791","0.0787","","","0.1992","0.1993","","","","","","1.308","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050582","12.5741","0.0006","12.5741","0.0006","60.399","0.004","90","","90","","120","","8270.2","0.8","296","2","296","2","","","","","","","","6","P 61 2 2","P 61 2 (0 0 5)","178","matze Tb","","","- C48 H38 N8 Na2 O19 Tb2 -","- C48 H32 N8 Na2 O19 Tb2 -","- C288 H192 N48 Na12 O114 Tb12 -","6","0.5","","Sendor, Dorota; Hilder, Matthias; Juestel, Thomas; Junk, Peter C.; Kynast, Ulrich H.","One dimensional energy transfer in lanthanoid picolinates. Correlation of structure and spectroscopy","New Journal of Chemistry","2003","27","7","1070","","10.1039/b302499g","","","0.71073","MoKα","","0.0652","0.0604","","","0.1536","0.1569","","","","","","1.077","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050583","12.7708","0.0007","12.7708","0.0007","62.46","0.005","90","","90","","120","","8822","1","296","2","296","2","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","(NH4)(TbL4)","","","- C24 H24 N5 O10 Tb -","- C24 H16 N5 O10 Tb -","- C288 H192 N60 O120 Tb12 -","12","1","","Sendor, Dorota; Hilder, Matthias; Juestel, Thomas; Junk, Peter C.; Kynast, Ulrich H.","One dimensional energy transfer in lanthanoid picolinates. Correlation of structure and spectroscopy","New Journal of Chemistry","2003","27","7","1070","","10.1039/b302499g","","","0.71073","MoKα","","0.0985","0.0982","","","0.2237","0.2239","","","","","","1.344","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050584","12.5245","0.0018","12.5245","0.0018","60.47","0.012","90","","90","","120","","8215","2","296","2","296","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","picolinates","","","- C48 H38 Ho2 N8 Na2 O19 -","- C48 H32 Ho2 N8 Na2 O19 -","- C288 H192 Ho12 N48 Na12 O114 -","6","0.5","","Sendor, Dorota; Hilder, Matthias; Juestel, Thomas; Junk, Peter C.; Kynast, Ulrich H.","One dimensional energy transfer in lanthanoid picolinates. Correlation of structure and spectroscopy","New Journal of Chemistry","2003","27","7","1070","","10.1039/b302499g","","","0.71073","MoKα","","0.0518","0.0495","","","0.1231","0.1245","","","","","","1.15","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050585","27.894","0.006","14.665","0.003","21.659","0.004","90","","126.01","0.03","90","","7167","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C33 H28 Br4 Cl4 O4 -","- C33 H28 Br4 Cl4 O4 -","- C264 H224 Br32 Cl32 O32 -","8","1","","Baudry, Roselyne; Felix, Caroline; Bavoux, Claude; Perrin, Monique; Vocanson, Francis; Dumazet-Bonnamour, Isabelle; Lamartine, Roger","Biaryl cross-coupling reactions: convenient routes to new functionalized calix[8]arenes","New Journal of Chemistry","2003","27","10","1540","","10.1039/b302613b","","","0.71073","MoKα","","0.1806","0.074","","","0.147","0.2033","","","","","","1.043","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050586","32.628","0.007","11.079","0.003","17.333","0.004","90","","101.969","0.01","90","","6129","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H25 F3 N3 O2 P Pd -","- C34 H25 F3 N3 O2 P Pd -","- C272 H200 F24 N24 O16 P8 Pd8 -","8","1","","José Pérez; Luis García; Eduardo Pérez; José Luis Serrano; José Francisco Martínez; Gregorio Sánchez; Gregorio López; Arturo Espinosa; Malva Liu; Franciso Sanz","Solid state conformational and theoretical study of complexes containing the (CxN)Pd moiety (CxN = 2-(phenylazo)phenyl-C,N and its derivatives)","New J. Chem.","2003","27","10","1490","1496","10.1039/b302653a","","","0.71073","MoKα","","0.0925","0.041","","","0.0946","0.1213","","","","","","0.921","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050587","15.001","0.0002","15.741","0.0002","18.139","0.0003","92.767","0.0006","105.623","0.0007","114.954","0.0005","3675.01","0.09","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C37.13 H34.25 Cl0.25 N3 O5 P Pd -","- C37.125 H34.25 Cl0.25 N3 O5 P Pd -","- C148.5 H137 Cl N12 O20 P4 Pd4 -","4","2","","José Pérez; Luis García; Eduardo Pérez; José Luis Serrano; José Francisco Martínez; Gregorio Sánchez; Gregorio López; Arturo Espinosa; Malva Liu; Franciso Sanz","Solid state conformational and theoretical study of complexes containing the (CxN)Pd moiety (CxN = 2-(phenylazo)phenyl-C,N and its derivatives)","New J. Chem.","2003","27","10","1490","1496","10.1039/b302653a","","","0.71073","MoKα","","0.1071","0.0531","","","0.1503","0.1849","","","","","","1.016","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050588","14.288","0.0011","16.726","0.0015","12.104","0.002","90","","112.836","0.004","90","","2665.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H26 N3 O2 P Pd -","- C29 H26 N3 O2 P Pd -","- C116 H104 N12 O8 P4 Pd4 -","4","1","","José Pérez; Luis García; Eduardo Pérez; José Luis Serrano; José Francisco Martínez; Gregorio Sánchez; Gregorio López; Arturo Espinosa; Malva Liu; Franciso Sanz","Solid state conformational and theoretical study of complexes containing the (CxN)Pd moiety (CxN = 2-(phenylazo)phenyl-C,N and its derivatives)","New J. Chem.","2003","27","10","1490","1496","10.1039/b302653a","","","0.71073","MoKα","","0.1397","0.061","","","0.1215","0.1492","","","","","","1.015","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050589","10.863","0.0011","10.863","0.0011","9.1947","0.0014","90","","90","","90","","1085","0.2","301","2","301","2","","","","","","","","5","P 42/m b c","-P 4c 2ab","135","","","","- C3 H4 N2 O3 S -","- C3 H4 N2 O3 S -","- C24 H32 N16 O24 S8 -","8","0.5","","Mezei, Gellert; Raptis, Raphael G.","Pyrazole-4-sulfonate networks of alkali and alkaline-earth metals. Effect of cation size, charge, H-bonding and aromatic interactions on the three-dimensional supramolecular architecture","New Journal of Chemistry","2003","27","9","1399","","10.1039/b303096b","","","0.71073","MoKα","","0.0253","0.0241","","","0.0679","0.0698","","","","","","1.076","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050590","9.979","0.003","7.848","0.003","20.583","0.007","90","","90","","90","","1612","1","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C3 H7 N2 Na O5 S -","- C3 H7 N2 Na O5 S -","- C24 H56 N16 Na8 O40 S8 -","8","1","","Mezei, Gellert; Raptis, Raphael G.","Pyrazole-4-sulfonate networks of alkali and alkaline-earth metals. Effect of cation size, charge, H-bonding and aromatic interactions on the three-dimensional supramolecular architecture","New Journal of Chemistry","2003","27","9","1399","","10.1039/b303096b","","","0.71073","MoKα","","0.0333","0.0318","","","0.0841","0.0851","","","","","","1.071","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050591","8.1743","0.0012","8.9723","0.0013","19.912","0.003","90","","90","","90","","1460.4","0.4","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C3 H5 K N2 O4 S -","- C3 H5 K N2 O4 S -","- C24 H40 K8 N16 O32 S8 -","8","1","","Mezei, Gellert; Raptis, Raphael G.","Pyrazole-4-sulfonate networks of alkali and alkaline-earth metals. Effect of cation size, charge, H-bonding and aromatic interactions on the three-dimensional supramolecular architecture","New Journal of Chemistry","2003","27","9","1399","","10.1039/b303096b","","","0.71073","MoKα","","0.064","0.0568","","","0.1464","0.1517","","","","","","1.05","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050592","5.9972","0.0006","9.2102","0.0009","12.9567","0.0013","76.536","0.002","89.264","0.002","79.057","0.002","682.98","0.12","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H12 Ca N4 O9 S2 -","- C6 H12 Ca N4 O9 S2 -","- C12 H24 Ca2 N8 O18 S4 -","2","1","","Mezei, Gellert; Raptis, Raphael G.","Pyrazole-4-sulfonate networks of alkali and alkaline-earth metals. Effect of cation size, charge, H-bonding and aromatic interactions on the three-dimensional supramolecular architecture","New Journal of Chemistry","2003","27","9","1399","","10.1039/b303096b","","","0.71073","MoKα","","0.0349","0.033","","","0.0917","0.094","","","","","","1.069","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050593","11.3856","0.0014","4.9098","0.0006","24.348","0.003","90","","90.702","0.002","90","","1361","0.3","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H10 Ba N4 O8 S2 -","- C6 H10 Ba N4 O8 S2 -","- C24 H40 Ba4 N16 O32 S8 -","4","1","","Mezei, Gellert; Raptis, Raphael G.","Pyrazole-4-sulfonate networks of alkali and alkaline-earth metals. Effect of cation size, charge, H-bonding and aromatic interactions on the three-dimensional supramolecular architecture","New Journal of Chemistry","2003","27","9","1399","","10.1039/b303096b","","","0.71073","MoKα","","0.0243","0.0217","","","0.0754","0.0762","","","","","","1.262","","","","has coordinates","189184","2020-10-21","18:00:00",""
"7050594","8.1875","0.0012","13.3925","0.0019","15.778","0.002","92.796","0.003","92.386","0.003","101.263","0.003","1692.4","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","janaB","","","- C28.5 H35 N10 O14.5 -","- C28.5 H32 N10 O14.5 -","- C57 H64 N20 O29 -","2","1","","Martin Chadim; Pilar Díaz; Enrique García-España; Jana Hodacova; Peter C. Junk; Julio Latorre; José M. Llinares; Conxa Soriano; Jiri Zavada","Copper(II) and Zn(II) coordination chemistry of tetraaza[n]cyclophanes","New J. Chem.","2003","27","7","1132","1139","10.1039/b303470d","","","0.71073","MoKα","","0.0989","0.0714","","","0.2123","0.2435","","","","","","1.051","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050595","9.452","0.0002","11","0.0003","19.359","0.0007","90","","90","","90","","2012.79","0.1","293","2","293","2","","","","","","","","6","P m n b","-P 2bc 2a","62","","","","- C15 H26 Cl2 Cu N4 O4 -","- C15 H28 Cl2 Cu N4 O4 -","- C60 H112 Cl8 Cu4 N16 O16 -","4","0.5","","Martin Chadim; Pilar Díaz; Enrique García-España; Jana Hodacova; Peter C. Junk; Julio Latorre; José M. Llinares; Conxa Soriano; Jiri Zavada","Copper(II) and Zn(II) coordination chemistry of tetraaza[n]cyclophanes","New J. Chem.","2003","27","7","1132","1139","10.1039/b303470d","","","0.71073","MoKα","","0.1042","0.0439","","","0.128","0.1754","","","","","","1.006","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050596","7.105","0.0002","11.219","0.0003","12.264","0.0004","98.202","0.0011","95.208","0.0011","92.828","0.0013","961.66","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H28 Cl2 N4 O Zn -","- C15 H28 Cl2 N4 O Zn -","- C30 H56 Cl4 N8 O2 Zn2 -","2","1","","Martin Chadim; Pilar Díaz; Enrique García-España; Jana Hodacova; Peter C. Junk; Julio Latorre; José M. Llinares; Conxa Soriano; Jiri Zavada","Copper(II) and Zn(II) coordination chemistry of tetraaza[n]cyclophanes","New J. Chem.","2003","27","7","1132","1139","10.1039/b303470d","","","0.71073","MoKα","","0.048","0.0361","","","0.1062","0.1169","","","","","","0.877","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050597","10.9563","0.0009","11.6745","0.0009","17.633","0.001","108.25","0.002","104.354","0.002","95.475","0.002","2038.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H108 Co2 N10 Si4 -","- C78 H108 Co2 N10 Si4 -","- C78 H108 Co2 N10 Si4 -","1","0.5","","Kay Lee, Hung; Suet Lam, Tung; Lam, Chi-Keung; Li, Hung-Wing; Man Fung, Sze","Synthesis and structural characterisation of divalent transition metal complexes containing an unsymmetrical benzamidinate ligandElectronic supplementary information (ESI) available: inclination angles in complexes 1?6. See http://www.rsc.org/suppdata/nj/b3/b303527a//","New Journal of Chemistry","2003","27","9","1310","","10.1039/b303527a","","","0.71073","MoKα","","0.0802","0.0465","","","0.1172","0.1312","","","","","","0.943","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050598","10.414","0.004","18.633","0.007","23.86","0.009","90","","93.964","0.008","90","","4619","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H62 Fe N6 Si2 -","- C42 H54 Fe N6 Si2 -","- C168 H216 Fe4 N24 Si8 -","4","1","","Kay Lee, Hung; Suet Lam, Tung; Lam, Chi-Keung; Li, Hung-Wing; Man Fung, Sze","Synthesis and structural characterisation of divalent transition metal complexes containing an unsymmetrical benzamidinate ligandElectronic supplementary information (ESI) available: inclination angles in complexes 1?6. See http://www.rsc.org/suppdata/nj/b3/b303527a//","New Journal of Chemistry","2003","27","9","1310","","10.1039/b303527a","","","0.71073","MoKα","","0.1026","0.0503","","","0.134","0.154","","","","","","0.91","","","","has coordinates,has disorder","180059","2020-10-21","18:00:00",""
"7050599","7.9613","0.0008","10.053","0.001","18.0261","0.0019","92.056","0.002","98.285","0.002","101.881","0.002","1393.9","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H39 Cl Fe N4 Si -","- C24 H39 Cl Fe N4 Si -","- C48 H78 Cl2 Fe2 N8 Si2 -","2","1","","Kay Lee, Hung; Suet Lam, Tung; Lam, Chi-Keung; Li, Hung-Wing; Man Fung, Sze","Synthesis and structural characterisation of divalent transition metal complexes containing an unsymmetrical benzamidinate ligandElectronic supplementary information (ESI) available: inclination angles in complexes 1?6. See http://www.rsc.org/suppdata/nj/b3/b303527a//","New Journal of Chemistry","2003","27","9","1310","","10.1039/b303527a","","","0.71073","MoKα","","0.0853","0.0424","","","0.0923","0.1083","","","","","","0.905","","","","has coordinates","180059","2020-10-21","18:00:00",""
"7050600","12.3641","0.0009","12.4981","0.0009","14.4849","0.0011","97.98","0.001","109.071","0.002","114.916","0.001","1816","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H46 N4 Ni Si2 -","- C36 H46 N4 Ni Si2 -","- C72 H92 N8 Ni2 Si4 -","2","1","","Kay Lee, Hung; Suet Lam, Tung; Lam, Chi-Keung; Li, Hung-Wing; Man Fung, Sze","Synthesis and structural characterisation of divalent transition metal complexes containing an unsymmetrical benzamidinate ligandElectronic supplementary information (ESI) available: inclination angles in complexes 1?6. See http://www.rsc.org/suppdata/nj/b3/b303527a//","New Journal of Chemistry","2003","27","9","1310","","10.1039/b303527a","","","0.71073","MoKα","","0.056","0.0404","","","0.1161","0.1241","","","","","","1.046","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050601","8.2152","0.0008","25.198","0.002","13.1402","0.0012","90","","93.696","0.002","90","","2714.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H39 Li N4 Si -","- C24 H39 Li N4 Si -","- C96 H156 Li4 N16 Si4 -","4","1","","Kay Lee, Hung; Suet Lam, Tung; Lam, Chi-Keung; Li, Hung-Wing; Man Fung, Sze","Synthesis and structural characterisation of divalent transition metal complexes containing an unsymmetrical benzamidinate ligandElectronic supplementary information (ESI) available: inclination angles in complexes 1?6. See http://www.rsc.org/suppdata/nj/b3/b303527a//","New Journal of Chemistry","2003","27","9","1310","","10.1039/b303527a","","","0.71073","MoKα","","0.1258","0.0478","","","0.1213","0.1496","","","","","","0.853","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050602","32.691","0.005","13.883","0.002","20.286","0.003","90","","106.162","0.004","90","","8843","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C85 H115 Mn2 N10 Si4 -","- C85 H115 Mn2 N10 Si4 -","- C340 H460 Mn8 N40 Si16 -","4","0.5","","Kay Lee, Hung; Suet Lam, Tung; Lam, Chi-Keung; Li, Hung-Wing; Man Fung, Sze","Synthesis and structural characterisation of divalent transition metal complexes containing an unsymmetrical benzamidinate ligandElectronic supplementary information (ESI) available: inclination angles in complexes 1?6. See http://www.rsc.org/suppdata/nj/b3/b303527a//","New Journal of Chemistry","2003","27","9","1310","","10.1039/b303527a","","","0.71073","MoKα","","0.1635","0.053","","","0.1206","0.1511","","","","","","0.821","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050604","8.333","0.003","12.671","0.004","7.96","0.003","90","","91.191","0.005","90","","840.3","0.5","168","2","168","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H9 N O4 -","- C8 H9 N O4 -","- C32 H36 N4 O16 -","4","1","","Li, Rongqing; Larsen, David S.; Brooker, Sally","Syntheses, structures and tautomers of 2,5-disubstituted pyrroles","New Journal of Chemistry","2003","27","9","1353","","10.1039/b303829g","","","0.71073","MoKα","","0.0735","0.0444","","","0.1043","0.1211","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050605","9.089","0.003","13.036","0.004","10.604","0.003","90","","100.047","0.004","90","","1237.1","0.7","170","2","170","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H17 N O4 -","- C12 H17 N O4 -","- C48 H68 N4 O16 -","4","1","","Li, Rongqing; Larsen, David S.; Brooker, Sally","Syntheses, structures and tautomers of 2,5-disubstituted pyrroles","New Journal of Chemistry","2003","27","9","1353","","10.1039/b303829g","","","0.71073","MoKα","","0.0402","0.0362","","","0.0927","0.0967","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050606","8.0698","0.0019","8.102","0.002","18.278","0.003","90","","98.426","0.014","90","","1182.1","0.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","trans-Dichlorobis(triallylarsine)palladium(ii)","trans-Dichlorobis(triallylarsine)palladium(II)","","- C18 H30 As2 Cl2 Pd -","- C18 H30 As2 Cl2 Pd -","- C36 H60 As4 Cl4 Pd2 -","2","0.5","","Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang","Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures","New Journal of Chemistry","2003","27","11","1584","","10.1039/b303990k","","","0.71073","MoKα","","0.0902","0.0465","","","0.098","0.1142","","","","","","1.026","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050607","8.2198","0.0001","18.4134","0.0001","49.8803","0.0005","90","","90","0.005","90","","7549.61","0.13","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","trans-Dibromobis(triallylarsine)palladium(ii)","trans-Dibromobis(triallylarsine)palladium(II)","","- C18 H30 As2 Br2 Pd -","- C18 H30 As2 Br2 Pd -","- C216 H360 As24 Br24 Pd12 -","12","1.5","","Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang","Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures","New Journal of Chemistry","2003","27","11","1584","","10.1039/b303990k","","","0.71073","MoKα","","0.0841","0.0539","","","0.1183","0.127","","","","","","1.301","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050608","7.982","0.0009","9.366","0.002","10.1692","0.0009","68.166","0.012","82.138","0.009","77.166","0.011","686.84","0.19","173","2","173","2","","","","","","","","5","P -1","-P 1","2","trans-Dichlorobis(tri(methylallyl)arsine)palladium(ii)","trans-Dichlorobis(tri(methylallyl)arsine)palladium(II)","","- C24 H42 As2 Cl2 Pd -","- C24 H42 As2 Cl2 Pd -","- C24 H42 As2 Cl2 Pd -","1","0.5","","Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang","Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures","New Journal of Chemistry","2003","27","11","1584","","10.1039/b303990k","","","0.71073","MoKα","","0.0485","0.0365","","","0.0937","0.0992","","","","","","1.14","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050609","8.8295","0.0017","9.4059","0.0014","9.5258","0.0019","108.471","0.013","103.331","0.014","96.937","0.012","713.9","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","trans-Dibromobis(tri(methylallyl)arsine)palladium(ii)","trans-Dibromobis(tri(methylallyl)arsine)palladium(II)","","- C24 H42 As2 Br2 Pd -","- C24 H42 As2 Br2 Pd -","- C24 H42 As2 Br2 Pd -","1","0.5","","Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang","Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures","New Journal of Chemistry","2003","27","11","1584","","10.1039/b303990k","","","0.71073","MoKα","","0.052","0.036","","","0.0835","0.0895","","","","","","1.042","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050610","8.6461","0.0016","9.4107","0.0017","9.532","0.003","108.19","0.017","102.878","0.018","97.604","0.014","701","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","trans-Dichlorobis(tri(methylallyl)arsine)platinum(ii)","trans-Dichlorobis(tri(methylallyl)arsine)platinum(II)","","- C24 H42 As2 Cl2 Pt -","- C24 H42 As2 Cl2 Pt -","- C24 H42 As2 Cl2 Pt -","1","0.5","","Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang","Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures","New Journal of Chemistry","2003","27","11","1584","","10.1039/b303990k","","","0.71073","MoKα","","0.0349","0.0293","","","0.07","0.0728","","","","","","1.034","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050611","7.7802","0.0015","10.0937","0.0016","20.62","0.003","94.326","0.012","98.76","0.013","100.107","0.014","1566.9","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","trans-μ-Dichlorobis(chloro-tri(methylallyl)arsinepalladium(ii))","trans-μ-Dichlorobis(chloro-tri(methylallyl)arsinepalladium(II))","","- C24 H42 As2 Cl4 Pd2 -","- C24 H42 As2 Cl4 Pd2 -","- C48 H84 As4 Cl8 Pd4 -","2","1","","Phadnis, Prasad P.; Jain, Vimal K.; Klein, Axel; Schurr, Thilo; Kaim, Wolfgang","Tri(allyl)- and tri(methylallyl)arsine complexes of palladium(ii) and platinum(ii): synthesis, spectroscopy, photochemistry and structures","New Journal of Chemistry","2003","27","11","1584","","10.1039/b303990k","","","0.71073","MoKα","","0.0747","0.049","","","0.1162","0.127","","","","","","1.189","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050612","16.749","0.003","23.587","0.005","17.758","0.004","90","","116.76","0.03","90","","6264","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H30 Cl2 N6 O4 -","- C31 H30 Cl2 N6 O4 -","- C248 H240 Cl16 N48 O32 -","8","2","","Nabih, Khadija; Baouid, Abdesselam; Hasnaoui, Aissa; Selkti, Mohamed; Compain, Philippe","1,3-Dipolar cycloaddition of nitrilimines to 2,4-disubstituted-3H-1,5-benzodiazepines: remarkable effect of C4-substituent on diastereoselectivity","New Journal of Chemistry","2003","27","11","1644","","10.1039/b303995c","","","0.71073","MoKα","","0.0614","0.0612","","","0.1546","0.1549","","","","","","1.06","","","","has coordinates,has disorder","180060","2020-10-21","18:00:00",""
"7050613","8.2308","0.0001","10.5652","0.0001","14.6405","0.0002","90","","95.159","0.001","90","","1267.98","0.03","123","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","p11(NMes2)","N,N-dimethylpyrrolidinium dbis(methylsunphonyl)amide","","- C8 H20 N2 O4 S2 -","- C8 H20 N2 O4 S2 -","- C32 H80 N8 O16 S8 -","4","1","","Pringle, Jennifer M.; Golding, Jake; Baranyai, Krisztian; Forsyth, Craig M.; Deacon, Glen B.; Scott, Janet L.; MacFarlane, Douglas R.","The effect of anion fluorination in ionic liquids?physical properties of a range of bis(methanesulfonyl)amide salts","New Journal of Chemistry","2003","27","10","1504","","10.1039/b304072k","","","0.71073","MoKα","","0.0466","0.0308","","","0.0776","0.0819","","","","","","1.085","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050614","33.348","0.007","11.02","0.002","32.188","0.006","90","","110.03","0.03","90","","11113","4","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[{Na(AMPTMS)(THF)0.5}n]","","","- C11 H19 N2 Na O0.5 Si -","- C11 H19 N2 Na O0.5 Si -","- C352 H608 N64 Na32 O16 Si32 -","32","4","","Cole, Marcus L.; Junk, Peter C.","Synthesis and structure of the first non ?ate? heteroleptic lanthanoid complexes bearing monoanionic 2-amidopyridine ligands","New Journal of Chemistry","2003","27","7","1032","","10.1039/b304197b","","","0.71073","MoKα","","0.2984","0.0972","","","0.1909","0.2699","","","","","","0.939","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050615","16.194","0.003","17.076","0.003","20.335","0.004","90","","90","","90","","5623.2","1.8","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","[{Nd(AMPTMS)2(Cl)(THF)}2]","","","- C22 H38 Cl N4 Nd O Si2 -","- C22 H38 Cl N4 Nd O Si2 -","- C176 H304 Cl8 N32 Nd8 O8 Si16 -","8","1","","Cole, Marcus L.; Junk, Peter C.","Synthesis and structure of the first non ?ate? heteroleptic lanthanoid complexes bearing monoanionic 2-amidopyridine ligands","New Journal of Chemistry","2003","27","7","1032","","10.1039/b304197b","","","0.71073","MoKα","","0.0456","0.0271","","","0.0581","0.063","","","","","","1.031","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050616","17.207","0.002","17.207","0.002","50.082","0.01","90","","90","","120","","12842","3","123","2","123","2","","","","","","","","5","R -3 :H","-R 3","148","[TbCp*2(AMPTMS)]","","","- C29 H45 N2 Si Tb -","- C29 H45 N2 Si Tb -","- C522 H810 N36 Si18 Tb18 -","18","1","","Cole, Marcus L.; Junk, Peter C.","Synthesis and structure of the first non ?ate? heteroleptic lanthanoid complexes bearing monoanionic 2-amidopyridine ligands","New Journal of Chemistry","2003","27","7","1032","","10.1039/b304197b","","","0.71073","MoKα","","0.0359","0.0258","","","0.0564","0.0592","","","","","","1.056","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050617","18.18","0.004","12.346","0.003","10.68","0.002","90","","108.95","0.03","90","","2267.2","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis-4-hydroxy-acridinate-ethylenediaminenickel(II)","","- C28 H24 N4 Ni O2 -","- C28 H24 N4 Ni O2 -","- C112 H96 N16 Ni4 O8 -","4","0.5","","Crispini, Alessandra; Pucci, Daniela; Sessa, Stefania; Cataldi, Antonella; Napoli, Anna; Valentini, Alessandra; Ghedini, Mauro","Synthesis and characterization of new transition metal complexes containing DNA intercalators of the acridine family","New Journal of Chemistry","2003","27","10","1497","","10.1039/b304288j","","","0.71073","MoKα","","0.0514","0.0386","","","0.0977","0.1033","","","","","","0.945","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050618","13.2633","0.0006","23.0476","0.0013","22.9725","0.0006","90","","91.39","0.014","90","","7020.3","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C78 H75 Lu N6 O8 P2 -","- C78 H75 Lu N6 O8 P2 -","- C312 H300 Lu4 N24 O32 P8 -","4","1","","Xin, Hao; Shi, Mei; Li, Fu You; Guan, Min; Gao, De Qing; Huang, Chun Hui; Ibrahim, Kurash; Liu, Feng Qin","Photoluminescence and electroluminescence properties of three ternary lutetium complexes","New Journal of Chemistry","2003","27","10","1485","","10.1039/b304451c","","","0.71073","MoKα","","0.1125","0.0698","","","0.0778","0.0859","","","","","","0.943","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050619","12.1329","0.0009","10.4929","0.0009","15.2841","0.0017","90","","98.315","0.008","90","","1925.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 Cu2 O11 -","- C18 H18 Cu2 O11 -","- C72 H72 Cu8 O44 -","4","1","","Jorge Pasán; Joaquín Sanchiz; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve","{[Cu(H2O)3][Cu(phmal)2]}n: a new two-dimensional copper(II) complex with intralayer ferromagnetic interactions (phmal=phenylmalonate dianion)","New J. Chem.","2003","27","11","1557","1562","10.1039/b304471h","","","0.71073","MoKα","","0.0732","0.0414","","","0.0831","0.0932","","","","","","1.003","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050620","19.5646","0.0009","16.3302","0.0008","31.1144","0.0016","90","","107.548","0.001","90","","9478.3","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C96 H138 B4 N16 O9 -","- C96 H134 B4 N16 O9 -","- C384 H536 B16 N64 O36 -","4","1","","Irving, Alison M.; Vogels, Christopher M.; Nikolcheva, Liliya G.; Edwards, Janet P.; He, Xiao-Feng; Hamilton, Michael G.; Baerlocher, Mark O.; Baerlocher, Felix J.; Decken, Andreas; Westcott, Stephen A.","Synthesis and antifungal and antibacterial bioactivity of cyclic diamines containing boronate esters","New Journal of Chemistry","2003","27","10","1419","","10.1039/b304500e","","","0.71073","MoKα","","0.117","0.0566","","","0.1563","0.1817","","","","","","1.052","","","","has coordinates,has disorder","180060","2020-10-21","18:00:00",""
"7050621","12.5263","0.0006","12.5263","0.0006","21.7284","0.0016","90","","90","","90","","3409.4","0.3","173","2","173","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C17 H27 B N2 O2 -","- C17 H27 B N2 O2 -","- C136 H216 B8 N16 O16 -","8","1","","Irving, Alison M.; Vogels, Christopher M.; Nikolcheva, Liliya G.; Edwards, Janet P.; He, Xiao-Feng; Hamilton, Michael G.; Baerlocher, Mark O.; Baerlocher, Felix J.; Decken, Andreas; Westcott, Stephen A.","Synthesis and antifungal and antibacterial bioactivity of cyclic diamines containing boronate esters","New Journal of Chemistry","2003","27","10","1419","","10.1039/b304500e","","","0.71073","MoKα","","0.0648","0.0463","","","0.1166","0.1266","","","","","","0.993","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050622","9.5447","0.0012","10.5484","0.0013","10.9073","0.0013","95.987","0.002","92.32","0.002","91.666","0.002","1090.7","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H33 B N2 O3 -","- C23 H33 B N2 O3 -","- C46 H66 B2 N4 O6 -","2","1","","Irving, Alison M.; Vogels, Christopher M.; Nikolcheva, Liliya G.; Edwards, Janet P.; He, Xiao-Feng; Hamilton, Michael G.; Baerlocher, Mark O.; Baerlocher, Felix J.; Decken, Andreas; Westcott, Stephen A.","Synthesis and antifungal and antibacterial bioactivity of cyclic diamines containing boronate esters","New Journal of Chemistry","2003","27","10","1419","","10.1039/b304500e","","","0.71073","MoKα","","0.0422","0.0391","","","0.1099","0.1126","","","","","","1.089","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050623","10.025","0.0016","10.914","0.0017","17.365","0.003","106.609","0.002","105.779","0.002","93.244","0.002","1733.4","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H54 B2 N4 O5 -","- C34 H54 B2 N4 O5 -","- C68 H108 B4 N8 O10 -","2","1","","Irving, Alison M.; Vogels, Christopher M.; Nikolcheva, Liliya G.; Edwards, Janet P.; He, Xiao-Feng; Hamilton, Michael G.; Baerlocher, Mark O.; Baerlocher, Felix J.; Decken, Andreas; Westcott, Stephen A.","Synthesis and antifungal and antibacterial bioactivity of cyclic diamines containing boronate esters","New Journal of Chemistry","2003","27","10","1419","","10.1039/b304500e","","","0.71073","MoKα","","0.0822","0.0557","","","0.132","0.1399","","","","","","0.919","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050624","7.6819","0.001","8.8715","0.0011","10.3205","0.0011","105.852","0.006","93.055","0.007","105.705","0.003","645.16","0.14","200","","200","","","","","","","","","4","P -1","-P 1","2","","[Cd3(BTC)3)2(H2O)6]-3(H2O)","","- C18 H24 Cd3 O21 -","- C18 H22 Cd3 O20.412 -","- C18 H22 Cd3 O20.412 -","1","0.5","","Fan, Jian; Zhu, Hui-Fang; Okamura, Taka-aki; Sun, Wei-Yin; Tang, Wen-Xia; Ueyama, Norikazu","Three-dimensional photoluminescent pillared metal-organic framework with 4.82 topological channels obtained from the assembly of cadmium(ii) acetate and trimellitic salt","New Journal of Chemistry","2003","27","10","1409","","10.1039/b304826h","","","0.71069","MoKα","","0.0267","0.0243","","","0.0622","0.063","","","","","","1.126","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050625","11.899","0.006","21.435","0.008","16.727","0.007","90","","108.64","0.04","90","","4043","3","193","2","193","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C26 H36 B Cu4 F9 N18 O2 -","- C26 H36 B Cu4 F9 N18 O2 -","- C104 H144 B4 Cu16 F36 N72 O8 -","4","0.5","","van Albada, Gerard A.; Roubeau, Olivier; Mutikainen, Ilpo; Turpeinen, Urho; Reedijk, Jan","A unique methoxo- and fluoro-bridged triangular trinuclear Cu(ii) species linked in a lattice via mononuclear Cu(ii) units. Synthesis, X-ray structure and magnetism of [Cu4(2-aminopyrimidine)6(�3-OCH3)2(�-F)3(F)2](BF4)Electronic supplementary information (ESI) available: fitting of the magnetic coupling according to Scheme 2(a). See http://www.rsc.org/suppdata/nj/b3/b304979e/","New Journal of Chemistry","2003","27","12","1693","","10.1039/b304979e","","","0.71073","MoKα","","0.1752","0.0735","","","0.1402","0.1711","","","","","","0.902","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050626","18.8912","0.0006","19.2995","0.0006","20.7963","0.0007","90","","90","","90","","7582.1","0.4","113","","110","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C35 H63 Cl N2 P2 Ru -","- C35 H63 Cl N2 P2 Ru -","- C280 H504 Cl8 N16 P16 Ru8 -","8","1","","Ho, Victoria M.; Watson, Lori A.; Huffman, John C.; Caulton, Kenneth G.","Double C(sp3) dehydrogenation as a route to coordinated Arduengo carbenes: experiment and computation on comparative ?-acidityElectronic supplementary information (ESI) available: crystallographic data. See http://www.rsc.org/suppdata/nj/b3/b305249d/","New Journal of Chemistry","2003","27","10","1446","","10.1039/b305249d","","","0.71073","MoKα","","","0.0296","","","","0.0286","","","","","","0.6433","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050627","13.7979","0.0018","7.3558","0.0009","15.251","0.002","90","","108.775","0.003","90","","1465.5","0.3","112","2","112","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C11 H13 F6 Fe O3 P -","- C11 H13 F6 Fe O3 P -","- C44 H52 F24 Fe4 O12 P4 -","4","0.5","","Watson, Lori A.; Franzman, Bethany; Bollinger, John C.; Caulton, Kenneth G.","?-Donor olefin substituents alter olefin binding to CpFe(CO)2+Electronic supplementary information available: selected bond lengths and angles in CpFe(CO)2(H2C?CHNMe2)+ and CpFe(CO)2(H2C?CHOEt)+; calculated orbital occupancies and natural charges in the iron-olefin complex and the free olefin. See http://www.rsc.org/suppdata/nj/b3/b305252d/","New Journal of Chemistry","2003","27","12","1769","","10.1039/b305252d","","","0.71073","MoKα","","0.0743","0.0609","","","0.1646","0.1714","","","","","","1.691","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050628","7.3364","0.0017","25.006","0.006","8.175","0.0018","90","","100.73","0.006","90","","1473.5","0.6","113","2","113","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C11 H14 F6 Fe N O2 P -","- C11 H14 F6 Fe N O2 P -","- C44 H56 F24 Fe4 N4 O8 P4 -","4","1","","Watson, Lori A.; Franzman, Bethany; Bollinger, John C.; Caulton, Kenneth G.","?-Donor olefin substituents alter olefin binding to CpFe(CO)2+Electronic supplementary information available: selected bond lengths and angles in CpFe(CO)2(H2C?CHNMe2)+ and CpFe(CO)2(H2C?CHOEt)+; calculated orbital occupancies and natural charges in the iron-olefin complex and the free olefin. See http://www.rsc.org/suppdata/nj/b3/b305252d/","New Journal of Chemistry","2003","27","12","1769","","10.1039/b305252d","","","0.71073","MoKα","","0.04","0.0318","","","0.0845","0.0872","","","","","","1.447","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050629","15.2502","0.0003","10.452","0.0004","10.5579","0.0003","90","","127.508","0.0016","90","","1334.96","0.07","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H14 Br2 F4 N2 -","- C8 H14 Br2 F4 N2 -","- C32 H56 Br8 F16 N8 -","4","0.5","","Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng","Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br)","New Journal of Chemistry","2003","27","10","1522","","10.1039/b305312c","","","0.71073","MoKα","","0.0593","0.0374","","","0.0734","0.0815","","","","","","1.03","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050630","15.8483","0.0003","10.4899","0.0003","10.7354","0.0003","90","","128.488","0.0013","90","","1396.98","0.07","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C8 H14 F4 I2 N2 -","- C8 H14 F4 I2 N2 -","- C32 H56 F16 I8 N8 -","4","0.5","","Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng","Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br)","New Journal of Chemistry","2003","27","10","1522","","10.1039/b305312c","","","0.71073","MoKα","","0.0508","0.0343","","","0.082","0.0887","","","","","","1.036","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050631","6.8922","0.0002","6.8945","0.0003","14.5254","0.0007","77.793","0.003","81.707","0.003","77.341","0.003","654.74","0.05","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C7 H11 F4 I2 N O -","- C7 H11 F4 I2 N O -","- C14 H22 F8 I4 N2 O2 -","2","1","","Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng","Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br)","New Journal of Chemistry","2003","27","10","1522","","10.1039/b305312c","","","0.71073","MoKα","","0.0414","0.034","","","0.0849","0.0896","","","","","","1.038","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050632","7.028","0.0014","16.461","0.003","14.947","0.003","90","","101.89","0.03","90","","1692.1","0.6","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C8 H18 F4 I2 N3 O P -","- C8 F4 I2 N3 O P -","- C32 F16 I8 N12 O4 P4 -","4","1","","Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng","Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br)","New Journal of Chemistry","2003","27","10","1522","","10.1039/b305312c","","","0.71073","MoKα","","0.0676","0.0584","","","0.1818","0.1886","","","","","","1.083","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050633","6.916","0.0005","7.7021","0.0005","10.6364","0.0007","80.528","0.004","78.781","0.004","85.991","0.004","547.75","0.07","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H14 F4 I2 N2 S2 -","- C18 H14 F4 I2 N2 S2 -","- C18 H14 F4 I2 N2 S2 -","1","0.5","","Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng","Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br)","New Journal of Chemistry","2003","27","10","1522","","10.1039/b305312c","","","0.71073","MoKα","","0.0444","0.0348","","","0.0777","0.0819","","","","","","1.03","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050634","6.2536","0.0005","6.4403","0.0007","7.5067","0.0007","106.843","0.005","107.535","0.006","93.925","0.006","271.87","0.05","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H4 F4 I2 N2 -","- C6 H4 F4 I2 N2 -","- C6 H4 F4 I2 N2 -","1","0.5","","Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng","Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br)","New Journal of Chemistry","2003","27","10","1522","","10.1039/b305312c","","","0.71073","MoKα","","0.0332","0.032","","","0.0848","0.0856","","","","","","1.14","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050635","6.9365","0.0005","11.5354","0.001","8.1604","0.0004","90","","110.487","0.004","90","","611.66","0.08","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 F4 I2 N2 -","- C7 H6 F4 I2 N2 -","- C14 H12 F8 I4 N4 -","2","0.5","","Chu, Qianli; Wang, Zheming; Huang, Qichen; Yan, Chunhua; Zhu, Shizheng","Fluorine-containing donor-acceptor complexes: crystallographic study of the interactions between electronegative atoms (N, O, S) and halogen atoms (I, Br)","New Journal of Chemistry","2003","27","10","1522","","10.1039/b305312c","","","0.71073","MoKα","","0.059","0.0459","","","0.108","0.1167","","","","","","1.062","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050636","13.302","0.004","14.54","0.002","22.451","0.008","90","","90","","90","","4342","2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","H4DAPS","H4DAPS","","- C23 H21 N5 O4 -","- C23 H21 N5 O4 -","- C184 H168 N40 O32 -","8","1","","Manuel R. Bermejo; Rosa Pedrido; Ana M. González-Noya; María J. Romero; Miguel Vázquez; Lorenzo Sorace","Conformational rearrangement of 2,6-bis(1-salicyloylhydrazonoethyl)pyridine (H4daps) on complexation. Synthesis and X-ray characterisation of H4daps and its copper helicate complex [Cu(H2daps)(H2O)]2·2CH3CN","New J. Chem.","2003","27","12","1753","1759","10.1039/b305354g","","","1.5418","CuKα","","0.2753","0.065","","","0.112","0.1604","","","","","","0.873","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050637","23.936","0.004","14.65","0.002","18.069","0.003","90","0.003","129.566","0.003","90","0.003","4884.5","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Cudaps","Cudaps","","- C50 H48 Cu2 N12 O10 -","- C50 H48 Cu2 N12 O10 -","- C200 H192 Cu8 N48 O40 -","4","0.5","","Manuel R. Bermejo; Rosa Pedrido; Ana M. González-Noya; María J. Romero; Miguel Vázquez; Lorenzo Sorace","Conformational rearrangement of 2,6-bis(1-salicyloylhydrazonoethyl)pyridine (H4daps) on complexation. Synthesis and X-ray characterisation of H4daps and its copper helicate complex [Cu(H2daps)(H2O)]2·2CH3CN","New J. Chem.","2003","27","12","1753","1759","10.1039/b305354g","","","0.71073","MoKα","","0.1432","0.0674","","","0.1605","0.1943","","","","","","1.019","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050638","25.598","0.005","9.467","0.0019","17.439","0.004","90","","125.82","0.03","90","","3426.8","1.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H42 O8 P2 W2 -","- C30 H42 O8 P2 W2 -","- C120 H168 O32 P8 W8 -","4","0.5","","Brym, Markus; Jones, Cameron; Waugh, Mark; Hey-Hawkins, Evamarie; Majoumo, Felecite","Reactions of phosphavinyl Grignard reagents with aldehydes: synthesis, characterisation and further reactivity of ?-phosphaallylic alcohols","New Journal of Chemistry","2003","27","11","1614","","10.1039/b306607j","","","0.71073","MoKα","","0.062","0.0393","","","0.0801","0.0882","","","","","","1.029","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050639","12.988","0.003","14.268","0.003","18.557","0.004","90","","97.76","0.03","90","","3407.4","1.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H27 O P -","- C18 H27 O P -","- C144 H216 O8 P8 -","8","2","","Brym, Markus; Jones, Cameron; Waugh, Mark; Hey-Hawkins, Evamarie; Majoumo, Felecite","Reactions of phosphavinyl Grignard reagents with aldehydes: synthesis, characterisation and further reactivity of ?-phosphaallylic alcohols","New Journal of Chemistry","2003","27","11","1614","","10.1039/b306607j","","","0.71073","MoKα","","0.0915","0.0538","","","0.1003","0.1134","","","","","","1.03","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050640","14.908","0.003","10.424","0.002","20.972","0.004","90","","97.64","0.03","90","","3230.1","1.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H52 O P2 -","- C36 H52 O P2 -","- C144 H208 O4 P8 -","4","1","","Brym, Markus; Jones, Cameron; Waugh, Mark; Hey-Hawkins, Evamarie; Majoumo, Felecite","Reactions of phosphavinyl Grignard reagents with aldehydes: synthesis, characterisation and further reactivity of ?-phosphaallylic alcohols","New Journal of Chemistry","2003","27","11","1614","","10.1039/b306607j","","","0.71073","MoKα","","0.0845","0.0531","","","0.0977","0.1085","","","","","","1.035","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050641","11.235","0.002","14.236","0.003","21.449","0.004","90","","103.64","0.03","90","","3333.8","1.2","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H52 O P2 -","- C36 H52 O P2 -","- C144 H208 O4 P8 -","4","1","","Brym, Markus; Jones, Cameron; Waugh, Mark; Hey-Hawkins, Evamarie; Majoumo, Felecite","Reactions of phosphavinyl Grignard reagents with aldehydes: synthesis, characterisation and further reactivity of ?-phosphaallylic alcohols","New Journal of Chemistry","2003","27","11","1614","","10.1039/b306607j","","","0.71073","MoKα","","0.1067","0.0751","","","0.1751","0.19","","","","","","1.091","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050642","10.787","0.002","11.073","0.002","15.414","0.003","80.23","0.03","69.52","0.03","79.05","0.03","1682.6","0.7","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H52 O P2 -","- C36 H52 O P2 -","- C72 H104 O2 P4 -","2","1","","Brym, Markus; Jones, Cameron; Waugh, Mark; Hey-Hawkins, Evamarie; Majoumo, Felecite","Reactions of phosphavinyl Grignard reagents with aldehydes: synthesis, characterisation and further reactivity of ?-phosphaallylic alcohols","New Journal of Chemistry","2003","27","11","1614","","10.1039/b306607j","","","0.71073","MoKα","","0.1289","0.0916","","","0.2455","0.2767","","","","","","1.033","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050643","6.349","0.0013","14.028","0.003","19.12","0.004","90","","95.05","0.03","90","","1696.3","0.6","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 O P -","- C18 H27 O P -","- C72 H108 O4 P4 -","4","1","","Brym, Markus; Jones, Cameron; Waugh, Mark; Hey-Hawkins, Evamarie; Majoumo, Felecite","Reactions of phosphavinyl Grignard reagents with aldehydes: synthesis, characterisation and further reactivity of ?-phosphaallylic alcohols","New Journal of Chemistry","2003","27","11","1614","","10.1039/b306607j","","","0.71073","MoKα","","0.0569","0.0408","","","0.0945","0.1024","","","","","","1.032","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050644","6.083","0.0012","19.234","0.004","14.925","0.003","90","","100.12","0.03","90","","1719.1","0.6","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H29 O2 P -","- C18 H29 O2 P -","- C72 H116 O8 P4 -","4","1","","Brym, Markus; Jones, Cameron; Waugh, Mark; Hey-Hawkins, Evamarie; Majoumo, Felecite","Reactions of phosphavinyl Grignard reagents with aldehydes: synthesis, characterisation and further reactivity of ?-phosphaallylic alcohols","New Journal of Chemistry","2003","27","11","1614","","10.1039/b306607j","","","0.71073","MoKα","","0.085","0.0556","","","0.1083","0.1195","","","","","","1.066","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050645","8.7477","0.0009","16.5928","0.0017","8.3841","0.0009","90","","96.281","0.002","90","","1209.6","0.2","446","2","100","2","","","","","","","","5","P 1 c 1","P -2yc","7","","","","- C24 H19 B N9 Tl -","- C24 H19 B N9 Tl -","- C48 H38 B2 N18 Tl2 -","2","1","","Davies, Graham M.; Jeffery, John C.; Ward, Michael D.","Chiral coordination polymers based on thallium(i) complexes of new bis- and tris(pyrazolyl)borate ligands with externally-directed 4-pyridyl groups","New Journal of Chemistry","2003","27","11","1550","","10.1039/b306659b","","","0.71073","MoKα","","0.0503","0.0337","","","0.0622","0.0838","","","","","","0.764","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050646","10.454","0.002","6.374","0.0013","12.338","0.003","90","","98.96","0.03","90","","812.1","0.3","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H14 B N6 Tl -","- C16 H14 B N6 Tl -","- C32 H28 B2 N12 Tl2 -","2","1","","Davies, Graham M.; Jeffery, John C.; Ward, Michael D.","Chiral coordination polymers based on thallium(i) complexes of new bis- and tris(pyrazolyl)borate ligands with externally-directed 4-pyridyl groups","New Journal of Chemistry","2003","27","11","1550","","10.1039/b306659b","","","0.71073","MoKα","","0.0407","0.037","","","0.0773","0.0785","","","","","","0.999","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050647","7.3159","0.001","14.339","0.0017","18.052","0.002","90","","91.067","0.007","90","","1893.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H13 Mn2 N8 O7 W -","- C8 Mn2 N8 O7 W -","- C32 Mn8 N32 O28 W4 -","4","1","","Dong, Wen; Sun, Ya-Qiu; Zhu, Li-Na; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping; Cheng, Peng","Two different three-dimensional microporous framework structures in [Mn2(H2O)4{W(CN)8}�4H2O]n and [Mn2(H2O)4{W(CN)8} (OH)�2H2O]n","New Journal of Chemistry","2003","27","12","1760","","10.1039/b306755f","","","0.71073","MoKα","","0.082","0.0462","","","0.0995","0.1119","","","","","","1.008","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050648","11.915","0.004","11.915","0.004","13.252","0.009","90","","90","","90","","1881.3","1.6","293","2","293","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C8 H16 Mn2 N8 O8 W -","- C8 H16 Mn2 N8 O8 W -","- C32 H64 Mn8 N32 O32 W4 -","4","0.25","","Dong, Wen; Sun, Ya-Qiu; Zhu, Li-Na; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping; Cheng, Peng","Two different three-dimensional microporous framework structures in [Mn2(H2O)4{W(CN)8}�4H2O]n and [Mn2(H2O)4{W(CN)8} (OH)�2H2O]n","New Journal of Chemistry","2003","27","12","1760","","10.1039/b306755f","","","0.71073","MoKα","","0.0326","0.0236","","","0.0487","0.0509","","","","","","1.071","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050649","9.506","0.004","9.904","0.003","20.616","0.006","95.45","0.04","98.14","0.04","118.46","0.03","1659.5","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H51 Cl N6 O14 -","- C24 H35 Cl N6 O14 -","- C48 H70 Cl2 N12 O28 -","2","1","","Formica, Mauro; Fusi, Vieri; Giorgi, Luca; Guerri, Annalisa; Lucarini, Simone; Micheloni, Mauro; Paoli, Paola; Pontellini, Roberto; Rossi, Patrizia; Tarzia, Giorgio; Zappia, Giovanni","New ligand bearing preorganized binding side-arms interacting with ammonium cations: Synthesis, conformational studies and crystal structureElectronic supplementary information (ESI) available: molecular modeling studies. See http://www.rsc.org/suppdata/nj/b3/b306778e/","New Journal of Chemistry","2003","27","11","1575","","10.1039/b306778e","","","1.5418","CuKα","","0.0782","0.0691","","","0.1972","0.209","","","","","","1.045","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050650","11.0993","0.0008","13.0681","0.001","19.3948","0.0014","84.735","0.001","76.483","0.001","64.9","0.001","2476.9","0.3","125","2","125","2","","","","","","","","6","P -1","-P 1","2","","[Au(dppeS-P)Cl]2","","- C52 H48 Au2 Cl2 P4 S2 -","- C52 H48 Au2 Cl2 P4 S2 -","- C104 H96 Au4 Cl4 P8 S4 -","2","1","","Aucott, Stephen M.; Bhattacharyya, Pravat; Milton, Heather L.; Slawin, Alexandra M. Z.; Woollins, J. Derek","N-Metallation of MS2N2 rings. X-ray crystal structures of [(?5-C5Me5)Ir(S2N2)Au(PPh3)][ClO4], [{(?5-C5Me5)Ir(S2N2)Au}2(�2-dppm)][ClO4]2 and [Au(dppeS-P)Cl]2","New Journal of Chemistry","2003","27","10","1466","","10.1039/b306847a","","","0.71073","MoKα","","0.0598","0.0364","","","0.0713","0.0756","","","","","","0.9","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050651","13.0057","0.0017","11.2301","0.0015","21.098","0.003","90","","98.213","0.002","90","","3049.9","0.7","125","2","125","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","[(h5-C5Me5)Ir(S2N2)Au(PPh3)][ClO4]","","- C28 H30 Au Cl Ir N2 O4 P S2 -","- C28 H30 Au Cl Ir N2 O4 P S2 -","- C112 H120 Au4 Cl4 Ir4 N8 O16 P4 S8 -","4","1","","Aucott, Stephen M.; Bhattacharyya, Pravat; Milton, Heather L.; Slawin, Alexandra M. Z.; Woollins, J. Derek","N-Metallation of MS2N2 rings. X-ray crystal structures of [(?5-C5Me5)Ir(S2N2)Au(PPh3)][ClO4], [{(?5-C5Me5)Ir(S2N2)Au}2(�2-dppm)][ClO4]2 and [Au(dppeS-P)Cl]2","New Journal of Chemistry","2003","27","10","1466","","10.1039/b306847a","","","0.71073","MoKα","","0.0324","0.0233","","","0.0464","0.0479","","","","","","0.955","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050652","32.363","0.008","10.367","0.003","16.838","0.004","90","","90","","90","","5649","3","125","2","125","2","","","","","","","","9","P c a 21","P 2c -2ac","29","","","","- C46 H55 Au2 Cl4 Ir2 N4 O8 P2 S4 -","- C46 H55 Au2 Cl4 Ir2 N4 O8 P2 S4 -","- C184 H220 Au8 Cl16 Ir8 N16 O32 P8 S16 -","4","1","","Aucott, Stephen M.; Bhattacharyya, Pravat; Milton, Heather L.; Slawin, Alexandra M. Z.; Woollins, J. Derek","N-Metallation of MS2N2 rings. X-ray crystal structures of [(?5-C5Me5)Ir(S2N2)Au(PPh3)][ClO4], [{(?5-C5Me5)Ir(S2N2)Au}2(�2-dppm)][ClO4]2 and [Au(dppeS-P)Cl]2","New Journal of Chemistry","2003","27","10","1466","","10.1039/b306847a","","","0.71073","MoKα","","0.0282","0.0263","","","0.0637","0.0644","","","","","","0.958","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050653","14.6124","0.0017","12.5497","0.0014","24.402","0.003","90","","96.373","0.002","90","","4447.2","0.9","125","2","125","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","[{(h5-C5H5)Co(S2N2)Au}2(m2-dppm)][ClO4]2","","- C35 H32 Au2 Cl2 Co2 N4 O8 P2 S4 -","- C35 H32 Au2 Cl2 Co2 N4 O8 P2 S4 -","- C140 H128 Au8 Cl8 Co8 N16 O32 P8 S16 -","4","1","","Aucott, Stephen M.; Bhattacharyya, Pravat; Milton, Heather L.; Slawin, Alexandra M. Z.; Woollins, J. Derek","N-Metallation of MS2N2 rings. X-ray crystal structures of [(?5-C5Me5)Ir(S2N2)Au(PPh3)][ClO4], [{(?5-C5Me5)Ir(S2N2)Au}2(�2-dppm)][ClO4]2 and [Au(dppeS-P)Cl]2","New Journal of Chemistry","2003","27","10","1466","","10.1039/b306847a","","","0.71073","MoKα","","0.0916","0.0448","","","0.0942","0.1135","","","","","","1.004","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050654","8.791","0.008","10.577","0.006","8.663","0.006","90","","95.63","0.01","90","","801.6","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 Fe N O5 -","- C7 H5 Fe N O5 -","- C28 H20 Fe4 N4 O20 -","4","1","","Zeng, Ming-Hua; Gao, Song; Yu, Xiao-Lan; Chen, Xiao-Ming","Crystal structure and magnetic properties of a new three-dimensional coordination polymer constructed from (4,4) layers based on dimeric iron(ii) subunits","New Journal of Chemistry","2003","27","11","1599","","10.1039/b306872b","","","0.71073","MoKα","","0.0944","0.0635","","","0.1636","0.1839","","","","","","1.063","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050655","8.5468","0.0008","11.7744","0.0011","23.277","0.002","90","","96.143","0.002","90","","2329","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N9 O7 Pb -","- C18 H19 N9 O7 Pb -","- C72 H76 N36 O28 Pb4 -","4","1","","Fan, Jian; Shu, Mou-Hai; Okamura, Taka-aki; Li, Yi-Zhi; Sun, Wei-Yin; Tang, Wen-Xia; Ueyama, Norikazu","Solvent effect on the structure and topology of metal-organic frameworks with the rigid tripodal star ligand 1,3,5-tris(1-imidazolyl)benzene and lead(ii) nitrateElectronic supplementary information (ESI) available: crystal packing diagram of 1. See http://www.rsc.org/suppdata/nj/b3/b306876p/","New Journal of Chemistry","2003","27","9","1307","","10.1039/b306876p","","","0.71073","MoKα","","0.0625","0.0536","","","0.1486","0.16","","","","","","0.882","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050656","8.6278","0.0006","9.587","0.0007","11.5759","0.0008","84.345","0.004","84.226","0.005","75.04","0.004","917.72","0.11","200","","200","","","","","","","","","5","P -1","-P 1","2","(Pb(tib))(NO3)2","[Pb(tib)](NO3)2","","- C15 H12 N8 O6 Pb -","- C15 H12 N8 O6 Pb -","- C30 H24 N16 O12 Pb2 -","2","1","","Fan, Jian; Shu, Mou-Hai; Okamura, Taka-aki; Li, Yi-Zhi; Sun, Wei-Yin; Tang, Wen-Xia; Ueyama, Norikazu","Solvent effect on the structure and topology of metal-organic frameworks with the rigid tripodal star ligand 1,3,5-tris(1-imidazolyl)benzene and lead(ii) nitrateElectronic supplementary information (ESI) available: crystal packing diagram of 1. See http://www.rsc.org/suppdata/nj/b3/b306876p/","New Journal of Chemistry","2003","27","9","1307","","10.1039/b306876p","","","0.71069","MoKα","","0.0606","0.0538","","","0.134","0.1386","","","","","","1.087","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050657","10.0574","0.0008","13.4157","0.001","15.1345","0.0011","90","","91.235","0.002","90","","2041.6","0.3","200","0.2","200","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H15 Cl N2 -","- C7.996 H15 Cl N2 -","- C63.968 H120 Cl8 N16 -","8","1","","Reger, Daniel L.; Gardinier, James R.; Christian Grattan, T.; Smith, Monica R.; Smith, Mark D.","Synthesis of the silver(i) complex of CH2[CH(pz4Et)2]2 containing the unprecedented [Ag(NO3)4]3? anion: A general method for the preparation of 4-(alkyl)pyrazolesElectronic supplementary information (ESI) available: Crystal packing diagram of the unit cell of [Ag2{�-CH2[CH(pz4Et)2]2}2]3[Ag(NO3)4]2(acetonex/Et2Oy). See http://www.rsc.org/suppdata/nj/b3/b307306h/","New Journal of Chemistry","2003","27","11","1670","","10.1039/b307306h","","","0.71073","MoKα","","0.0597","0.0499","","","0.14","0.1466","","","","","","1.05","","","","has coordinates,has disorder","180060","2020-10-21","18:00:00",""
"7050658","12.2524","0.0007","21.8178","0.0013","27.0779","0.0016","68.573","0.001","80.934","0.001","87.349","0.001","6653.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C138 H192 Ag8 N56 O24 -","- C148.54 H172 Ag8 N56 O24 -","- C148.54 H172 Ag8 N56 O24 -","1","0.5","","Reger, Daniel L.; Gardinier, James R.; Christian Grattan, T.; Smith, Monica R.; Smith, Mark D.","Synthesis of the silver(i) complex of CH2[CH(pz4Et)2]2 containing the unprecedented [Ag(NO3)4]3? anion: A general method for the preparation of 4-(alkyl)pyrazolesElectronic supplementary information (ESI) available: Crystal packing diagram of the unit cell of [Ag2{�-CH2[CH(pz4Et)2]2}2]3[Ag(NO3)4]2(acetonex/Et2Oy). See http://www.rsc.org/suppdata/nj/b3/b307306h/","New Journal of Chemistry","2003","27","11","1670","","10.1039/b307306h","","","0.71073","MoKα","","0.1109","0.0727","","","0.2166","0.2481","","","","","","1.028","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050659","19.9396","0.0008","26.9479","0.0011","15.0854","0.0006","90","","90.967","0.001","90","","8104.7","0.6","150","0.2","150","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H15 Cl N2 -","- C8.01 H15 Cl N2 -","- C256.32 H480 Cl32 N64 -","32","4","","Reger, Daniel L.; Gardinier, James R.; Christian Grattan, T.; Smith, Monica R.; Smith, Mark D.","Synthesis of the silver(i) complex of CH2[CH(pz4Et)2]2 containing the unprecedented [Ag(NO3)4]3? anion: A general method for the preparation of 4-(alkyl)pyrazolesElectronic supplementary information (ESI) available: Crystal packing diagram of the unit cell of [Ag2{�-CH2[CH(pz4Et)2]2}2]3[Ag(NO3)4]2(acetonex/Et2Oy). See http://www.rsc.org/suppdata/nj/b3/b307306h/","New Journal of Chemistry","2003","27","11","1670","","10.1039/b307306h","","","0.71073","MoKα","","0.076","0.0564","","","0.1438","0.1529","","","","","","0.99","","","","has coordinates,has disorder","180060","2020-10-21","18:00:00",""
"7050660","17.2047","0.0011","11.8608","0.0008","7.3253","0.0005","90","","90","","90","","1494.81","0.17","150","0.2","150","0.2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C9 H8 N2 -","- C9 H8 N2 -","- C72 H64 N16 -","8","1","","Reger, Daniel L.; Gardinier, James R.; Christian Grattan, T.; Smith, Monica R.; Smith, Mark D.","Synthesis of the silver(i) complex of CH2[CH(pz4Et)2]2 containing the unprecedented [Ag(NO3)4]3? anion: A general method for the preparation of 4-(alkyl)pyrazolesElectronic supplementary information (ESI) available: Crystal packing diagram of the unit cell of [Ag2{�-CH2[CH(pz4Et)2]2}2]3[Ag(NO3)4]2(acetonex/Et2Oy). See http://www.rsc.org/suppdata/nj/b3/b307306h/","New Journal of Chemistry","2003","27","11","1670","","10.1039/b307306h","","","0.71073","MoKα","","0.0427","0.0354","","","0.0824","0.086","","","","","","1.055","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050661","5.9762","0.0002","13.9047","0.0004","14.2152","0.0004","71.79","0.002","84.29","0.002","87.967","0.002","1116.51","0.06","200","2","200","2","","","","","","","","4","P -1","-P 1","2","1,3,5-tris(4-cyanobenzoyl)benzene)","1,3,5-tris(4-cyanobenzoyl)benzene)","","- C30 H15 N3 O3 -","- C30 H15 N3 O3 -","- C60 H30 N6 O6 -","2","1","","Senthil Kumar, V. S.; Christopher Pigge, F.; Rath, Nigam P.","Concomitant polymorphism and supramolecular isomerism in 1,3,5-tris(4-cyanobenzoyl)benzene","New Journal of Chemistry","2003","27","11","1554","","10.1039/b307492g","","","0.71073","MoKα","","0.0897","0.053","","","0.1201","0.1361","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050662","7.7072","0.0002","11.3057","0.0002","13.7913","0.0003","73.284","0.001","88.422","0.001","83.42","0.001","1143.33","0.04","165","2","165","2","","","","","","","","4","P -1","-P 1","2","1,3,5-tris(4-cyanobenzoyl)benzene)","1,3,5-tris(4-cyanobenzoyl)benzene)","","- C30 H15 N3 O3 -","- C30 H15 N3 O3 -","- C60 H30 N6 O6 -","2","1","","Senthil Kumar, V. S.; Christopher Pigge, F.; Rath, Nigam P.","Concomitant polymorphism and supramolecular isomerism in 1,3,5-tris(4-cyanobenzoyl)benzene","New Journal of Chemistry","2003","27","11","1554","","10.1039/b307492g","","","0.71073","MoKα","","0.0977","0.0445","","","0.0898","0.1084","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050663","15.169","0.002","8.461","0.0013","15.288","0.002","90","","94.228","0.003","90","","1956.8","0.5","567","2","567","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4,6-bis(trimethylsilyl)dibenzothiophene","","","- C18 H24 S Si2 -","- C18 H24 S Si2 -","- C72 H96 S4 Si8 -","4","1","","Chantson, Janine T.; Lotz, Simon; Ichharam, Vimal","Synthesis and structure of 4,6-disubstituted dibenzothiophenes and their use in the preparation of binuclear platinum(ii) complexes","New Journal of Chemistry","2003","27","12","1735","","10.1039/b307634m","","","0.71073","MoKα","","0.0588","0.0394","","","0.1026","0.1152","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050664","10.4977","0.0017","8.5629","0.0014","12.947","0.002","90","","106.813","0.003","90","","1114.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4,6-dibromo dibenzothiophene","4,6-dibromo dibenzothiophene","","- C12 H6 Br2 S -","- C12 H6 Br2 S -","- C48 H24 Br8 S4 -","4","1","","Chantson, Janine T.; Lotz, Simon; Ichharam, Vimal","Synthesis and structure of 4,6-disubstituted dibenzothiophenes and their use in the preparation of binuclear platinum(ii) complexes","New Journal of Chemistry","2003","27","12","1735","","10.1039/b307634m","","","0.71073","MoKα","","0.0754","0.049","","","0.1302","0.1449","","","","","","0.953","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050665","10.5135","0.0003","8.3306","0.0003","19.6638","0.0007","90","","90","","90","","1722.23","0.1","120","2","120","2","","","","","","","","5","C m c m","-C 2c 2","63","1,4,7,10-tetrathiacyclododecane-tetrabromotin(IV)","1,4,7,10-tetrathiacyclododecane-tetrabromotin(IV)","","- C8 H16 Br4 S4 Sn -","- C8 H16 Br4 S4 Sn -","- C32 H64 Br16 S16 Sn4 -","4","0.25","","Levason, William; Matthews, Melissa L.; Patel, Rina; Reid, Gillian; Webster, Michael","Unusual structural variations within a family of thioether macrocyclic complexes. Tin(iv) halide adducts of [12]-, [14]- and [16]-aneS4","New Journal of Chemistry","2003","27","12","1784","","10.1039/b307863a","","","0.71073","MoKα","","0.0447","0.0412","","","0.1046","0.1072","","","","","","1.062","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050666","11.2865","0.0003","11.5634","0.0003","13.3067","0.0004","104.865","0.001","103.475","0.001","92.859","0.001","1621.19","0.08","120","2","120","2","","","","","","","","6","P -1","-P 1","2","1,4,8,11-tetrathiacyclotetradecane-tetrabromotin(IV) dichloromethane solvate","1,4,8,11-tetrathiacyclotetradecane-tetrabromotin(IV) dichloromethane solvate","","- C10.67 H21.33 Br4 Cl1.33 S4 Sn -","- C10.6667 H21.3333 Br4 Cl1.33333 S4 Sn -","- C32 H64 Br12 Cl4 S12 Sn3 -","3","1.5","","Levason, William; Matthews, Melissa L.; Patel, Rina; Reid, Gillian; Webster, Michael","Unusual structural variations within a family of thioether macrocyclic complexes. Tin(iv) halide adducts of [12]-, [14]- and [16]-aneS4","New Journal of Chemistry","2003","27","12","1784","","10.1039/b307863a","","","0.71073","MoKα","","0.0635","0.0467","","","0.0997","0.1077","","","","","","1.034","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050667","19.4987","0.0007","10.0624","0.0003","10.9104","0.0003","90","","90","","90","","2140.66","0.12","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","1,5,9,13-tetrathiacyclohexadecane-tetrabromotin(IV)","1,5,9,13-tetrathiacyclohexadecane-tetrabromotin(IV)","","- C12 H24 Br4 S4 Sn -","- C12 H24 Br4 S4 Sn -","- C48 H96 Br16 S16 Sn4 -","4","1","","Levason, William; Matthews, Melissa L.; Patel, Rina; Reid, Gillian; Webster, Michael","Unusual structural variations within a family of thioether macrocyclic complexes. Tin(iv) halide adducts of [12]-, [14]- and [16]-aneS4","New Journal of Chemistry","2003","27","12","1784","","10.1039/b307863a","","","0.71073","MoKα","","0.0626","0.0535","","","0.1314","0.138","","","","","","1.039","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050668","9.7076","0.0003","12.642","0.0003","16.1419","0.0003","90","","98.468","0.002","90","","1959.39","0.09","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H30 Cl10 Cu2 N2 S4 -","- C26 H30 Cl10 Cu2 N2 S4 -","- C52 H60 Cl20 Cu4 N4 S8 -","2","0.5","","Sylvie Ferlay; Abdelaziz Jouaiti; Marielle Loï; Mir Wais Hosseini; André De Cian; Philippe Turek","Molecular tectonics: structural and magnetic properties of a discrete copper binuclear complex and a 1-D coordination network","New J. Chem.","2003","27","12","1801","1805","10.1039/b308944b","","","0.71073","Mo-Kα","","0.043","0.029","","0.066","","0.06","","","1.388","","","1.26","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050669","32.475","0.003","13.496","0.002","8.738","0.0005","90","","96.335","0.006","90","","3806.3","0.7","294","","294","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 B2 Cl2 Cu2 F8 N2 S4 -","- C24 H28 B2 Cl2 Cu2 F8 N2 S4 -","- C96 H112 B8 Cl8 Cu8 F32 N8 S16 -","4","0.5","","Sylvie Ferlay; Abdelaziz Jouaiti; Marielle Loï; Mir Wais Hosseini; André De Cian; Philippe Turek","Molecular tectonics: structural and magnetic properties of a discrete copper binuclear complex and a 1-D coordination network","New J. Chem.","2003","27","12","1801","1805","10.1039/b308944b","","","0.71073","Mo-Kα","","0.117","0.056","","0.196","","0.094","","","1.218","","","1.084","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050670","10.5204","0.0002","11.2241","0.0002","14.0039","0.0003","109.398","0.005","91.023","0.005","103.73","0.005","1506.71","0.08","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H21 Cl5 Hg N2 O4 -","- C28 H21 Cl5 Hg N2 O4 -","- C56 H42 Cl10 Hg2 N4 O8 -","2","1","","Grosshans, Philippe; Jouaiti, Abdelaziz; Kardouh, Nasser; Wais Hosseini, Mir; Kyritsakas, Nathalie","Molecular tectonics: design of coordinating tectons based on fluorene bearing pyridines and structural analysis of their coordination networks generated in the presence of mercury and cobalt salts","New Journal of Chemistry","2003","27","12","1806","","10.1039/b308947a","","","0.71073","Mo-Kα","","0.052","0.036","","0.161","","0.045","","","1.093","","","1.059","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050671","17.6763","0.0002","7.1511","0.0001","28.2492","0.0003","90","","91.544","0.005","90","","3569.54","0.08","173","","173","","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C75 H55 Cl5 Co N4 O11 -","- C75 H48 Cl5 Co0.5 N4 O11 -","- C150 H96 Cl10 Co N8 O22 -","2","0.5","","Grosshans, Philippe; Jouaiti, Abdelaziz; Kardouh, Nasser; Wais Hosseini, Mir; Kyritsakas, Nathalie","Molecular tectonics: design of coordinating tectons based on fluorene bearing pyridines and structural analysis of their coordination networks generated in the presence of mercury and cobalt salts","New Journal of Chemistry","2003","27","12","1806","","10.1039/b308947a","","","0.71073","Mo-Kα","","0.116","0.078","","0.169","","0.105","","","1.372","","","1.284","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050672","15.9838","0.0016","5.2038","0.0005","20.426","0.002","90","","90","","90","","1699","0.3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H20 N2 O2 S2 -","- C18 H20 N2 O2 S2 -","- C72 H80 N8 O8 S8 -","4","0.5","","Elsegood, Mark R. J.; Holmes, Kathryn E.; Kelly, Paul F.; Parr, Jonathan; Stonehouse, Julia M.","The preparation and structure of novel sulfimide systems; X-ray crystal structures of 1,4-(PhS{NH})2C6H4 (and dihydrate), 1,2-(PhS{NH})(PhS)C6H4·H2O and of [Ph2SNH] and its hydrate","New Journal of Chemistry","2002","26","2","202","","10.1039/b103502a","","","0.71073","MoKα","","0.1068","0.0527","","","0.1021","0.1278","","","","","","1.021","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050673","5.5099","0.0002","8.5604","0.0004","16.5197","0.0007","90","","92.699","0.002","90","","778.32","0.06","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 N2 S2 -","- C18 H16 N2 S2 -","- C36 H32 N4 S4 -","2","0.5","","Elsegood, Mark R. J.; Holmes, Kathryn E.; Kelly, Paul F.; Parr, Jonathan; Stonehouse, Julia M.","The preparation and structure of novel sulfimide systems; X-ray crystal structures of 1,4-(PhS{NH})2C6H4 (and dihydrate), 1,2-(PhS{NH})(PhS)C6H4·H2O and of [Ph2SNH] and its hydrate","New Journal of Chemistry","2002","26","2","202","","10.1039/b103502a","","","0.71073","MoKα","","0.0407","0.0399","","","0.0979","0.0982","","","","","","1.23","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7050674","20.698","0.006","28.122","0.008","5.5475","0.0015","90","","94.837","0.005","90","","3217.5","1.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O S2 -","- C18 H16 N O S2 -","- C144 H128 N8 O8 S16 -","8","2","","Elsegood, Mark R. J.; Holmes, Kathryn E.; Kelly, Paul F.; Parr, Jonathan; Stonehouse, Julia M.","The preparation and structure of novel sulfimide systems; X-ray crystal structures of 1,4-(PhS{NH})2C6H4 (and dihydrate), 1,2-(PhS{NH})(PhS)C6H4·H2O and of [Ph2SNH] and its hydrate","New Journal of Chemistry","2002","26","2","202","","10.1039/b103502a","","","0.71073","MoKα","","0.1898","0.0995","","","0.2108","0.257","","","","","","1.078","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050675","5.1467","0.0004","20.1417","0.0014","21.4008","0.0014","90","","90","","90","","2218.5","0.3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H13 N O S -","- C12 H13 N O S -","- C96 H104 N8 O8 S8 -","8","1","","Elsegood, Mark R. J.; Holmes, Kathryn E.; Kelly, Paul F.; Parr, Jonathan; Stonehouse, Julia M.","The preparation and structure of novel sulfimide systems; X-ray crystal structures of 1,4-(PhS{NH})2C6H4 (and dihydrate), 1,2-(PhS{NH})(PhS)C6H4·H2O and of [Ph2SNH] and its hydrate","New Journal of Chemistry","2002","26","2","202","","10.1039/b103502a","","","0.71073","MoKα","","0.0455","0.0321","","","0.0822","0.0898","","","","","","1.022","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050676","5.6702","0.0004","8.9745","0.0006","40.53","0.003","90","","90.97","0.002","90","","2062.2","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H11 N S -","- C12 H11 N S -","- C96 H88 N8 S8 -","8","2","","Elsegood, Mark R. J.; Holmes, Kathryn E.; Kelly, Paul F.; Parr, Jonathan; Stonehouse, Julia M.","The preparation and structure of novel sulfimide systems; X-ray crystal structures of 1,4-(PhS{NH})2C6H4 (and dihydrate), 1,2-(PhS{NH})(PhS)C6H4·H2O and of [Ph2SNH] and its hydrate","New Journal of Chemistry","2002","26","2","202","","10.1039/b103502a","","","0.71073","MoKα","","0.0581","0.0479","","","0.094","0.0973","","","","","","1.167","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050677","22.2498","0.0005","22.2498","0.0005","13.304","0.0004","90","","90","","90","","6586.2","0.3","173","","173","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C76 H66 N8 O16 -","- C76 H40 N8 O16 -","- C304 H160 N32 O64 -","4","0.25","","Zimmer, Bertrand; Bulach, Véronique; Drexler, Cathy; Erhardt, Sabine; Hosseini, Mir Wais; De Cian, André","Design, synthesis, structural analysis and atropoisomerisation studies of polynucleating ligands based on porphyrins bearing catechol units","New Journal of Chemistry","2002","26","1","43","57","10.1039/b104084g","","","0.71073","Mo-Kα","","0.116","0.062","","0.087","","0.074","","","1.523","","","1.344","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050678","12.7436","0.0002","12.9855","0.0003","39.3596","0.0009","90","","92.368","0.005","90","","6507.7","0.2","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C149 H110 Cl10 N16 O24 -","- C149 H58 Cl10 N16 O24 -","- C298 H116 Cl20 N32 O48 -","2","0.5","","Zimmer, Bertrand; Bulach, Véronique; Drexler, Cathy; Erhardt, Sabine; Hosseini, Mir Wais; De Cian, André","Design, synthesis, structural analysis and atropoisomerisation studies of polynucleating ligands based on porphyrins bearing catechol units","New Journal of Chemistry","2002","26","1","43","57","10.1039/b104084g","","","0.71073","Mo-Kα","","0.165","0.071","","0.391","","0.082","","","7.546","","","1.101","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050679","12.129","0.003","11.168","0.001","13.627","0.003","90","","108.6","0.02","90","","1749.5","0.6","294","","294","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C44 H34 N8 -","- C44 H26 N8 -","- C88 H52 N16 -","2","1","","Zimmer, Bertrand; Bulach, Véronique; Drexler, Cathy; Erhardt, Sabine; Hosseini, Mir Wais; De Cian, André","Design, synthesis, structural analysis and atropoisomerisation studies of polynucleating ligands based on porphyrins bearing catechol units","New Journal of Chemistry","2002","26","1","43","57","10.1039/b104084g","","","0.71073","Mo-Kα","","0.259","0.042","","0.21","","0.048","","","4.608","","","1.031","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7050680","7.81","0.002","19.273","0.002","16.189","0.003","90","","91.99","0.02","90","","2435.3","0.8","298.2","","298.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 Ho N5 O14 Zn -","- C18 H20 Ho N5 O14 Zn -","- C72 H80 Ho4 N20 O56 Zn4 -","4","1","","Wong, Wai-Kwok; Liang, Hongze; Wong, Wai-Yeung; Cai, Zongwei; Li, King-Fai; Cheah, Kok-Wai","Synthesis and near-infrared luminescence of 3d-4f bi-metallic Schiff base complexes","New Journal of Chemistry","2002","26","3","275","","10.1039/b104175b","","","0.7107","MoKalpha","","","0.0326","","","0.0367","","","","","1.235","1.235","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050681","11.052","0.014","11.696","0.014","14.049","0.017","78.445","0.01","74.361","0.01","73.854","0.01","1664","4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H28 Cl Cu N4 O4 -","- C40 H28 Cl Cu N4 O4 -","- C80 H56 Cl2 Cu2 N8 O8 -","2","1","","Naskar, Jnan P.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","Chemistry of the copper(I)‒water bond. Some new observations","New Journal of Chemistry","2002","26","1","170","","10.1039/b105443k","","","0.71073","MoKα","","0.1829","0.1162","","","0.3027","0.3402","","","","","","1.068","","","","has coordinates,has disorder","180060","2020-10-21","18:00:00",""
"7050682","9.166","0.012","13.014","0.017","17.57","0.02","90","","90","","90","","2096","5","293","2","293","2","","","","","","","","7","P 2 21 21","P 2bc 2","18","","","","- C20 H18 B Cu F4 N2 O2 -","- C20 H14 B Cu F4 N2 O1.99 -","- C80 H56 B4 Cu4 F16 N8 O7.96 -","4","1","","Naskar, Jnan P.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","Chemistry of the copper(I)‒water bond. Some new observations","New Journal of Chemistry","2002","26","1","170","","10.1039/b105443k","","","0.71073","MoKα","","0.1221","0.0726","","","0.1863","0.2103","","","","","","0.967","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050683","15.08","0.02","9.895","0.014","8.7","0.014","90","","90","","90","","1298","3","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C10 H12 B Cu F4 N2 O -","- C10 H10 B Cu F4 N2 O -","- C40 H40 B4 Cu4 F16 N8 O4 -","4","1","","Naskar, Jnan P.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","Chemistry of the copper(I)‒water bond. Some new observations","New Journal of Chemistry","2002","26","1","170","","10.1039/b105443k","","","0.71073","MoKα","","0.0948","0.0721","","","0.1833","0.1949","","","","","","1.11","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050684","34.9413","0.0015","24.8105","0.001","17.168","0.0007","90","","95.362","0.001","90","","14818","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H88 Br3 Cu2 N4 -","- C56 H88 Br3 Cu2 N4 -","- C448 H704 Br24 Cu16 N32 -","8","1","","Kickelbick, Guido; Pintauer, Tomislav; Matyjaszewski, Krzysztof","Structural comparison of CuII complexes in atom transfer radical polymerization","New Journal of Chemistry","2002","26","4","462","","10.1039/b105454f","","","0.71073","MoKα","","0.1917","0.1185","","","0.3138","0.3798","","","","","","1.257","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050685","14.7679","0.0003","16.1912","0.0004","18.8663","0.0003","90","","90","","90","","4511.12","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H65 Br2 Cu N3 -","- C42 H65 Br2 Cu N3 -","- C168 H260 Br8 Cu4 N12 -","4","1","","Kickelbick, Guido; Pintauer, Tomislav; Matyjaszewski, Krzysztof","Structural comparison of CuII complexes in atom transfer radical polymerization","New Journal of Chemistry","2002","26","4","462","","10.1039/b105454f","","","0.71073","MoKα","","0.0513","0.0393","","","0.0858","0.0913","","","","","","0.991","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050686","15.164","0.003","13.664","0.003","14.846","0.003","90","","100.35","0.03","90","","3026.1","1.1","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H23 Br2 Cu N3 -","- C9 H23 Br2 Cu N3 -","- C72 H184 Br16 Cu8 N24 -","8","2","","Kickelbick, Guido; Pintauer, Tomislav; Matyjaszewski, Krzysztof","Structural comparison of CuII complexes in atom transfer radical polymerization","New Journal of Chemistry","2002","26","4","462","","10.1039/b105454f","","","0.71073","MoKα","","0.0375","0.0252","","","0.0518","0.0563","","","","","","1.074","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050687","15.2858","0.0002","8.082","","15.0421","0.0002","90","","90","","90","","1858.3","0.03","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C14 H32 Br2 Cu N4 -","- C14 H32 Br2 Cu N4 -","- C56 H128 Br8 Cu4 N16 -","4","1","","Kickelbick, Guido; Pintauer, Tomislav; Matyjaszewski, Krzysztof","Structural comparison of CuII complexes in atom transfer radical polymerization","New Journal of Chemistry","2002","26","4","462","","10.1039/b105454f","","","0.71073","MoKα","","0.0541","0.0357","","","0.0704","0.0783","","","","","","0.982","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050688","15.4552","0.0004","8.0865","0.0002","14.6116","0.0003","90","","90","","90","","1826.14","0.08","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C12 H23 Br2 Cu N4 -","- C12 H23 Br2 Cu N4 -","- C48 H92 Br8 Cu4 N16 -","4","1","","Kickelbick, Guido; Pintauer, Tomislav; Matyjaszewski, Krzysztof","Structural comparison of CuII complexes in atom transfer radical polymerization","New Journal of Chemistry","2002","26","4","462","","10.1039/b105454f","","","0.71073","MoKα","","0.0377","0.0358","","","0.0988","0.1002","","","","","","1.126","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050689","9.5925","0.0004","9.6743","0.0003","18.3085","0.0008","83.959","0.003","78.664","0.002","77.06","0.002","1620.26","0.11","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H15 Ge I -","- C18 H15 Ge I -","- C72 H60 Ge4 I4 -","4","2","","Prince, Paul D.; Sean McGrady, G.; Steed, Jonathan W.","Weak interactions induce asymmetry in the crystal structures of triaryl derivatives of group 14 elements","New Journal of Chemistry","2002","26","4","457","","10.1039/b105457k","","","0.71073","MoKα","","0.045","0.0333","","","0.077","0.0818","","","","","","1.019","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050690","10.3444","0.0008","11.7723","0.0007","13.0869","0.0011","90","","110.328","0.004","90","","1494.4","0.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 F Ge -","- C18 H15 F Ge -","- C72 H60 F4 Ge4 -","4","1","","Prince, Paul D.; Sean McGrady, G.; Steed, Jonathan W.","Weak interactions induce asymmetry in the crystal structures of triaryl derivatives of group 14 elements","New Journal of Chemistry","2002","26","4","457","","10.1039/b105457k","","","0.71073","MoKα","","0.0759","0.0619","","","0.1585","0.1714","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050691","18.637","0.004","18.317","0.004","18.129","0.004","90","","98.38","0.03","90","","6123","2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Cl Ge -","- C18 H15 Cl Ge -","- C288 H240 Cl16 Ge16 -","16","4","","Prince, Paul D.; Sean McGrady, G.; Steed, Jonathan W.","Weak interactions induce asymmetry in the crystal structures of triaryl derivatives of group 14 elements","New Journal of Chemistry","2002","26","4","457","","10.1039/b105457k","","","0.71073","MoKα","","0.0833","0.0554","","","0.1201","0.1306","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050692","13.767","0.0004","4.353","0.0001","21.118","0.0007","90","","90.407","0.0012","90","","1265.52","0.06","150","1","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 N4 O5 -","- C13 H10 N4 O5 -","- C52 H40 N16 O20 -","4","1","","Urbanczyk-Lipkowska, Z.; Szczesna, B.","Cooperative effect of multiple hydrogen bonding involving nitro group - solid state dimeric self-assembly of o-, m-, p-hydroxyphenyl-2,4-dinitrophenylhydrazones","New Journal of Chemistry","2002","","","","","10.1039/b105498h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050693","9.7902","0.001","14.0346","0.001","9.8226","0.001","90","","101.32","0.03","90","0.1","1323.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 N4 O5 -","- C13 H10 N4 O5 -","- C52 H40 N16 O20 -","4","1","","Urbanczyk-Lipkowska, Z.; Szczesna, B.","Cooperative effect of multiple hydrogen bonding involving nitro group - solid state dimeric self-assembly of o-, m-, p-hydroxyphenyl-2,4-dinitrophenylhydrazones","New Journal of Chemistry","2002","","","","","10.1039/b105498h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050694","8.4297","0.0004","6.1857","0.0007","24.715","0.0014","90","","91.488","0.011","90","","1288.29","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 N4 O5 -","- C13 H10 N4 O5 -","- C52 H40 N16 O20 -","4","1","","Urbanczyk-Lipkowska, Z.; Szczesna, B.","Cooperative effect of multiple hydrogen bonding involving nitro group - solid state dimeric self-assembly of o-, m-, p-hydroxyphenyl-2,4-dinitrophenylhydrazones","New Journal of Chemistry","2002","","","","","10.1039/b105498h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050695","12.002","0.002","9.175","0.002","27.266","0.005","90","","102.15","0.03","90","","2935.2","1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H11.5 N4.5 O5 -","- C14 H11.5 N4.5 O5 -","- C112 H92 N36 O40 -","8","1","","Urbanczyk-Lipkowska, Z.; Szczesna, B.","Cooperative effect of multiple hydrogen bonding involving nitro group - solid state dimeric self-assembly of o-, m-, p-hydroxyphenyl-2,4-dinitrophenylhydrazones","New Journal of Chemistry","2002","","","","","10.1039/b105498h","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050696","10.779","0.017","13.887","0.017","16.42","0.02","87.558","0.01","80.704","0.01","83.014","0.01","2407","6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C55 H50 B Cu N6 O -","- C55 H50 B Cu N6 O -","- C110 H100 B2 Cu2 N12 O2 -","2","1","","Pal, Pankaj K.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","The electrooxidation of the tetraphenylborate ion revisited","New Journal of Chemistry","2002","26","3","367","","10.1039/b106356c","","","0.71073","MoKα","","0.1656","0.0758","","","0.2032","0.2431","","","","","","0.974","","","","has coordinates","180060","2020-10-21","18:00:00",""
"7050697","8.2411","0.0001","15.2287","0.0002","19.3672","0.0001","90","","90.207","0.001","90","","2430.59","0.05","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H11 Cl2 N Pd S -","- C10 H11 Cl2 N Pd S -","- C80 H88 Cl16 N8 Pd8 S8 -","8","2","","Fernández, Alberto; Vázquez-García, Digna; Fernández, Jesús J.; López-Torres, Margarita; Suárez, Antonio; Castro-Juiz, Samuel; Ortigueira, Juan M.; Vila, José M.","Cyclopalladated compounds derived from a [C,N,S] terdentate ligand: synthesis, characterization and reactivity. Crystal and molecular structures of [Pd{2-ClC6H3C(H)NCH2CH2SMe}(Cl)] and [{Pd[2-ClC6H3C(H)NCH2CH2SMe]}2{µ-Ph2P(CH2)4PPh2}][CF3SO3]2","New Journal of Chemistry","2002","26","1","105","","10.1039/b106511d","","","0.71073","MoKα","","0.0646","0.0372","","","0.0754","0.0856","","","","","","1.037","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050698","10.3501","0.0015","11.1288","0.0016","12.78","0.0019","74.691","0.003","82.642","0.003","82.434","0.003","1400.7","0.4","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C50 H50 Cl2 F6 N2 O6 P2 Pd2 S4 -","- C50 H50 Cl2 F6 N2 O6 P2 Pd2 S4 -","- C50 H50 Cl2 F6 N2 O6 P2 Pd2 S4 -","1","0.5","","Fernández, Alberto; Vázquez-García, Digna; Fernández, Jesús J.; López-Torres, Margarita; Suárez, Antonio; Castro-Juiz, Samuel; Ortigueira, Juan M.; Vila, José M.","Cyclopalladated compounds derived from a [C,N,S] terdentate ligand: synthesis, characterization and reactivity. Crystal and molecular structures of [Pd{2-ClC6H3C(H)NCH2CH2SMe}(Cl)] and [{Pd[2-ClC6H3C(H)NCH2CH2SMe]}2{µ-Ph2P(CH2)4PPh2}][CF3SO3]2","New Journal of Chemistry","2002","26","1","105","","10.1039/b106511d","","","0.71073","MoKα","","0.0992","0.0515","","","0.1207","0.1513","","","","","","0.994","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050699","14.376","0.003","15.528","0.003","18.926","0.004","75.08","0.03","69.97","0.03","65.96","0.03","3590.6","1.6","301","2","301","2","","","","","","","","8","P -1","-P 1","2","","","","- C24.75 H17 Cl2.5 F9 Ir N3 O9.5 S3 -","- C24.75 H15 Cl2.5 F9 Ir N3 O9.5 S3 -","- C99 H60 Cl10 F36 Ir4 N12 O38 S12 -","4","2","","Kam-Wing Lo, Kenneth; Chung, Chi-Keung; Chun-Ming Ng, Dominic; Zhu, Nianyong","Syntheses, characterisation and photophysical studies of novel biological labelling reagents derived from luminescent iridium(III) terpyridine complexes","New Journal of Chemistry","2002","26","1","81","","10.1039/b107163g","","","0.71069","MoKα","","0.063","0.0473","","","0.1337","0.1471","","","","","","0.998","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050700","14.819","0.002","16.5","0.004","19.295","0.003","90","","95.679","0.012","90","","4694.7","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[(n5-Cp)Fe(n6-C6H5)-NHN==C(Me)-(n5-C5H4)Fe(n5-Cp)]+PF6-","","- C23 H23 F6 Fe2 N2 P -","- C23 H23 F6 Fe2 N2 P -","- C184 H184 F48 Fe16 N16 P8 -","8","2","","Carolina Manzur; Mauricio Fuentealba; Lorena Millán; Francisco Gajardo; David Carrillo; Jose A. Mata; Sourisak Sinbandhit; Paul Hamon; Jean-René Hamon; Samia Kahlal; Jean-Yves Saillard","Homodimetallic iron(II) hydrazones: syntheses, spectroscopic, electrochemical, and theoretical investigations. X-Ray crystal structure of both syn- and anti- rotamers of [(η5-Cp)Fe(η6-C6H5)‒NHNC(Me)‒(η5-C5H4) Fe(η5-Cp)]+PF6−","New J. Chem.","2002","26","2","213","221","10.1039/b107631k","","","0.71073","MoKα","","0.0917","0.0472","","","0.1045","0.1211","","","","","","0.952","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050701","5.817","0.004","7.528","0.005","11.274","0.008","90","","93.26","0.01","90","","492.9","0.6","163","2","163","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H11 N -","- C13 H11 N -","- C26 H22 N2 -","2","0.5","","Cariati, Elena; Galli, Simona; Macchi, Piero; Roberto, Dominique; Sironi, A.; Srdanov, Vojislav I.; Ugo, Renato","","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050702","5.817","0.004","7.528","0.005","11.274","0.008","90","","93.26","0.01","90","","492.9","0.6","163","2","163","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C13 H11 N -","- C13 H11 N -","- C26 H22 N2 -","2","1","","Cariati, Elena; Galli, Simona; Macchi, Piero; Roberto, Dominique; Sironi, A.; Srdanov, Vojislav I.; Ugo, Renato","","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050703","12.915","0.001","19.757","0.001","19.01","0.001","90","","102.34","0.01","90","","4738.6","0.5","193","2","193","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H61 Cl7 N2 O2 S4 -","- C38 H61 Cl7 N2 O2 S4 -","- C152 H244 Cl28 N8 O8 S16 -","4","1","","Wilhelm, Michaela; Koch, Rainer; Strasdeit, Henry","Coordination chemistry of lipoic acid and related compounds. Part 4. Experimental and theoretical studies on the 1:2 proton complex of N-(1- adamantyl)lipoamide","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180061","2020-10-21","18:00:00",""
"7050704","17.024","0.005","13.573","0.003","8.4498","0.0019","90","","95.71","0.015","90","","1942.8","0.8","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H30 Fe N O6 P -","- C16 H30 Fe N O6 P -","- C64 H120 Fe4 N4 O24 P4 -","4","1","","Reynes, Olivier; Moutet, Jean-Claude; Pecaut, Jacques; Royal, Guy; Saint-Aman, Eric","(Ferrocenylmethyl)trimethylammonium cation: a very simple probe for the electro-chemical sensing of dihydrogen phosphate and ATP anionsElectronic supplementary information (ESI) available: cyclic voltammograms of 1 in the presence of increasing amounts of ATP2‒ or HSO4‒. See http://www.rsc.org/suppdata/nj/b1/b107713a/","New Journal of Chemistry","2002","26","1","9","","10.1039/b107713a","","","0.71073","MoKα","","0.0517","0.0301","","","0.0739","0.0882","","","","","","0.996","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050705","12.4048","0.0008","12.9345","0.0007","15.5773","0.001","93.282","0.003","107.93","0.003","106.375","0.003","2252.9","0.2","180","2","180","2","","","","","","","","4","P -1","-P 1","2","trimesic acid, 1,2-bis(4-pyridyl)ethane, 4:1 co-crystal hydrate","","","- C48 H38 N2 O25 -","- C48 H38 N2 O25 -","- C96 H76 N4 O50 -","2","1","","Almeida Paz, Filipe A.; Bond, Andrew D.; Khimyak, Yaroslav Z.; Klinowski, Jacek","Synthesis and characterization of a new layered compound of trimesic acidElectronic supplementary information (ESI) available: top view of the HxBTC anionic network (Fig. S1) and detailed hydrogen bond graph sets present in the interactions linking the two HxBTC sheets within a double layer (Fig. S2). See http://www.rsc.org/suppdata/nj/b1/b108083k/","New Journal of Chemistry","2002","26","4","381","","10.1039/b108083k","","","0.71073","MoKα","","0.1221","0.0584","","","0.1279","0.1557","","","","","","1.015","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050706","9.5535","0.0006","9.6338","0.0007","21.1761","0.0014","90","","100.831","0.001","90","","1914.3","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H38 Cl2 N2 O16 Pd -","- C32 H38 Cl2 N2 O16 Pd -","- C64 H76 Cl4 N4 O32 Pd2 -","2","0.5","","Lee, Derek Y. K.; Lam, Michael H. W.; Wong, Wai-Yeung","A novel molecular luminescent sensor for metal ions using deprotonated tetramethylpropane-1,1,3,3-tetracarboxylate as ionophore","New Journal of Chemistry","2002","26","3","330","","10.1039/b108087n","","","0.71073","MoKα","","0.0594","0.0393","","","0.1182","0.1271","","","","","","1.051","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050707","14.142","0.002","21.946","0.003","20.008","0.003","90","","90.146","0.003","90","","6209.7","1.5","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C70 H78 Mo N6 O4 -","- C70 H78 Mo N6 O4 -","- C280 H312 Mo4 N24 O16 -","4","1","","Gibson, Vernon C.; Redshaw, Carl; Elsegood, Mark R. J.","A novel ligand family based on bulky metallocalix[4 and 8]arene substituentsFirst presented at the 221st ACS National Meeting, San Diego, 1‒5th April 2001.","New Journal of Chemistry","2002","26","1","16","","10.1039/b108088c","","","0.6923","synchrotron","","0.1929","0.0926","","","0.1885","0.2341","","","","","","0.989","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050708","16.7686","0.0015","16.7686","0.0015","34.515","0.003","90","","90","","120","","8404.9","1.3","160","2","160","2","","","","","","","","5","P 32","P 32","145","","","","- C128 H150 Mo2 N10 O8 -","- C128 H148 Mo2 N10 O8 -","- C384 H444 Mo6 N30 O24 -","3","1","","Gibson, Vernon C.; Redshaw, Carl; Elsegood, Mark R. J.","A novel ligand family based on bulky metallocalix[4 and 8]arene substituentsFirst presented at the 221st ACS National Meeting, San Diego, 1‒5th April 2001.","New Journal of Chemistry","2002","26","1","16","","10.1039/b108088c","","","0.71073","MoKα","","0.1203","0.0718","","","0.1227","0.1429","","","","","","1.026","","","","has coordinates,has disorder","180061","2020-10-21","18:00:00",""
"7050709","12.804","0.001","16.86","0.03","15.137","0.002","90","","105.41","0.04","90","","3150","6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H24 F10 Fe N4 Pd -","- C33 H24 F10 Fe N4 Pd -","- C132 H96 F40 Fe4 N16 Pd4 -","4","1","","Carmen Carrión, M.; Díaz, Alberto; Guerrero, Ana; Jalón, Félix A.; Manzano, Blanca R.; Rodríguez, Ana","New palladium and platinum polyfluorophenyl complexes with pyrazolyl N-donor ligands. Analysis of the restricted rotation of the polyfluorophenyl rings","New Journal of Chemistry","2002","26","3","305","","10.1039/b108139j","","","0.7107","MoKα","","0.0843","0.038","","","0.072","0.1004","","","","","","0.982","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050710","18.624","0.003","11.2643","0.0017","11.6667","0.0016","90","","106.174","0.003","90","","2350.6","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H26 Fe2 O -","- C31 H26 Fe2 O -","- C124 H104 Fe8 O4 -","4","1","","Palomero, Juan; Mata, José A.; González, Florenci; Peris, Eduardo","Facile synthesis of first generation ferrocene dendrimers by a convergent approach using ditopic conjugated dendronsElectronic supplementary information (ESI) available: molecular structure of 2. See http://www.rsc.org/suppdata/nj/b1/b108142j/","New Journal of Chemistry","2002","26","3","291","","10.1039/b108142j","","","0.71073","MoKα","","0.0758","0.0479","","","0.1135","0.1226","","","","","","1.064","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050711","19.198","0.002","11.1627","0.0012","11.5538","0.0012","90","","102.89","0.002","90","","2413.6","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C32 H28 Fe2 -","- C32 H28 Fe2 -","- C128 H112 Fe8 -","4","1","","Palomero, Juan; Mata, José A.; González, Florenci; Peris, Eduardo","Facile synthesis of first generation ferrocene dendrimers by a convergent approach using ditopic conjugated dendronsElectronic supplementary information (ESI) available: molecular structure of 2. See http://www.rsc.org/suppdata/nj/b1/b108142j/","New Journal of Chemistry","2002","26","3","291","","10.1039/b108142j","","","0.71073","MoKα","","0.0565","0.0333","","","0.0763","0.0939","","","","","","1.028","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050712","11.1704","0.0016","11.4301","0.0017","18.24","0.003","75.62","0.003","74.322","0.003","64.449","0.003","1999.5","0.5","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C38 H28 Ag F3 N2 O6 P2 Ru S -","- C38 H28 Ag F3 N2 O6 P2 Ru S -","- C76 H56 Ag2 F6 N4 O12 P4 Ru2 S2 -","2","1","","Hai-Bin Song; Zheng-Zhi Zhang; Thomas C. W. Mak","Hetero-binuclear complexes containing a Ru0→Mn+ bond bridged by P,N-phosphine ligands: convenient synthesis of tridentate organometallic trans-Ru(CO)3(L)2(L=phosphine bearing an N-donor substituent) ligands","New J. Chem.","2002","26","1","113","119","10.1039/b108287f","","","0.71073","MoKα","","0.1287","0.0553","","","0.1187","0.1501","","","","","","0.929","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050713","14.6934","0.0008","12.7794","0.0007","24.9176","0.0014","90","","91.41","0.001","90","","4677.4","0.4","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C41 H50 Hg I2 N2 O6 P2 Ru -","- C41 H50 Hg I2 N2 O6 P2 Ru -","- C164 H200 Hg4 I8 N8 O24 P8 Ru4 -","4","1","","Hai-Bin Song; Zheng-Zhi Zhang; Thomas C. W. Mak","Hetero-binuclear complexes containing a Ru0→Mn+ bond bridged by P,N-phosphine ligands: convenient synthesis of tridentate organometallic trans-Ru(CO)3(L)2(L=phosphine bearing an N-donor substituent) ligands","New J. Chem.","2002","26","1","113","119","10.1039/b108287f","","","0.71073","MoKα","","0.0628","0.0311","","","0.0602","0.067","","","","","","0.883","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050714","14.682","0.003","12.739","0.003","24.921","0.005","90","","91.54","0.03","90","","4659.4","1.7","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C41 H50 Cd I2 N2 O6 P2 Ru -","- C41 H50 Cd I2 N2 O6 P2 Ru -","- C164 H200 Cd4 I8 N8 O24 P8 Ru4 -","4","1","","Hai-Bin Song; Zheng-Zhi Zhang; Thomas C. W. Mak","Hetero-binuclear complexes containing a Ru0→Mn+ bond bridged by P,N-phosphine ligands: convenient synthesis of tridentate organometallic trans-Ru(CO)3(L)2(L=phosphine bearing an N-donor substituent) ligands","New J. Chem.","2002","26","1","113","119","10.1039/b108287f","","","0.71073","MoKα","","0.0702","0.0601","","","0.1605","0.1688","","","","","","1.113","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050715","11.0622","0.0018","11.362","0.002","18.146","0.004","95.479","0.017","94.424","0.017","113.047","0.013","2072.7","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H42 Cl4 N2 O4 P2 Ru -","- C37 H42 Cl4 N2 O4 P2 Ru -","- C74 H84 Cl8 N4 O8 P4 Ru2 -","2","1","","Hai-Bin Song; Zheng-Zhi Zhang; Thomas C. W. Mak","Hetero-binuclear complexes containing a Ru0→Mn+ bond bridged by P,N-phosphine ligands: convenient synthesis of tridentate organometallic trans-Ru(CO)3(L)2(L=phosphine bearing an N-donor substituent) ligands","New J. Chem.","2002","26","1","113","119","10.1039/b108287f","","","0.71073","MoKα","","0.1363","0.067","","","0.1238","0.1531","","","","","","1.014","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050716","20.928","0.002","20.928","0.002","17.798","0.004","90","","90","","90","","7795","2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C36.5 H41 Cl3 N2 O4 P2 Ru -","- C36.5 H40 Cl3 N2 O4 P2 Ru -","- C292 H320 Cl24 N16 O32 P16 Ru8 -","8","0.5","","Hai-Bin Song; Zheng-Zhi Zhang; Thomas C. W. Mak","Hetero-binuclear complexes containing a Ru0→Mn+ bond bridged by P,N-phosphine ligands: convenient synthesis of tridentate organometallic trans-Ru(CO)3(L)2(L=phosphine bearing an N-donor substituent) ligands","New J. Chem.","2002","26","1","113","119","10.1039/b108287f","","","0.71073","MoKα","","0.0893","0.0487","","","0.1274","0.1464","","","","","","1.043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050717","11.094","0.0002","19.9527","0.0003","14.54","0.0003","90","","110.873","0.001","90","","3007.28","0.1","150","1","150","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H27 Br N8 Os -","- C34 H27 Br N8 Os -","- C136 H108 Br4 N32 Os4 -","4","1","","Das, Chayan; Peng, Shie-Ming; Lee, Gene-Hsiang; Goswami, Sreebrata","Osmium(II) complexes of 2-[(arylamido)phenylazo]pyridines. New examples of deamination reactions—X-ray structure and redox propertiesElectronic supplementary information (ESI) available: partial energy level diagrams and molecular orbitals of 1a, 2a and 4a, UV-vis spectra of 4 complexes and cyclic voltammograms of 1b, 2b and 4b. See http://www.rsc.org/suppdata/nj/b1/b108507g/","New Journal of Chemistry","2002","26","2","222","","10.1039/b108507g","","","0.71073","MoKα","","0.0282","0.0227","","0.0499","0.0482","","","","1.079","1.098","1.098","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050718","13.643","0.002","14.1915","0.0018","13.85","0.003","90","","91.36","0.02","90","","2680.8","0.8","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 Br N7 Os -","- C28 H22 Br N7 Os -","- C112 H88 Br4 N28 Os4 -","4","1","","Das, Chayan; Peng, Shie-Ming; Lee, Gene-Hsiang; Goswami, Sreebrata","Osmium(II) complexes of 2-[(arylamido)phenylazo]pyridines. New examples of deamination reactions—X-ray structure and redox propertiesElectronic supplementary information (ESI) available: partial energy level diagrams and molecular orbitals of 1a, 2a and 4a, UV-vis spectra of 4 complexes and cyclic voltammograms of 1b, 2b and 4b. See http://www.rsc.org/suppdata/nj/b1/b108507g/","New Journal of Chemistry","2002","26","2","222","","10.1039/b108507g","","","0.71073","MoKα","","0.0764","0.0353","","","0.065","0.0717","","","","","","1.033","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050719","38.4934","0.0007","38.4934","0.0007","9.7379","0.0002","90","","90","","120","","12495.9","0.4","150","1","150","1","","","","","","","","5","R -3 :H","-R 3","148","","","","- C28 H23 Br2 N7 Os -","- C28 H23 Br2 N7 Os -","- C504 H414 Br36 N126 Os18 -","18","1","","Das, Chayan; Peng, Shie-Ming; Lee, Gene-Hsiang; Goswami, Sreebrata","Osmium(II) complexes of 2-[(arylamido)phenylazo]pyridines. New examples of deamination reactions—X-ray structure and redox propertiesElectronic supplementary information (ESI) available: partial energy level diagrams and molecular orbitals of 1a, 2a and 4a, UV-vis spectra of 4 complexes and cyclic voltammograms of 1b, 2b and 4b. See http://www.rsc.org/suppdata/nj/b1/b108507g/","New Journal of Chemistry","2002","26","2","222","","10.1039/b108507g","","","0.71073","MoKα","","0.0399","0.0285","","0.0726","0.0611","","","","1.15","1.035","1.035","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050720","8.0001","0.0007","9.4959","0.0009","14.769","0.0013","80.96","0.002","74.773","0.002","82.454","0.002","1064.35","0.17","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C54 H34 Si2 -","- C54 H34 Si2 -","- C54 H34 Si2 -","1","0.5","","Wai-Yeung Wong; Albert W.-M Lee; Chun-Kin Wong; Guo-Liang Lu; Hongkui Zhang; Tian Mo; Kwun-Ting Lam","Synthesis and characterisation of new oligoacetylenic silanes","New J. Chem.","2002","26","3","354","360","10.1039/b108510g","","","0.71073","MoKα","","0.0695","0.0583","","","0.1741","0.189","","","","","","1.059","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050721","8.1175","0.0016","9.4246","0.0019","12.362","0.003","93.23","0.03","109.13","0.03","97.09","0.03","881.9","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H20 Cu N8 -","- C16 H20 Cu N8 -","- C32 H40 Cu2 N16 -","2","1","","Xie, Yongshu; Liu, Qingliang; Jiang, Hui; Du, Chenxia; Xu, Xiaolong; Yu, Minggao; Zhu, Yu","An unusual alternating ferro- and antiferromagnetic 1D hydrogen-bonded µ2-1,3-azide-bridged copper(II) complex: a dominant ferromagnetic couplingElectronic supplementary information (ESI) available: EPR spectra of 1 (Fig. S1) and fit of χMT data with the binuclear model (Fig. S2). See http://www.rsc.org/suppdata/nj/b1/b108511p/","New Journal of Chemistry","2002","26","1","176","","10.1039/b108511p","","","0.71073","MoKα","","0.0822","0.0557","","","0.1252","0.1403","","","","","","1.058","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050722","11.1287","0.0005","11.9739","0.0005","18.9832","0.0008","90","","90","","90","","2529.59","0.19","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C18 H21 Br Cu3 Mo N3 O S3 -","- C18 H21 Br Cu3 Mo N3 O S3 -","- C72 H84 Br4 Cu12 Mo4 N12 O4 S12 -","4","1","","Chi, Dae Yoon; Fun, H.; Hermann, W. A.; Song, Y.; Wang, Y.; Xin, X.","Sign alteration of nonlinear refraction of the isomorphous cubane-shaped heterothiometallic clusters originating from a skeleton atomic effect","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050723","11.968","0.005","19.102","0.004","11.209","0.002","90","","90","","90","","2562.3","1.3","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C18 H21 Cu3 I N3 O S3 W -","- C18 H21 Cu3 I N3 O S3 W -","- C72 H84 Cu12 I4 N12 O4 S12 W4 -","4","1","","Chi, Dae Yoon; Fun, H.; Hermann, W. A.; Song, Y.; Wang, Y.; Xin, X.","Sign alteration of nonlinear refraction of the isomorphous cubane-shaped heterothiometallic clusters originating from a skeleton atomic effect","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050724","15.1478","0.0003","14.6941","0.0004","12.6533","0.0004","90","","109.95","0.09","90","","2647","1","288","","288","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C12 H30 Cl Cu2 Fe K N10 O5 -","- C12 H20 Cl Cu2 Fe K N10 O5 -","- C48 H80 Cl4 Cu8 Fe4 K4 N40 O20 -","4","1","","Smail Triki; Franck Thetiot; Pala, Jean-Sala","{[CuII(pn)]2]Fell(CN)6]}. KCI.5H20 (pn = 1,3-diaminopropane): a two-dimensional bimetallic layered material with ""Cu4Fe3"" defective cubane units","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050725","9.0985","0.0006","9.3302","0.0004","20.88","0.0012","90","","96.591","0.003","90","","1760.81","0.17","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H25 Ag B F4 N O4 -","- C13 H25 Ag B F4 N O4 -","- C52 H100 Ag4 B4 F16 N4 O16 -","4","1","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.7107","MoKα","","0.0466","0.0363","","","0.0776","0.0802","","","","","","1.156","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050726","10.8857","0.0003","16.4547","0.0006","11.2887","0.0004","90","","100.677","0.002","90","","1987.04","0.12","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C13 H25 F6 K N O4 P -","- C13 H25 F6 K N O4 P -","- C52 H100 F24 K4 N4 O16 P4 -","4","1","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.7107","MoKα","","0.0397","0.0316","","","0.077","0.0812","","","","","","1.036","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050727","9.2947","0.0002","13.6796","0.0006","15.3903","0.0004","90","","96.365","0.002","90","","1944.78","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H25 N3 O10 Pb -","- C13 H25 N3 O10 Pb -","- C52 H100 N12 O40 Pb4 -","4","1","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.7107","MoKα","","0.0338","0.0279","","","0.0649","0.0674","","","","","","1.034","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050728","7.6545","0.0005","12.0537","0.0004","21.6309","0.0004","90.671","0.005","96.212","0.004","96.61","0.004","1970.28","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H52 N6 O21 Pb2 -","- C26 H50 N6 O21.045 Pb2 -","- C52 H100 N12 O42.09 Pb4 -","2","1","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.71073","MoKα","","0.0878","0.067","","","0.1733","0.1892","","","","","","1.032","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050729","8.4495","0.0005","9.4557","0.0003","27.68","0.002","90","","95.563","0.003","90","","2201.1","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H31 N3 O12 Pb -","- C15 H31 N3 O12 Pb -","- C60 H124 N12 O48 Pb4 -","4","1","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.7107","MoKα","","0.065","0.0404","","","0.0728","0.0788","","","","","","1.029","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050730","13.3966","0.0007","5.8041","0.0002","24.5126","0.0013","90","","91.767","0.002","90","","1905.08","0.16","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H29 Ag B F4 N O5 -","- C15 H29 Ag B F4 N O5 -","- C60 H116 Ag4 B4 F16 N4 O20 -","4","1","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.7107","MoKα","","0.0492","0.0316","","","0.0572","0.061","","","","","","1.039","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050731","10.589","0.002","8.5424","0.0017","23.835","0.005","90","","90.3","0.003","90","","2156","0.7","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C16 H31 Ag F6 N O5 P -","- C16 H31 Ag F6 N O5 P -","- C64 H124 Ag4 F24 N4 O20 P4 -","4","2","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.71073","MoKα","","0.062","0.0521","","","0.1189","0.1225","","","","","","1.063","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050732","14.829","0.003","19.689","0.004","8.5073","0.0017","90","","97.09","0.03","90","","2464.9","0.9","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","N-allyl-aza-18-crown-6","","","- C30 H64 Cu4 I6 N2 O12 -","- C30 H64 Cu4 I6 N2 O12 -","- C60 H128 Cu8 I12 N4 O24 -","2","0.5","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.71073","MoKα","","0.0835","0.0603","","","0.1265","0.136","","","","","","1.069","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050733","13.894","0.003","12.865","0.003","30.066","0.006","90","","90","","90","","5374","2","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H38 N4 O10 Pb -","- C20 H38 N4 O10 Pb -","- C160 H304 N32 O80 Pb8 -","8","1","","Arya, Pious; Channa, Asif; Cragg, Peter J.; Prince, Paul D.; Steed, Jonathan W.","C-Donor lariat ether 'scorpionates'","New Journal of Chemistry","2002","26","4","440","","10.1039/b108522k","","","0.71073","MoKα","","0.1388","0.0783","","","0.1156","0.129","","","","","","1.172","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050734","16.14","0.002","16.14","0.002","27.624","0.004","90","","90","","90","","7196","1.6","301","2","301","2","","","","","","","","6","I -4","I -4","82","","","","- C128 H116 Ag6 F12 P10 S4 -","- C128 H116 Ag6 F12 P10 S4 -","- C256 H232 Ag12 F24 P20 S8 -","2","0.25","","Wing-Wah Yam, Vivian; Chung-Chin Cheng, Eddie; Zhu, Nianyong","Synthesis, photophysics, and electrochemistry of hexanuclear silver(I) chalcogenolate complexes. X-Ray crystal structures of [Ag6(µ-dppm)4(µ3-SC6H4Me-p)4](PF6)2 and [Ag6(µ-dppm)4(µ3-SeC6H4Cl-p)4](PF6)2","New Journal of Chemistry","2002","26","3","279","","10.1039/b108759m","","","0.71073","MoKα","","0.0473","0.039","","","0.1093","0.1189","","","","","","1.128","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050735","16.021","0.002","16.021","0.002","27.512","0.004","90","","90","","90","","7061.6","1.6","301","2","301","2","","","","","","","","7","I -4","I -4","82","","","","- C124 H104 Ag6 Cl4 F12 P10 Se4 -","- C124 H104 Ag6 Cl4 F12 P10 Se4 -","- C248 H208 Ag12 Cl8 F24 P20 Se8 -","2","0.25","","Wing-Wah Yam, Vivian; Chung-Chin Cheng, Eddie; Zhu, Nianyong","Synthesis, photophysics, and electrochemistry of hexanuclear silver(I) chalcogenolate complexes. X-Ray crystal structures of [Ag6(µ-dppm)4(µ3-SC6H4Me-p)4](PF6)2 and [Ag6(µ-dppm)4(µ3-SeC6H4Cl-p)4](PF6)2","New Journal of Chemistry","2002","26","3","279","","10.1039/b108759m","","","0.71073","MoKα","","0.0507","0.0374","","","0.0984","0.1112","","","","","","1.042","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050736","10.4759","0.0012","14.738","0.0016","15.3325","0.0017","87.479","0.002","87.473","0.002","88.683","0.002","2362.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H50 Cu3 N28 O W2 -","- C28 H50 Cu3 N28 O W2 -","- C56 H100 Cu6 N56 O2 W4 -","2","1","","Li, Dong-Feng; Gao, Song; Zheng, Li-Min; Sun, Wei-Yin; Okamura, Taka-aki; Ueyama, Norikazu; Tang, Wen-Xia","A novel Cu(II)-W(V) bimetallic assembly magnet {[Cu(en)~2~]~3~[W(CN)~8~]~2~·H~2~O}\ιnfty (en = ethylenediamine) with cube-like W~8~Cu~12~ units from a coordinated anion template self-assembly reaction","New Journal of Chemistry","2002","26","4","485","489","10.1039/b108791f","","","0.71073","MoKα","","0.0812","0.0508","","","0.0678","0.0731","","","","","","0.967","","","","has coordinates,has disorder","180061","2020-10-21","18:00:00",""
"7050737","9.383","0.003","9.774","0.002","11.585","0.002","85.9","0.02","89.74","0.02","70.79","0.02","1000.5","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H14 F6 N2 O4 Pd -","- C18 H14 F6 N2 O4 Pd -","- C36 H28 F12 N4 O8 Pd2 -","2","1","","Bianchini, C.; Lee, H.M.; Mantovani, Giuseppe; Meli, Andrea; Oberhauser, Werner","Bis-alkoxycarbonylation of styrene by pyridinimine palladium catalysts","New Journal of Chemistry","2002","","","","","10.1039/b108804c","","","","","","","0.0636","","","0.1755","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050738","8.481","0.004","20.641","0.004","12.241","0.003","90","0.02","98.8","0.02","90","0.02","2117.7","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 F6 N2 O4 Pd -","- C19 H16 F6 N2 O4 Pd -","- C76 H64 F24 N8 O16 Pd4 -","4","1","","Bianchini, C.; Lee, H.M.; Mantovani, Giuseppe; Meli, Andrea; Oberhauser, Werner","Bis-alkoxycarbonylation of styrene by pyridinimine palladium catalysts","New Journal of Chemistry","2002","","","","","10.1039/b108804c","","","","","","","0.0667","","","0.2114","","","","","","","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050739","12.37","0.004","17.071","0.002","12.663","0.005","90","0.005","105.55","0.04","90","0.005","2576.1","1.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 F6 N2 O4 Pd -","- C22 H20 F6 N2 O4 Pd -","- C88 H80 F24 N8 O16 Pd4 -","4","1","","Bianchini, C.; Lee, H.M.; Mantovani, Giuseppe; Meli, Andrea; Oberhauser, Werner","Bis-alkoxycarbonylation of styrene by pyridinimine palladium catalysts","New Journal of Chemistry","2002","","","","","10.1039/b108804c","","","","","","","0.0752","","","0.2123","","","","","","","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050740","14.24","0.003","9.126","0.0018","8.1013","0.0016","90","","92.93","0.03","90","","1051.5","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C5 H6 Ag N O3 S4 -","- C5 H6 Ag N O3 S4 -","- C20 H24 Ag4 N4 O12 S16 -","4","1","","Jia, Chunyang; Liu, Cai-Ming; Xu, Wei; Zhang, Deqing; Zhu, Daoben; Huaiming Hu","Novel silver (I) complexes derived from tetrakis(methylthio)- tetrathiafulvalene and bis(ethylenedithio)tetrathiafulvalene with 3D and 1D structures","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050741","27.637","0.006","4.273","0.0009","18.839","0.004","90","","125.52","0.03","90","","1810.7","0.6","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C10 H8 Ag N2 O6 S8 -","- C10 H8 Ag N2 O6 S8 -","- C40 H32 Ag4 N8 O24 S32 -","4","1","","Jia, Chunyang; Liu, Cai-Ming; Xu, Wei; Zhang, Deqing; Zhu, Daoben; Huaiming Hu","Novel silver (I) complexes derived from tetrakis(methylthio)- tetrathiafulvalene and bis(ethylenedithio)tetrathiafulvalene with 3D and 1D structures","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180061","2020-10-21","18:00:00",""
"7050742","19.917","0.004","7.627","0.002","8.677","0.002","90","","90","","90","","1318.1","0.5","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","N,N'-Bis(2-pyridyl)-1,3-diaminobenzene","","- C16 H14 N4 -","- C16 H14 N4 -","- C64 H56 N16 -","4","0.5","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.1054","0.0378","","","0.1001","0.1103","","","","","","1.016","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050743","11.352","0.005","7.702","0.002","16.435","0.007","90","","90.36","0.03","90","","1436.9","1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N,N'-Bis(2-pyridyl)-1,3-diamino-2-methylbenzene","","- C17 H16 N4 -","- C17 H13.12 N4 -","- C68 H52.48 N16 -","4","1","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","1.54178","CuKα","","0.173","0.0719","","","0.1883","0.2205","","","","","","0.908","","","","has coordinates,has disorder","180061","2020-10-21","18:00:00",""
"7050744","7.778","0.002","9.003","0.002","10.24","0.002","101.77","0.03","97.54","0.03","105.52","0.03","663.1","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","N,N'-Bis(2-pyridyl)-1,4-diaminobenzene, polymorph alpha","","- C16 H14 N4 -","- C16 H14 N4 -","- C32 H28 N8 -","2","1","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.1126","0.0429","","","0.1109","0.122","","","","","","1.001","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050745","7.454","0.001","8.991","0.002","19.477","0.004","90","","90","","90","","1305.3","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","N,N'-Bis(2-pyridyl)-1,4-diaminobenzene, polymorph beta","","- C16 H14 N4 -","- C16 H14 N4 -","- C64 H56 N16 -","4","0.5","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.1205","0.0382","","","0.0971","0.1103","","","","","","0.963","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050746","8.118","0.002","9.361","0.002","11.803","0.002","100.62","0.03","101.57","0.03","114.2","0.03","765","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","N,N'-Bis(2-pyridyl)-1,5-diaminonaphthalene","","- C20 H16 N4 -","- C20 H16 N4 -","- C40 H32 N8 -","2","1","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.1108","0.0631","","","0.1689","0.2022","","","","","","0.962","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050747","14.761","0.003","13.162","0.003","18.341","0.004","90","","104.7","0.03","90","","3446.7","1.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(2-pyridyl)-4,4'-diaminobiphenyl","","- C22 H18 N4 -","- C22 H18 N4 -","- C176 H144 N32 -","8","1","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.1665","0.0502","","","0.1157","0.1346","","","","","","0.96","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050748","9.6437","0.0005","11.8742","0.0006","17.1611","0.0008","79.732","0.004","89.713","0.004","72.535","0.005","1842.06","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N,N'-Bis(2-pyridyl) -4,4'-oxybis(aminobenzene), polymorph alphafrom ethyl acetate","","- C22 H18 N4 O -","- C22 H18 N4 O -","- C88 H72 N16 O4 -","4","2","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.0741","0.0506","","","0.1343","0.15","","","","","","1.11","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050749","11.162","0.001","18.893","0.001","17.247","0.001","90","","100.89","0.01","90","","3571.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-Bis(2-pyridyl) -4,4'-oxybis(aminobenzene),polymorph beta from methanol","","- C22 H18 N4 O -","- C22 H18 N4 O -","- C176 H144 N32 O8 -","8","2","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.0895","0.0543","","","0.1299","0.1489","","","","","","1.143","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050750","34.619","0.007","18.823","0.004","5.61","0.001","90","","90","","90","","3655.7","1.3","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","N,N'-Bis(2-pyridyl) -4,4'-thiobis(aminobenzene)","","- C22 H18 N4 S -","- C22 H18 N4 S -","- C176 H144 N32 S8 -","8","0.5","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","1.54178","CuKα","","0.0352","0.0347","","","0.0898","0.0904","","","","","","1.074","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050751","9.756","0.002","17.048","0.003","22.116","0.004","90","","90","","90","","3678.3","1.2","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","N,N'-Bis(2-pyridyl) -4,4'-methylenebis(aminobenzene)","","- C23 H20 N4 -","- C23 H20 N4 -","- C184 H160 N32 -","8","1","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","1.54178","CuKα","","0.1621","0.0499","","","0.1247","0.161","","","","","","0.896","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050752","11.4291","0.001","14.5351","0.0013","11.9115","0.0011","90","","107.555","0.008","90","","1886.6","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(2-pyridyl)-3,3'-methylenebis(aminobenzene)","","- C23 H20 N4 -","- C23 H20 N4 -","- C92 H80 N16 -","4","0.5","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","0.71073","MoKα","","0.0653","0.0409","","","0.1089","0.1192","","","","","","1.05","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050753","15.039","0.002","15.039","0.002","8.896","0.002","90","","90","","90","","2012","0.6","293","2","293","2","","","","","","","","4","P 4 n c","P 4 -2n","104","","N,N'-Bis(2-pyridyl) -3,3'-methylenebis(aminobenzene) 0.5 ethanol solvate","","- C24 H23 N4 O0.5 -","- C24 H20 N4 O0.5 -","- C96 H80 N16 O2 -","4","0.5","","Bensemann, Igor; Gdaniec, Maria; Połoński, Tadeusz","Supramolecular structures formed by 2-aminopyridine derivatives.","New Journal of Chemistry","2002","26","4","448","","10.1039/b108861k","","","1.54178","CuKα","","0.0926","0.0355","","","0.0775","0.0908","","","","","","1.018","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050754","40.149","0.001","12.072","0.001","21.691","0.002","90","","91.97","0.02","90","","10506","1","298.2","","298.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H38 La2 N10 O27 -","- C22 H27 La2 N11 O30 -","- C176 H216 La16 N88 O240 -","8","1","","Wing-Tak, Wong; King-Fai, Li Billy; Kwok-Wai, Cheah; Po-Wan, Lai Winnie","Synthesis, crystal structures, luminescence and magnetic properties of lanthanide complexes containing 1,8-bis(2-hydroxybenzamido)-3,6-dioxaoctane ligand","New Journal of Chemistry","2002","","","","","10.1039/b108942k","","","","","","","0.066","","","0.0863","","","","","","","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050755","22.76","0.001","10.847","0.001","21.55","0.001","90","","106.83","0.02","90","","5092.3","0.7","298.2","","298.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H48 N14 O28 Pr2 -","- C28 H44 N14 O28 Pr2 -","- C112 H176 N56 O112 Pr8 -","4","0.5","","","","New Journal of Chemistry","2002","","","","","10.1039/b108942k","","","","","","","0.048","","","0.0593","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050756","16.3031","0.0006","19.6564","0.0008","19.668","0.0008","90","","90","","90","","6302.8","0.4","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C33 H43 N O8 U -","- C33 H43 N O8 U -","- C264 H344 N8 O64 U8 -","8","1","","Masci, Bernardo; Nierlich, Martine; Thuéry, Pierre","Trigonal versus tetragonal or pentagonal coordination of the uranyl ion by hexahomotrioxacalix[3]arenes: solid state and solution investigations","New Journal of Chemistry","2002","26","1","120","","10.1039/b108947c","","","0.71073","MoKα","","0.0515","0.0295","","","0.0518","0.0574","","","","","","1.008","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050757","14.0317","0.0007","21.9727","0.0014","16.3246","0.0007","90","","106.837","0.003","90","","4817.4","0.4","100","2","100","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C46 H71 N O9 U -","- C47.5 H51 N O9 U -","- C190 H204 N4 O36 U4 -","4","1","","Masci, Bernardo; Nierlich, Martine; Thuéry, Pierre","Trigonal versus tetragonal or pentagonal coordination of the uranyl ion by hexahomotrioxacalix[3]arenes: solid state and solution investigations","New Journal of Chemistry","2002","26","1","120","","10.1039/b108947c","","","0.71073","MoKα","","0.0905","0.0566","","","0.136","0.1541","","","","","","1.056","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050758","8.8676","0.0004","17.6548","0.0011","26.4488","0.0014","90","","90","","90","","4140.7","0.4","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C40 H57 N O8 U -","- C40 H41 N O8 U -","- C160 H164 N4 O32 U4 -","4","0.5","","Masci, Bernardo; Nierlich, Martine; Thuéry, Pierre","Trigonal versus tetragonal or pentagonal coordination of the uranyl ion by hexahomotrioxacalix[3]arenes: solid state and solution investigations","New Journal of Chemistry","2002","26","1","120","","10.1039/b108947c","","","0.71073","MoKα","","0.0756","0.0584","","","0.1494","0.1662","","","","","","1.051","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050759","25.2169","0.0006","16.501","0.0005","24.4065","0.0007","90","","112.739","0.002","90","","9366.3","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H69 N O9 U -","- C45 H69 N O9 U -","- C360 H552 N8 O72 U8 -","8","2","","Masci, Bernardo; Nierlich, Martine; Thuéry, Pierre","Trigonal versus tetragonal or pentagonal coordination of the uranyl ion by hexahomotrioxacalix[3]arenes: solid state and solution investigations","New Journal of Chemistry","2002","26","1","120","","10.1039/b108947c","","","0.71073","MoKα","","0.0726","0.0434","","","0.086","0.0947","","","","","","1.092","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050760","19.3226","0.0007","16.4355","0.0007","14.1831","0.0005","90","","90","","90","","4504.2","0.3","100","2","100","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C44 H69 N O11 U -","- C44 H44 N O11 U -","- C176 H176 N4 O44 U4 -","4","0.5","","Masci, Bernardo; Nierlich, Martine; Thuéry, Pierre","Trigonal versus tetragonal or pentagonal coordination of the uranyl ion by hexahomotrioxacalix[3]arenes: solid state and solution investigations","New Journal of Chemistry","2002","26","1","120","","10.1039/b108947c","","","0.71073","MoKα","","0.0768","0.047","","","0.1164","0.1292","","","","","","1.107","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050761","10.282","0.004","15.615","0.006","9.472","0.004","98.29","0.006","104.372","0.006","84.571","0.006","1455","1","294","1","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17.5 H16 N2 O2.5 -","- C17.5 H16 N2 O2.5 -","- C70 H64 N8 O10 -","4","2","","Field, Jeremy D.; Turner, Peter; Harding, Margaret M.; Hatzikominos, Theano; Kim, Linda","Carbocyclic molecular clefts incorporating hydrogen bonding features","New Journal of Chemistry","2002","26","6","720","","10.1039/b109055k","","","0.71073","MoKα","","0.1231","0.0636","","","0.1459","0.1584","","","","","","1.292","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050762","7.434","0.002","9.856","0.0014","29.368","0.009","90","","90","","90","","2151.8","0.9","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H18 N2 O6 -","- C29 H18 N2 O6 -","- C116 H72 N8 O24 -","4","1","","Field, Jeremy D.; Turner, Peter; Harding, Margaret M.; Hatzikominos, Theano; Kim, Linda","Carbocyclic molecular clefts incorporating hydrogen bonding features","New Journal of Chemistry","2002","26","6","720","","10.1039/b109055k","","","0.56356","synchrotron","","0.0452","0.0359","","","0.0771","0.0787","","","","","","1.055","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050763","35.8754","0.0006","17.6365","0.0003","43.1894","0.0008","90","","113.531","0.001","90","","25054.3","0.8","200","","200","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[Ag3(titmb)2]2[1,4-C6H4(COO)2]3×23H2O (1)","","- C108 H154 Ag6 N24 O35 -","- C108 H136 Ag6 N24 O35 -","- C864 H1088 Ag48 N192 O280 -","8","1","","Jian Fan; Wei-Yin Sun; Taka-aki Okamura; Jin Xie; Wen-Xia Tang; Norikazu Ueyama","First example of a dumbbell-like architecture containing M3L2 cages and terephthalate anions","New J. Chem.","","26","2","199","201","10.1039/b109141g","","","0.71073","MoKα","","0.1535","0.051","","","0.1009","0.1202","","","","","","0.819","","","","has coordinates","194585","2020-10-21","18:00:00",""
"7050764","14.6892","0.0005","21.5676","0.0008","16.0239","0.0007","90","","94.35","0.001","90","","5061.9","0.3","200","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[Ag3(titmb)2][NO3]3×5H2O (2)","","- C42 H58 Ag3 N15 O14 -","- C42 H48 Ag3 N15 O14 -","- C168 H192 Ag12 N60 O56 -","4","1","","Jian Fan; Wei-Yin Sun; Taka-aki Okamura; Jin Xie; Wen-Xia Tang; Norikazu Ueyama","First example of a dumbbell-like architecture containing M3L2 cages and terephthalate anions","New J. Chem.","","26","2","199","201","10.1039/b109141g","","","0.71073","MoKα","","0.1077","0.0742","","","0.2116","0.2238","","","","","","1.059","","","","has coordinates","194585","2020-10-21","18:00:00",""
"7050765","15.42","0.02","9.832","0.014","16.076","0.019","90","","96.673","0.01","90","","2421","5","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C20 H32 Cl2 N4 O4 Ru -","- C20 H32 Cl2 N4 O4 Ru -","- C80 H128 Cl8 N16 O16 Ru4 -","4","1","","Pal, Pankaj K.; Drew, Michael G. B.; Datta, Dipankar","Two simple precursor 2,2'-bisoxazoline complexes of ruthenium","New Journal of Chemistry","2002","26","1","24","","10.1039/b109294b","","","0.71073","MoKα","","0.0857","0.0457","","","0.1207","0.1429","","","","","","1.036","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050766","8.607","0.014","14.48","0.02","15.73","0.02","90","","90","","90","","1960","5","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H23 Cl3 N3 O3 Ru -","- C13 H23 Cl3 N3 O3 Ru -","- C52 H92 Cl12 N12 O12 Ru4 -","4","1","","Pal, Pankaj K.; Drew, Michael G. B.; Datta, Dipankar","Two simple precursor 2,2'-bisoxazoline complexes of ruthenium","New Journal of Chemistry","2002","26","1","24","","10.1039/b109294b","","","0.71073","MoKα","","0.0994","0.0581","","","0.1598","0.1835","","","","","","0.91","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050767","8.545","0.012","12.001","0.016","14.002","0.02","90","","90","","90","","1436","3","293","2","293","2","","","","","","","","8","P 2 21 21","P 2bc 2","18","","","","- C20 H32 Cl2 F6 N4 O4 P Ru -","- C10 H16 Cl F3 N2 O2 P0.5 Ru0.5 -","- C40 H64 Cl4 F12 N8 O8 P2 Ru2 -","4","1","","Pal, Pankaj K.; Drew, Michael G. B.; Datta, Dipankar","Two simple precursor 2,2'-bisoxazoline complexes of ruthenium","New Journal of Chemistry","2002","26","1","24","","10.1039/b109294b","","","0.71073","MoKα","","0.0479","0.0354","","","0.078","0.0832","","","","","","1.037","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050768","7.40022","0.00011","8.5669","0.00015","13.69231","0.00032","106.211","0.0014","90.8532","0.0011","98.7783","0.0012","822.26","","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H25 Cl N2 -","- C30 H50 Cl2 N4 O4 -","- C30 H50 Cl2 N4 O4 -","","","","Attfield, J.; Cole, J.C.; Cox, P.J.; Maginn, S.J.; Motherwell, W.D.S.; Nowell, H.; Shankland, K.","Structure solution and refinement of tetracaine hydrochloride from X-ray powder diffraction data","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050769","8.5942","0.0001","16.0218","0.0003","19.5448","0.0003","90","","90","","90","","2691.21","0.07","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H32 Fe N O4 P -","- C30 H32 Fe N O4 P -","- C120 H128 Fe4 N4 O16 P4 -","4","1","","Štěpnička, Petr","Synthesis, characterization and diastereoselective coordination of a planarly chiral, hybrid ferrocene ligand, (Sp)-2-(diphenylphosphino)ferrocenecarboxylic acid","New Journal of Chemistry","2002","26","5","567","","10.1039/b109495p","","","0.71073","MoKα","","0.0425","0.0333","","","0.0702","0.0741","","","","","","1.047","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050770","8.7508","0.0003","14.1915","0.0006","15.6483","0.0008","90","","90","","90","","1943.32","0.15","150","","150","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(Sp)-2-(diphenylphosphinoyl)ferrocenecarboxylic acid","","- C23 H19 Fe O3 P -","- C23 H19 Fe O3 P -","- C92 H76 Fe4 O12 P4 -","4","1","","Štěpnička, Petr","Synthesis, characterization and diastereoselective coordination of a planarly chiral, hybrid ferrocene ligand, (Sp)-2-(diphenylphosphino)ferrocenecarboxylic acid","New Journal of Chemistry","2002","26","5","567","","10.1039/b109495p","","","0.71073","MoKα","","0.0446","0.0363","","","0.0785","0.0828","","","","","","1.054","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050771","23.9653","0.0002","23.9653","0.0002","11.3015","0.0001","90","","90","","90","","6490.85","0.1","150","","150","","","","","","","","","7","P 41 21 2","P 4abw 2nw","92","","","","- C33.7 H33.4 Cl2.4 Fe O2 P Ru -","- C33.7 H33.4 Cl2.4 Fe O2 P Ru -","- C269.6 H267.2 Cl19.2 Fe8 O16 P8 Ru8 -","8","1","","Štěpnička, Petr","Synthesis, characterization and diastereoselective coordination of a planarly chiral, hybrid ferrocene ligand, (Sp)-2-(diphenylphosphino)ferrocenecarboxylic acid","New Journal of Chemistry","2002","26","5","567","","10.1039/b109495p","","","0.71073","MoKα","","0.0539","0.0495","","","0.1427","0.146","","","","","","1.094","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050772","11.27","0.003","11.754","0.003","15.67","0.004","100.07","0.03","98.45","0.03","111.88","0.03","1844.8","1","301.2","","301.2","","","","","","","","","6","P -1","-P 1","2","","","","- C35.5 H43 N2 O3 S5 Zn -","- C43 H30 N2 O4 S5 Zn -","- C86 H60 N4 O8 S10 Zn2 -","2","1","","Wing-Wah Yam, Vivian; Pui, Yung-Lin; Cheung, Kung-Kai; Zhu, Nianyong","Synthesis, photophysics, electrochemistry and binding studies of zinc(II) dithiolate crown complexes","New Journal of Chemistry","2002","26","5","536","","10.1039/b109497c","","","0.7107","MoKalpha","","","0.0481","","","0.0714","","","","","2.043","2.043","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050773","8.044","0.005","12.719","0.005","15.492","0.007","76.89","0.03","82.59","0.04","89.47","0.04","1530.5","1.3","220","2","220","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H35 N3 O8 P2 Pd -","- C28 H29 N3 O7 P2 Pd -","- C56 H58 N6 O14 P4 Pd2 -","2","1","","Inés García-Seijo, M.; Habtemariam, Abraha; Parsons, Simon; Gould, R. O.; Esther García-Fernández, M.","Reactivity of a cationic square-planar palladium(II) chloro complex containing bis[2-(diphenylphosphino)ethyl]amine: chloro substitutions by anionic ligands and formation of neutral digold(I) compounds possessing linear PAuX fragments. The X-Ray crystal structure of Au2[Ph2P(CH2)2N(NO)(CH2)2PPh2]Cl2","New Journal of Chemistry","2002","26","5","636","","10.1039/b109675n","","","1.54178","CuKα","","0.0887","0.0733","","","0.199","0.2161","","","","","","1.094","","","","has coordinates,has disorder","180061","2020-10-21","18:00:00",""
"7050774","20.245","0.003","15.725","0.002","17.788","0.002","90","","104.492","0.002","90","","5482.7","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H31 Cl2 N O P2 Pd -","- C28 H31 Cl2 N O P2 Pd -","- C224 H248 Cl16 N8 O8 P16 Pd8 -","8","2","","Inés García-Seijo, M.; Habtemariam, Abraha; Parsons, Simon; Gould, R. O.; Esther García-Fernández, M.","Reactivity of a cationic square-planar palladium(II) chloro complex containing bis[2-(diphenylphosphino)ethyl]amine: chloro substitutions by anionic ligands and formation of neutral digold(I) compounds possessing linear PAuX fragments. The X-Ray crystal structure of Au2[Ph2P(CH2)2N(NO)(CH2)2PPh2]Cl2","New Journal of Chemistry","2002","26","5","636","","10.1039/b109675n","","","0.71073","MoKα","","0.1447","0.058","","","0.11","0.1342","","","","","","0.926","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050775","11.722","0.004","12.209","0.004","12.64","0.004","114.823","0.013","101.696","0.019","98.816","0.017","1548.8","0.9","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H35 Br2 N O P2 Pd -","- C31 H35 Br2 N O P2 Pd -","- C62 H70 Br4 N2 O2 P4 Pd2 -","2","1","","Inés García-Seijo, M.; Habtemariam, Abraha; Parsons, Simon; Gould, R. O.; Esther García-Fernández, M.","Reactivity of a cationic square-planar palladium(II) chloro complex containing bis[2-(diphenylphosphino)ethyl]amine: chloro substitutions by anionic ligands and formation of neutral digold(I) compounds possessing linear PAuX fragments. The X-Ray crystal structure of Au2[Ph2P(CH2)2N(NO)(CH2)2PPh2]Cl2","New Journal of Chemistry","2002","26","5","636","","10.1039/b109675n","","","0.71073","MoKα","","0.0832","0.0466","","","0.097","0.1104","","","","","","1.001","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7050776","14.12","0.003","12.871","0.003","16.849","0.003","90","","109.72","0.03","90","","2882.5","1.2","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Au2 Cl2 N2 O P2 -","- C28 H28 Au2 Cl2 N2 O P2 -","- C112 H112 Au8 Cl8 N8 O4 P8 -","4","1","","Inés García-Seijo, M.; Habtemariam, Abraha; Parsons, Simon; Gould, R. O.; Esther García-Fernández, M.","Reactivity of a cationic square-planar palladium(II) chloro complex containing bis[2-(diphenylphosphino)ethyl]amine: chloro substitutions by anionic ligands and formation of neutral digold(I) compounds possessing linear PAuX fragments. The X-Ray crystal structure of Au2[Ph2P(CH2)2N(NO)(CH2)2PPh2]Cl2","New Journal of Chemistry","2002","26","5","636","","10.1039/b109675n","","","0.71073","MoKα","","0.0982","0.0515","","","0.0963","0.1104","","","","","","0.987","","","","has coordinates","288183","2023-12-08","14:43:00",""
"7050777","27.154","0.005","9.53","0.002","21.903","0.004","90","","97.57","0.03","90","","5618.6","1.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H23 O13 Tb -","- C28 H23 O13 Tb -","- C224 H184 O104 Tb8 -","8","1","","Liu, Gao-Feng; Qiao, Zheng-Ping; Wang, He-Zhou; Chen, Xiao-Ming; Yang, Guang","Synthesis, structures and photoluminescence of three terbium(iii) dicarboxylate coordination polymers","New Journal of Chemistry","2002","26","6","791","","10.1039/b109869a","","","0.71073","MoKα","","0.0472","0.0256","","","0.0536","0.0589","","","","","","1.047","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050778","8.5937","0.0009","29.016","0.003","16.5048","0.0018","90","","90.279","0.002","90","","4115.5","0.8","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H32 O19 Tb2 -","- C42 H32 O19 Tb2 -","- C168 H128 O76 Tb8 -","4","1","","Liu, Gao-Feng; Qiao, Zheng-Ping; Wang, He-Zhou; Chen, Xiao-Ming; Yang, Guang","Synthesis, structures and photoluminescence of three terbium(iii) dicarboxylate coordination polymers","New Journal of Chemistry","2002","26","6","791","","10.1039/b109869a","","","0.71073","MoKα","","0.0577","0.0471","","","0.1443","0.1559","","","","","","1.184","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050779","30.896","0.011","10.183","0.007","20.432","0.013","90","","118.75","","90","","5636","6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H40 N4 O15 Tb2 -","- C62 H40 N4 O15 Tb2 -","- C248 H160 N16 O60 Tb8 -","4","0.5","","Liu, Gao-Feng; Qiao, Zheng-Ping; Wang, He-Zhou; Chen, Xiao-Ming; Yang, Guang","Synthesis, structures and photoluminescence of three terbium(iii) dicarboxylate coordination polymers","New Journal of Chemistry","2002","26","6","791","","10.1039/b109869a","","","0.71073","MoKα","","0.0577","0.0388","","","0.0916","0.0996","","","","","","1.055","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050780","29.705","0.0007","11.151","0.0002","22.11","0.0005","90","","111.246","0.0011","90","","6826","0.3","150","2","150","2","","","","","","","synthesized by the authors","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H48 B18 Co Cs O8 -","- C16.5 H45 B18 Co Cs O7 -","- C132 H360 B144 Co8 Cs8 O56 -","8","1","","Grüner, Bohumír; Plešek, Jaromír; Báča, Jiří; Francois Dozol, Jean; Lamare, Veronique; Císařová, Ivana; Bělohradský, Martin; Čáslavský, Josef","Crown ether substituted cobalta bis(dicarbollide) ions as selective extraction agents for removal of Cs+ and Sr2+ from nuclear waste","New Journal of Chemistry","2002","26","7","867","","10.1039/b109956f","","","0.71073","MoKα","","0.0835","0.0737","","","0.2009","0.2094","","","","","","1.029","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050781","14.9254","0.0002","15.1776","0.0002","18.1566","0.0003","90","","92.4895","0.0006","90","","4109.16","0.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H36 Cl4 N2 Ni P2 -","- C46 H36 Cl4 N2 Ni P2 -","- C184 H144 Cl16 N8 Ni4 P8 -","4","1","","Sauthier, Mathieu; Leca, François; Fernando de Souza, Roberto; Bernardo-Gusmão, Katia; Trevisan Queiroz, Luiz Fernando; Toupet, Loïc; Réau, Régis","NiCl2(1,2-Diiminophosphorane) complexes: a new family of readily accessible and tuneable catalysts for oligomerisation of ethylene","New Journal of Chemistry","2002","26","5","630","","10.1039/b109992m","","","0.71069","MoKα","","0.0463","0.0367","","","0.092","0.0992","","","","","","1.022","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050782","16.921","0.004","16.112","0.004","17.597","0.005","90","","115.71","0.02","90","","4323","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 Cl2 N2 Ni P2 -","- C38.8 H34 Cl3.6 N2 Ni P2 -","- C155.2 H136 Cl14.4 N8 Ni4 P8 -","4","1","","Sauthier, Mathieu; Leca, François; Fernando de Souza, Roberto; Bernardo-Gusmão, Katia; Trevisan Queiroz, Luiz Fernando; Toupet, Loïc; Réau, Régis","NiCl2(1,2-Diiminophosphorane) complexes: a new family of readily accessible and tuneable catalysts for oligomerisation of ethylene","New Journal of Chemistry","2002","26","5","630","","10.1039/b109992m","","","0.71069","MoKα","","0.1551","0.0943","","","0.2803","0.3083","","","","","","1.035","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050783","10.6062","0.0002","10.6062","0.0002","31.1002","0.0008","90","","90","","90","","3498.51","0.13","293","2","293","2","","","","","","","","5","I 41 c d","I 4bw -2c","110","","bia(4-aminopyridine)bis(acetato)copper(II)","","- C14 H18 Cu N4 O4 -","- C14 H18 Cu N4 O4 -","- C112 H144 Cu8 N32 O32 -","8","0.5","","Lah, Nina; Koller, Joze; Giester, Gerald; Segedin, Primoz; Leban, Ivan","Copper(II) carboxylates with 4-aminopyridine: neutral mononuclear structures, isomerism of aceto compounds and a novel tetranuclear structure","New Journal of Chemistry","2002","26","7","933","","10.1039/b110051c","","","0.71073","MoKα","","0.0485","0.0424","","","0.1291","0.1371","","","","","","1.138","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050784","8.721","0.002","8.721","0.002","8.701","0.002","90","","90","","120","","573.1","0.2","123","2","123","2","","","","","","","chemical synthesis","3","P 32 2 1","P 32 2""","154","","Benzene/Dibromine Molecular Complex 1:1","","- C6 H6 Br2 -","- C6 H6 Br2 -","- C18 H18 Br6 -","3","0.5","","Vasilyev, Alexandr V.; Lindeman, Sergey V.; Kochi, Jay K.","Molecular structures of the metastable charge-transfer complexes of benzene (and toluene) with bromine as the pre-reactive intermediates in electrophilic aromatic bromination","New Journal of Chemistry","2002","26","5","582","","10.1039/b110169m","","","0.71073","MoKα","","0.0759","0.0634","","0.1781","0.1438","","","","1.171","1.18","1.18","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050785","5.5163","0.0012","11.715","0.002","13.551","0.003","79.761","0.003","80.887","0.003","85.556","0.004","849.8","0.3","123","2","123","2","","","","","","","chemical synthesis","3","P -1","-P 1","2","","Toluene/Dibromine Molecular Complex 1:1","","- C7 H8 Br2 -","- C7 H8 Br2 -","- C28 H32 Br8 -","4","2","","Vasilyev, Alexandr V.; Lindeman, Sergey V.; Kochi, Jay K.","Molecular structures of the metastable charge-transfer complexes of benzene (and toluene) with bromine as the pre-reactive intermediates in electrophilic aromatic bromination","New Journal of Chemistry","2002","26","5","582","","10.1039/b110169m","","","0.71073","MoKα","","0.0755","0.0385","","0.1018","0.0803","","","","1.037","1.056","1.056","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050786","27.4084","0.0013","12.0132","0.0005","18.325","0.0009","90","","103.171","0.008","90","","5875","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 N O4 P Pd -","- C34 H30 N O4 P Pd -","- C272 H240 N8 O32 P8 Pd8 -","8","1","","Vila, Jose M.; Castro-Juiz, Samuel; Fernandez, Alberto; Fernandez, Jesus J.; Lopez-Torres, Margarita; Suarez, Antonio; Vazquez-Garcia, Digna","Synthesis and Reactivity of Novel Tetranuclear Cyclometallated Complexes Derived From [C,N,O] Terdentate Ligands. Crystal Structure of [Pd{2,3,4-(MeO)3C6HC(H)=N[2-(O)C6H4]}(PPh3)]","New Journal of Chemistry","2002","","","","","10.1039/b110197h","","","","","","","","","","","","","","","","","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050787","11.86","0.004","8.114","0.003","32.848","0.01","90","","90.908","0.006","90","","3160.6","1.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H34 Cl4 Cu2 N6 O8 -","- C22 H34 Cl4 Cu2 N6 O8 -","- C88 H136 Cl16 Cu8 N24 O32 -","4","1","","Du, Miao; Guo, Ya-Mei; Bu, Xian-He; Ribas, Joan; Monfort, Montserrat","Ferromagnetic coupling in a unique Cu(II) metallacyclophane with functionalized diazamesocyclic ligands formed by Cu(II)-directed self-assembly: magneto-structural correlations for dichloro-bridged Cu(II) dinuclear complexes","New Journal of Chemistry","2002","26","5","645","","10.1039/b110465a","","","0.71073","MoKα","","0.1478","0.0611","","","0.1362","0.1673","","","","","","0.972","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050788","8.916","0.003","19.774","0.005","13.027","0.004","90","","106.411","0.006","90","","2203.2","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H50 Cl6 Cu2 N8 O8 -","- C36 H48 Cl6 Cu2 N8 O8 -","- C72 H96 Cl12 Cu4 N16 O16 -","2","0.5","","Du, Miao; Guo, Ya-Mei; Bu, Xian-He; Ribas, Joan; Monfort, Montserrat","Ferromagnetic coupling in a unique Cu(II) metallacyclophane with functionalized diazamesocyclic ligands formed by Cu(II)-directed self-assembly: magneto-structural correlations for dichloro-bridged Cu(II) dinuclear complexes","New Journal of Chemistry","2002","26","5","645","","10.1039/b110465a","","","0.71073","MoKα","","0.1447","0.0661","","","0.1285","0.1684","","","","","","0.955","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050789","8.2988","0.0017","9.1492","0.0018","12.431","0.003","93.27","0.03","107.02","0.03","113.53","0.03","811","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H24 N4 O14 S6 -","- C28 H24 N4 O14 S6 -","- C28 H24 N4 O14 S6 -","1","0.5","","Desroches, Cédric; Parola, Stéphane; Vocanson, Francis; Perrin, Monique; Lamartine, Roger; Létoffé, Jean-Marie; Bouix, Jean","Nitration of thiacalix[4]arene using nitrosium nitrate complexes: synthesis and characterization of tetranitro-, tetraamino-, and tetra(4-pyridylimino)tetrahydroxythiacalix[4]arene","New Journal of Chemistry","2002","26","5","651","","10.1039/b110609k","","","0.71073","MoKα","","0.1103","0.059","","","0.1426","0.1722","","","","","","1.016","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050790","8.5048","0.0003","10.2119","0.0004","11.522","0.0004","90","","92.241","0.001","90","","999.92","0.06","293","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C16 H30 N2 Ni O4 -","- C16 H30 N2 Ni O4 -","- C32 H60 N4 Ni2 O8 -","2","1","","Trimmel, Gregor; Lembacher, Christian; Kickelbick, Guido; Schubert, Ulrich","Sol-gel processing of alkoxysilyl-substituted nickel complexes for the preparation of highly dispersed nickel in silicaElectronic supplementary information (ESI) available: Tables S1‒S5 giving additional analytical data as described in the text and the exact quantities for the syntheses. See http://www.rsc.org/suppdata/nj/b1/b110612k/","New Journal of Chemistry","2002","26","6","759","","10.1039/b110612k","","","0.71073","MoKα","","0.0584","0.0477","","0.1288","0.1226","","","","1.045","1.022","1.022","","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050791","23.828","0.004","9.682","0.002","12.337","0.002","90","","96.912","0.013","90","","2825.5","0.9","293","2","150","0.2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H32 Cl N O8 S3 -","- C26 H32 Cl N O8 S3 -","- C104 H128 Cl4 N4 O32 S12 -","4","1","","Fedorova, Olga A.; Fedorov, Yuri V.; Vedernikov, Artem I.; Yescheulova, Olga V.; Gromov, Sergei P.; Alfimov, Michael V.; Kuz'mina, Lyudmila G.; Churakov, Andrei V.; Howard, Judith A. K.; Zaitsev, Sergei Yu.; Sergeeva, Tatyana I.; Möbius, Deitmar","Supramolecular assemblies of photochromic benzodithia-18-crown-6 ethers in crystals, solutions, and monolayersElectronic supplementary information (ESI) available: crystal data, data collection, and structure solution and refinement parameters. See http://www.rsc.org/suppdata/nj/b1/b110630a/","New Journal of Chemistry","2002","26","5","543","","10.1039/b110630a","","","0.71073","MoKα","","0.1581","0.0928","","0.3337","0.2181","","","","1.089","1.171","1.171","","","","","has coordinates,has disorder","180061","2020-10-21","18:00:00",""
"7050792","15.757","0.003","10.903","0.002","19.365","0.004","90","","110.46","0.03","90","","3117","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H43 Cu2 N16 O2 W -","- C20 H43 Cu2 N16 O2 W -","- C80 H172 Cu8 N64 O8 W4 -","4","0.5","","Li, Dong-feng; Gao, Song; Zheng, Li-min; Yu, Kai-bei; Tang, Wen-xia","Crystal structures and magnetic properties of two octacyanometalate-based tungstate(V)–copper(II) bimetallic assemblies","New Journal of Chemistry","2002","26","9","1190","1195","10.1039/b110635j","","","0.71073","MoKα","","0.0444","0.0398","","","0.0992","0.1013","","","","","","1.01","","","","has coordinates","275122","2022-05-06","17:14:58",""
"7050793","12.869","0.003","9.953","0.003","11.375","0.003","90","","90","","90","","1457","0.7","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C16 H33 Cu2 N14 O4 W -","- C16 H22 Cu2 N14 O4 W -","- C32 H44 Cu4 N28 O8 W2 -","2","0.5","","Li, Dong-feng; Gao, Song; Zheng, Li-min; Yu, Kai-bei; Tang, Wen-xia","Crystal structures and magnetic properties of two octacyanometalate-based tungstate(V)–copper(II) bimetallic assemblies","New Journal of Chemistry","2002","26","9","1190","1195","10.1039/b110635j","","","0.71073","MoKα","","0.0446","0.0381","","","0.062","0.063","","","","","","1.001","","","","has coordinates,has disorder","275122","2022-05-06","17:15:05",""
"7050794","6.8246","0.0007","13.9297","0.0017","14.2729","0.0017","90","","93.113","0.009","90","","1354.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H15 B Br2 N2 Si -","- C9 H15 B Br2 N2 Si -","- C36 H60 B4 Br8 N8 Si4 -","4","1","","Aldridge, Simon; Calder, Richard J.; Coombs, Deborah L.; Jones, Cameron; Steed, Jonathan W.; Coles, Simon; Hursthouse, Michael B.","Intramolecular base-stabilised adducts of main group halides","New Journal of Chemistry","2002","26","6","677","","10.1039/b110692a","","","0.71073","MoKα","","0.0826","0.0622","","","0.1337","0.1446","","","","","","1.019","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050795","9.8","0.002","12.045","0.002","5.9433","0.0012","90","","90","","90","","701.6","0.2","150","2","293","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C5 H11 B F N O2 -","- C5 H4 B F N O2 -","- C20 H16 B4 F4 N4 O8 -","4","0.5","","Aldridge, Simon; Calder, Richard J.; Coombs, Deborah L.; Jones, Cameron; Steed, Jonathan W.; Coles, Simon; Hursthouse, Michael B.","Intramolecular base-stabilised adducts of main group halides","New Journal of Chemistry","2002","26","6","677","","10.1039/b110692a","","","0.71073","MoKα","","0.1072","0.079","","","0.2346","0.2531","","","","","","1.124","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050796","9.2498","0.0018","9.7081","0.0019","17.738","0.004","93.62","0.03","90.61","0.03","104.26","0.03","1540.1","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C9 H15 Cl3 N2 Si Sn -","- C9 H15 Cl3 N2 Si Sn -","- C36 H60 Cl12 N8 Si4 Sn4 -","4","2","","Aldridge, Simon; Calder, Richard J.; Coombs, Deborah L.; Jones, Cameron; Steed, Jonathan W.; Coles, Simon; Hursthouse, Michael B.","Intramolecular base-stabilised adducts of main group halides","New Journal of Chemistry","2002","26","6","677","","10.1039/b110692a","","","0.71073","MoKα","","0.0386","0.0307","","","0.0769","0.0812","","","","","","0.98","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050797","14.633","0.002","7.328","0.003","11.725","0.001","90","","90","","90","","1257.3","0.6","298","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C6 H16 Cl4 Ge N2 -","- C6 H16 Cl4 Ge N2 -","- C24 H64 Cl16 Ge4 N8 -","4","1","","Ejfler, Jolanta; Szafert, Slawomir; Jiao, Haijun; Sobota, Piotr","Syntheses of new hexacoordinate germanium(IV) complexes. Crystal structures and properties of [GeCl4(TMEDA)] and [GeCl2(N3)2(TMEDA)]","New Journal of Chemistry","2002","26","6","803","","10.1039/b110770b","","","0.71073","MoKα","","0.1642","0.0414","","","0.1026","0.1418","","","","","","1.037","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050798","8.57","0.002","13.35","0.003","12.227","0.002","90","","108.63","0.03","90","","1325.6","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H16 Cl2 Ge N8 -","- C6 H16 Cl2 Ge N8 -","- C24 H64 Cl8 Ge4 N32 -","4","0.5","","Ejfler, Jolanta; Szafert, Slawomir; Jiao, Haijun; Sobota, Piotr","Syntheses of new hexacoordinate germanium(IV) complexes. Crystal structures and properties of [GeCl4(TMEDA)] and [GeCl2(N3)2(TMEDA)]","New Journal of Chemistry","2002","26","6","803","","10.1039/b110770b","","","0.71073","MoKα","","0.0485","0.039","","","0.102","0.1066","","","","","","1.084","","","","has coordinates","180061","2020-10-21","18:00:00",""
"7050799","6.043","0.002","11.192","0.002","15.715","0.002","90","","99.76","0.01","90","","1047.5","0.3","294.2","","294.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 B2 F4 N2 O2 -","- C22 H24 B2 F4 N2 O2 -","- C44 H48 B4 F8 N4 O4 -","2","0.5","","Fujimoto, Miki; Hashimoto, Masao; Itoh, Kuniaki","Photodimerizaion of Enaminoketo-natoboron Difluorides","New Journal of Chemistry","2002","","","","","10.1039/b110975h","","","","","","","0.0507","","","0.0473","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050800","13.936","0.004","8.744","0.002","14.796","0.002","90","","109.6","0.01","90","","1698.5","0.7","296.2","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 B2 Cl4 F4 N2 O2 -","- C34 H28 B2 Cl4 F4 N2 O2 -","- C68 H56 B4 Cl8 F8 N4 O4 -","2","0.5","","","","New Journal of Chemistry","2002","","","","","10.1039/b110975h","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050801","14.685","0.002","8.679","0.003","17.769","0.003","90","","111.75","0.01","90","","2103.4","0.7","289.2","","289.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C22 H24 B2 F4 N2 O2 -","- C21.87 H24 B1.58 F3.88 N1.57 O1.88 -","- C87.48 H96 B6.32 F15.52 N6.28 O7.52 -","4","1","","","","New Journal of Chemistry","2002","","","","","10.1039/b110975h","","","","","","","0.1181","","","0.0945","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050802","9.669","0.003","18.632","0.003","9.416","0.002","91.52","0.02","110.66","0.02","94.71","0.02","1579","0.6","298.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C33 H30 B2 Cl2 F4 N2 O2 -","- C33 H28 B2 Cl2 F4 N2 O2 -","- C66 H56 B4 Cl4 F8 N4 O4 -","2","1","","","","New Journal of Chemistry","2002","","","","","10.1039/b110975h","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050803","7.417","0.001","9.686","0.001","13.661","0.001","90","","93.3","0.01","90","","979.79","0.18","298.2","","298.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H4 Cu N7 -","- C7 H4 Cu N7 -","- C28 H16 Cu4 N28 -","4","1","","Yeung, Wai-Fun; Gao, Song; Wong, Wing-Tak; Lau, Tai-Chu","Antiferromagnetic ordering in a novel five-connected 3D polymer {Cu2(2,5-Me2pyz)[N(CN)2]4}n (2,5-Me2pyz2,5-dimethylpyrazine)Electronic supplementary information (ESI) available: plot of the temperature dependence of the ac susceptibility (Fig. S1). See http://www.rsc.org/suppdata/nj/b1/b111012h/","New Journal of Chemistry","2002","26","5","523","","10.1039/b111012h","","","0.7107","MoKalpha","","","0.0345","","","0.0448","","","","","1.451","1.451","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050804","23.255","0.0003","13.4512","0.0002","26.8143","0.0004","90","","111.477","0.001","90","","7805.3","0.2","142","2","142","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H11 Cl10.5 N24.5 O1.5 -","- C26 H11 Cl10.5 N24.5 O1.5 -","- C208 H88 Cl84 N196 O12 -","8","1","","Kroke, Edwin; Schwarz, Marcus; Horath-Bordon, Elisabeth; Kroll, Peter; Noll, Bruce; Norman, Arlan D.","Tri-s-triazine derivatives. Part I. From trichloro-tri-s-triazine to graphitic C~3~N~4~ structures","New Journal of Chemistry","2002","26","5","508","512","10.1039/b111062b","","","0.71073","MoKα","","0.1148","0.0798","","","0.136","0.1511","","","","","","1.235","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050805","9.6329","0.0001","9.6281","0.0001","15.9051","0.0001","89.994","0.001","99.576","0.001","118.901","0.001","1267.91","0.02","183","2","183","2","","","","","","","","4","P 1","P 1","1","","((S,S)-2-[2'-(2''-Acetylamino-3''-methyl-butyrylamino)-phenylethynyl]-N- (1-methyl-carbamoyl-ethyl)-benzamide","","- C26 H30 N4 O4 -","- C26 H30 N4 O4 -","- C52 H60 N8 O8 -","2","2","","Erdélyi, Máté; Langer, Vratislav; Karlén, Anders; Gogoll, Adolf","Insight into β-hairpin stability: a structural and thermodynamic study of diastereomeric β-hairpin mimeticsElectronic supplementary information (ESI) available: temperature and concentration-dependent chemical shifts and melting curves of the investigated molecules in different solvents and details of the X-ray analysis. See http://www.rsc.org/suppdata/nj/b1/b111241d/","New Journal of Chemistry","2002","26","7","834","","10.1039/b111241d","","","0.71073","MoKα","","0.0929","0.0588","","","0.1352","0.1607","","","","","","0.992","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050806","7.3857","0.0002","25.4539","0.001","9.5109","0.0004","90","","93.872","0.003","90","","1783.92","0.11","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H24 N O6 P -","- C17 H24 N O6 P -","- C68 H96 N4 O24 P4 -","4","2","","Gardner, Stuart; Motevalli, Majid; Shastri, Kirtida; Sullivan, Alice C.; Wyatt, Peter B.","Synthetic and structural chemistry of enantiomerically pure 1-phenyl-2-carboxyethylphosphonic acid and its derivativesElectronic supplementary information (ESI) available: Tables S1‒6. See http://www.rsc.org/suppdata/nj/b1/b111244a/","New Journal of Chemistry","2002","26","4","433","","10.1039/b111244a","","","0.71073","MoKα","","0.1234","0.0587","","","0.0966","0.1166","","","","","","0.974","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050807","10.716","0.002","10.737","0.002","26.151","0.004","90","","90","","90","","3008.9","0.9","160","2","160","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H41 N2 O3 P -","- C33 H41 N2 O3 P -","- C132 H164 N8 O12 P4 -","4","1","","Gardner, Stuart; Motevalli, Majid; Shastri, Kirtida; Sullivan, Alice C.; Wyatt, Peter B.","Synthetic and structural chemistry of enantiomerically pure 1-phenyl-2-carboxyethylphosphonic acid and its derivativesElectronic supplementary information (ESI) available: Tables S1‒6. See http://www.rsc.org/suppdata/nj/b1/b111244a/","New Journal of Chemistry","2002","26","4","433","","10.1039/b111244a","","","0.71073","MoKα","","0.2081","0.0555","","","0.1003","0.1381","","","","","","0.979","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050808","5.671","0.001","12.779","0.002","14.064","0.003","90","","90","","90","","1019.2","0.3","393","2","393","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H11 O5 P -","- C9 H11 O5 P -","- C36 H44 O20 P4 -","4","1","","Gardner, Stuart; Motevalli, Majid; Shastri, Kirtida; Sullivan, Alice C.; Wyatt, Peter B.","Synthetic and structural chemistry of enantiomerically pure 1-phenyl-2-carboxyethylphosphonic acid and its derivativesElectronic supplementary information (ESI) available: Tables S1‒6. See http://www.rsc.org/suppdata/nj/b1/b111244a/","New Journal of Chemistry","2002","26","4","433","","10.1039/b111244a","","","0.71073","MoKα","","0.1085","0.056","","","0.1342","0.1567","","","","","","0.949","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050809","6.7388","0.0002","8.7259","0.0003","14.5005","0.0006","103.643","0.001","94.729","0.002","106.122","0.002","785.96","0.05","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","3-{4-[4-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl}-1,1-diphenyl- prop-2-yn-1-ol","","- C42 H0 N2 O2 -","- C42 H30 N2 O2 -","- C42 H30 N2 O2 -","1","0.5","","Tanaka, Koichi; Asami, Masaya; Scott, Janet L.","A novel chromogenic host compound that shows sensitive color change upon inclusion crystallization","New Journal of Chemistry","2002","26","4","378","380","10.1039/b111359c","","","0.71073","MoKα","","0.11","0.0576","","","0.1215","0.1427","","","","","","0.995","","","","has coordinates","275163","2022-05-07","00:01:36",""
"7050810","8.8345","0.0001","12.1223","0.0001","19.1156","0.0001","102.698","0.001","93.471","0.001","97.473","0.001","1971.72","0.03","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","3-{4-[4-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl}-1,1-diphenyl- prop-2-yn-1-ol DMF solvate","","- C48 H44 N4 O4 -","- C48 H44 N4 O4 -","- C96 H88 N8 O8 -","2","1","","Tanaka, Koichi; Asami, Masaya; Scott, Janet L.","A novel chromogenic host compound that shows sensitive color change upon inclusion crystallization","New Journal of Chemistry","2002","26","4","378","380","10.1039/b111359c","","","0.71073","MoKα","","0.1061","0.0584","","","0.1241","0.1414","","","","","","1.026","","","","has coordinates,has disorder","275163","2022-05-07","00:01:36",""
"7050811","10.2033","0.0005","16.3289","0.0008","11.7551","0.0005","90","","96.269","0.003","90","","1946.79","0.16","183.2","","183.2","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C34 H31 Cl8 N P2 Pd S -","- C34 H31 Cl8 N P2 Pd S -","- C68 H62 Cl16 N2 P4 Pd2 S2 -","2","1","","Faller, Jack W.; Lloret-Fillol, Julio; Parr, Jonathan","Complexes of elements of groups 9 and 10 with new chiral chelating bisphosphine monosulfide and monoselenide ligands","New Journal of Chemistry","2002","26","7","883","","10.1039/b111422k","","","0.7107","MoKα","","0.0629","0.036","","0.049","","0.041","","","0.987","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050812","11.8372","0.0007","15.8445","0.0009","16.8452","0.0007","90","","90","","90","","3159.4","0.3","183.2","","183.2","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C32 H29 Cl2 N P2 Pd Se -","- C32 H29 Cl2 N P2 Pd Se -","- C128 H116 Cl8 N4 P8 Pd4 Se4 -","4","1","","Faller, Jack W.; Lloret-Fillol, Julio; Parr, Jonathan","Complexes of elements of groups 9 and 10 with new chiral chelating bisphosphine monosulfide and monoselenide ligands","New Journal of Chemistry","2002","26","7","883","","10.1039/b111422k","","","0.7107","MoKα","","0.067","0.038","","0.051","","0.041","","","1.028","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050813","11.8948","0.0004","15.3216","0.0005","16.8763","0.0006","90","","90","","90","","3075.66","0.18","183.2","","183.2","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C32 H29 Cl2 N P2 Pt Se -","- C32 H29 Cl2 N P2 Pt Se -","- C128 H116 Cl8 N4 P8 Pt4 Se4 -","4","1","","Faller, Jack W.; Lloret-Fillol, Julio; Parr, Jonathan","Complexes of elements of groups 9 and 10 with new chiral chelating bisphosphine monosulfide and monoselenide ligands","New Journal of Chemistry","2002","26","7","883","","10.1039/b111422k","","","0.7107","MoKα","","0.037","0.037","","0.039","","0.039","","","0.92","","","0.92","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050814","10.2048","0.0003","16.3146","0.0009","11.7788","0.0005","90","","96.615","0.003","90","","1947.96","0.15","183.2","","183.2","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C34 H31 Cl8 N P2 Pt S -","- C34 H31 Cl8 N P2 Pt S -","- C68 H62 Cl16 N2 P4 Pt2 S2 -","2","1","","Faller, Jack W.; Lloret-Fillol, Julio; Parr, Jonathan","Complexes of elements of groups 9 and 10 with new chiral chelating bisphosphine monosulfide and monoselenide ligands","New Journal of Chemistry","2002","26","7","883","","10.1039/b111422k","","","0.7107","MoKα","","0.0606","0.045","","0.056","","0.051","","","1.18","","","1.22","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050815","9.68","0.006","10.925","0.007","11.553","0.008","66.78","0.03","73.38","0.03","76.74","0.03","1066.4","1.2","294","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H23 Na O12 -","- C18 H23 Na O12 -","- C36 H46 Na2 O24 -","2","1","","Djaidi, Djamal; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Schroeter and Vossen's red salt revealed","New Journal of Chemistry","2002","26","5","614","","10.1039/b111448d","","","0.71073","MoKα","","","0.055","","","","0.073","","","","","","1.63","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050816","9.8982","0.0001","10.1089","0.0002","21.584","0.0003","84.213","0.001","83.627","0.001","60.722","0.001","1869.47","0.05","173","2","173","2","","","","","","","synthesis as described","6","P -1","-P 1","2","[Ti2FeCl(OiPr)9]","","","- C27 H63 Cl Fe O9 Ti2 -","- C27 H59.997 Cl Fe O9 Ti2 -","- C54 H119.994 Cl2 Fe2 O18 Ti4 -","2","1","","Nunes, Giovana G.; Reis, Dayane M.; Amorim, Priscila T.; Sá, Eduardo L.; Mangrich, Antonio S.; Evans, David J.; Hitchcock, Peter B.; Jeffery Leigh, G.; Nunes, Fábio S.; Soares, Jaísa F.","Novel double alkoxides of titanium(IV) and iron(II)/(III): synthetic, structural and spectroscopic studies","New Journal of Chemistry","2002","26","5","519","","10.1039/b111517k","","x-ray","0.71073","MoKα","","0.037","0.033","","","0.0826","0.0855","","","","","","1.051","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050817","13.9455","0.0003","38.1289","0.0012","16.0638","0.0005","90","","96.312","0.002","90","","8489.8","0.4","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","[Ti3(OiPr)9(OMe)2][Fe4TiCl4(O)(OiPr)9]","","","- C56 H132 Cl4 Fe4 O21 Ti4 -","- C56 H132 Cl4 Fe4 O21 Ti4 -","- C224 H528 Cl16 Fe16 O84 Ti16 -","4","1","","Nunes, Giovana G.; Reis, Dayane M.; Amorim, Priscila T.; Sá, Eduardo L.; Mangrich, Antonio S.; Evans, David J.; Hitchcock, Peter B.; Jeffery Leigh, G.; Nunes, Fábio S.; Soares, Jaísa F.","Novel double alkoxides of titanium(IV) and iron(II)/(III): synthetic, structural and spectroscopic studies","New Journal of Chemistry","2002","26","5","519","","10.1039/b111517k","","x-ray","0.71073","MoKα","","0.1434","0.0609","","","0.1115","0.1354","","","","","","0.957","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050818","24.03","0.015","24.03","0.015","12.815","0.014","90","","90","","120","","6409","9","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C36 H38 Cl3 Er N6 O19 -","- C36 H24 Cl3 Er N6 O19 -","- C216 H144 Cl18 Er6 N36 O114 -","6","0.166667","","Lu, Wen-Jie; Zhang, Lin-Ping; Song, Hai-Bin; Wang, Quan-Ming; Mak, Thomas C. W.","Novel lanthanide(iii) coordination networks based on 1,2-bis(4-pyridyl)ethane-N,N'-dioxide and trans-1,2-bis(4-pyridyl)ethene-N,N'-dioxide","New Journal of Chemistry","2002","26","6","775","781","10.1039/b111660f","","","0.71073","MoKα","","0.0947","0.0568","","","0.1565","0.1844","","","","","","1.061","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050819","23.9937","0.0011","23.9937","0.0011","12.8101","0.0008","90","","90","","120","","6386.7","0.6","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C36 H38 Cl3 N6 O19 Yb -","- C72 H48 Cl6 N12 O38 Yb2 -","- C216 H144 Cl18 N36 O114 Yb6 -","3","0.0833333","","Lu, Wen-Jie; Zhang, Lin-Ping; Song, Hai-Bin; Wang, Quan-Ming; Mak, Thomas C. W.","Novel lanthanide(iii) coordination networks based on 1,2-bis(4-pyridyl)ethane-N,N'-dioxide and trans-1,2-bis(4-pyridyl)ethene-N,N'-dioxide","New Journal of Chemistry","2002","26","6","775","781","10.1039/b111660f","","","0.71073","MoKα","","0.0889","0.0549","","","0.1595","0.1863","","","","","","1.056","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050820","8.3115","0.0017","15.243","0.003","19.58","0.004","90","","94.797","0.004","90","","2471.9","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H23 Er N6 O13 -","- C18 H18 Er N6 O13 -","- C72 H72 Er4 N24 O52 -","4","1","","Lu, Wen-Jie; Zhang, Lin-Ping; Song, Hai-Bin; Wang, Quan-Ming; Mak, Thomas C. W.","Novel lanthanide(iii) coordination networks based on 1,2-bis(4-pyridyl)ethane-N,N'-dioxide and trans-1,2-bis(4-pyridyl)ethene-N,N'-dioxid","New Journal of Chemistry","2002","26","6","775","781","10.1039/b111660f","","","0.71073","MoKα","","0.1248","0.047","","","0.0991","0.131","","","","","","0.953","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050821","8.3329","0.0015","15.215","0.003","19.602","0.004","90","","94.882","0.004","90","","2476.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H23 N6 O13 Yb -","- C18 H18 N6 O13 Yb -","- C72 H72 N24 O52 Yb4 -","4","1","","Lu, Wen-Jie; Zhang, Lin-Ping; Song, Hai-Bin; Wang, Quan-Ming; Mak, Thomas C. W.","Novel lanthanide(iii) coordination networks based on 1,2-bis(4-pyridyl)ethane-N,N'-dioxide and trans-1,2-bis(4-pyridyl)ethene-N,N'-dioxide","New Journal of Chemistry","2002","26","6","775","781","10.1039/b111660f","","","0.71073","MoKα","","0.0895","0.0496","","","0.108","0.1232","","","","","","1.01","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050822","9.609","0.002","10.801","0.003","13.566","0.003","78.38","0.005","82.011","0.005","89.895","0.005","1365.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H22 Cl2 La N5 O13 -","- C30 H40 Cl4 La2 N10 O26 -","- C30 H40 Cl4 La2 N10 O26 -","1","0.5","","Lu, Wen-Jie; Zhang, Lin-Ping; Song, Hai-Bin; Wang, Quan-Ming; Mak, Thomas C. W.","Novel lanthanide(iii) coordination networks based on 1,2-bis(4-pyridyl)ethane-N,N'-dioxide and trans-1,2-bis(4-pyridyl)ethene-N,N'-dioxide","New Journal of Chemistry","2002","26","6","775","781","10.1039/b111660f","","","0.71073","MoKα","","0.1043","0.0627","","","0.156","0.1782","","","","","","0.978","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050823","10.1013","0.0016","11.2822","0.0017","16.313","0.003","79.512","0.003","88.198","0.003","66.963","0.003","1680.6","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H37 Cl Er N3 O21 -","- C22 H37 Cl Er N3 O21 -","- C44 H74 Cl2 Er2 N6 O42 -","2","1","","Lu, Wen-Jie; Zhang, Lin-Ping; Song, Hai-Bin; Wang, Quan-Ming; Mak, Thomas C. W.","Novel lanthanide(iii) coordination networks based on 1,2-bis(4-pyridyl)ethane-N,N'-dioxide and trans-1,2-bis(4-pyridyl)ethene-N,N'-dioxide","New Journal of Chemistry","2002","26","6","775","781","10.1039/b111660f","","","0.71073","MoKα","","0.0622","0.0421","","","0.0842","0.0919","","","","","","0.987","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050824","8.5633","0.0009","18.779","0.002","24.041","0.003","90","","96.154","0.002","90","","3843.8","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 N4 -","- C14 H14 N4 -","- C168 H168 N48 -","12","3","","Dong, Guo; Cheng, He; Chun-Ying, Duan; Chun-Qi, Qian; Qing-Jin, Meng","The synthesis and structural characterisation of helical silver(i) complexes with short bis(pyridylimine) ligands","New Journal of Chemistry","2002","26","6","796","","10.1039/b111661b","","","0.71073","MoKα","","0.0937","0.0628","","","0.1573","0.1675","","","","","","1.016","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050825","8.6444","0.0017","13.663","0.003","14.079","0.003","90.29","0.03","104.04","0.03","107.57","0.03","1532.4","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H28 Ag2 Cl2 N8 O8 -","- C28 H28 Ag2 Cl2 N8 O8 -","- C56 H56 Ag4 Cl4 N16 O16 -","2","1","","Dong, Guo; Cheng, He; Chun-Ying, Duan; Chun-Qi, Qian; Qing-Jin, Meng","The synthesis and structural characterisation of helical silver(i) complexes with short bis(pyridylimine) ligands","New Journal of Chemistry","2002","26","6","796","","10.1039/b111661b","","","0.71073","MoKα","","0.0434","0.0306","","","0.0771","0.082","","","","","","1.007","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050826","25.648","0.004","8.5664","0.0006","18.328","0.007","90","","126.157","0.014","90","","3251.3","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H28 Ag2 B2 F8 N8 -","- C28 H28 Ag2 B2 F8 N8 -","- C112 H112 Ag8 B8 F32 N32 -","4","0.5","","Dong, Guo; Cheng, He; Chun-Ying, Duan; Chun-Qi, Qian; Qing-Jin, Meng","The synthesis and structural characterisation of helical silver(i) complexes with short bis(pyridylimine) ligands","New Journal of Chemistry","2002","26","6","796","","10.1039/b111661b","","","0.71073","MoKα","","0.0817","0.0658","","","0.1805","0.1954","","","","","","1.088","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050827","20.017","0.004","9.18","0.0018","17.192","0.003","90","","94.25","0.03","90","","3150.4","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H28 Ag2 N10 O6 -","- C28 H28 Ag2 N10 O6 -","- C112 H112 Ag8 N40 O24 -","4","0.5","","Dong, Guo; Cheng, He; Chun-Ying, Duan; Chun-Qi, Qian; Qing-Jin, Meng","The synthesis and structural characterisation of helical silver(i) complexes with short bis(pyridylimine) ligands","New Journal of Chemistry","2002","26","6","796","","10.1039/b111661b","","","0.71073","MoKα","","0.0578","0.0359","","","0.0899","0.1012","","","","","","1.022","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050828","10.639","0.004","13.019","0.004","13.141","0.005","90","","102.691","0.015","90","","1775.7","1.1","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H26 Ag2 B2 F8 N10 -","- C28 H26 Ag2 B2 F8 N10 -","- C56 H52 Ag4 B4 F16 N20 -","2","1","","Dong, Guo; Cheng, He; Chun-Ying, Duan; Chun-Qi, Qian; Qing-Jin, Meng","The synthesis and structural characterisation of helical silver(i) complexes with short bis(pyridylimine) ligands","New Journal of Chemistry","2002","26","6","796","","10.1039/b111661b","","","0.71073","MoKα","","0.257","0.0762","","","0.071","0.1004","","","","","","1.039","","","","has coordinates,has disorder","180062","2020-10-21","18:00:00",""
"7050829","13.2641","0.0003","16.4647","0.0003","23.7877","0.0005","84.508","0.001","80.908","0.001","67.808","0.001","4746.03","0.17","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C78 H80 Cl22 N4 O4 P2 Pd4 -","- C78 H80 Cl22 N4 O4 P2 Pd4 -","- C156 H160 Cl44 N8 O8 P4 Pd8 -","2","1","","Fernández, Alberto; Pereira, Esther; Fernández, Jesús J.; López-Torres, Margarita; Suárez, Antonio; Mosteiro, Roberto; Pereira, M. Teresa; Vila, José M.","Sterically controlled reactivity of palladium(ii) tetranuclear cyclometallated complexes. Crystal and molecular structure of the novel tetranuclear compound [Pd2{1,3-[C(H)NCH2C4H7O]2C6H2}(µ-Cl)(Cl)(PPh3)]2Electronic supplementary information (ESI) available: 1H and 31P NMR data for compounds 1‒15 and 17. See http://www.rsc.org/suppdata/nj/b1/b111671a/","New Journal of Chemistry","2002","26","7","895","","10.1039/b111671a","","","0.71073","MoKα","","0.1142","0.0722","","","0.182","0.2158","","","","","","1.031","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050830","13.4121","0.0008","9.0913","0.0005","18.3528","0.0012","90","","104.904","0.005","90","","2162.5","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H28 Cl2 N4 Ni O5 -","- C17 H28 Cl2 N4 Ni O5 -","- C68 H112 Cl8 N16 Ni4 O20 -","4","1","","Pérez, José; García, Luis; Guy Orpen, A.; Dolores Santana, M.; Saez, Paloma; García, Gabriel","Conformational analysis of complexes of 2,4,4-trimethyl-1,5,9-triazacyclododec-1-ene and its 9-methyl derivative","New Journal of Chemistry","2002","26","6","726","","10.1039/b200164k","","","0.71073","MoKα","","0.0594","0.0384","","","0.0965","0.115","","","","","","0.93","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050831","9.299","0.0009","10.5724","0.001","12.8248","0.0013","108.628","0.007","95.446","0.007","97.43","0.006","1172.2","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H33 F6 N4 Ni O P -","- C19 H33 F6 N4 Ni O P -","- C38 H66 F12 N8 Ni2 O2 P2 -","2","1","","Pérez, José; García, Luis; Guy Orpen, A.; Dolores Santana, M.; Saez, Paloma; García, Gabriel","Conformational analysis of complexes of 2,4,4-trimethyl-1,5,9-triazacyclododec-1-ene and its 9-methyl derivative","New Journal of Chemistry","2002","26","6","726","","10.1039/b200164k","","","0.71073","MoKα","","0.1162","0.074","","","0.2001","0.257","","","","","","1.205","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050833","10.8607","0.0013","25.535","0.004","11.3399","0.0012","90","","89.301","0.011","90","","3144.6","0.7","293","","293","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","4-amino-2,6-bis(pyrazol-1-ylmethyl)-5-(pyrazol-1-yl)pyrimidine","","- C30 H30 N18 -","- C30 H30 N18 -","- C120 H120 N72 -","4","1","","de la Hoz, A.; Blasco, H.; Diaz-Ortiz, A.; Elguero, J.; Foces-Foces, C.; Moreno, A.; Sanchez-Migallon, A.; Valiente, G.","Solvent-free synthesis and structural characterization of azolyl-substituted pyrimidines","New Journal of Chemistry","2002","","","","","","","","","","","","0.048","","","0.058","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7050834","17.6","0.0008","23.0061","0.0011","14.9033","0.0006","90","","90","","90","","6034.5","0.5","200","","200","","","","","","","","","5","C 2 2 21","C 2c 2","20","","[Zn(bimb)(OAc)2]6H2O","","- C24 H36 N4 O10 Zn -","- C24 H24 N4 O10 Zn -","- C192 H192 N32 O80 Zn8 -","8","1","","Zhu, Hui-Fang; Zhao, Wei; Okamura, Taka-aki; Fei, Bao-Li; Sun, Wei-Yin; Ueyama, Norikazu","Self-assembly of a snake-like blue photoluminescent coordination polymer from 4,4???-bis(imidazol-1-ylmethyl)biphenyl and zinc acetateElectronic supplementary information (ESI) available: color version of Fig. 3. See http://www.rsc.org/suppdata/nj/b2/b200383j/.","New Journal of Chemistry","2002","26","10","1277","","10.1039/b200383j","","","0.71069","MoKα","","0.161","0.0429","","","0.0484","0.0568","","","","","","0.548","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050835","10.939","0.0003","12.947","0.0002","11.114","0.0004","90","","90","","90","","1574.05","0.08","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C16 H14 Mn N5 O2 -","- C16 H14 Mn N5 O2 -","- C64 H56 Mn4 N20 O8 -","4","1","","Anangamohan Panja; Nizamuddin Shaikh; Pavel Vojtíšek; Song Gao; Pradyot Banerjee","Synthesis, crystal structures and magnetic properties of 1D polymeric [MnIII(salen)N3] and [MnIII(salen)Ag(CN)2] complexes","New J. Chem.","2002","26","8","1025","1028","10.1039/b200384h","","","0.7107","MoKα","","0.0366","0.0295","","","0.0693","0.0727","","","","","","1.061","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050836","8.148","0.005","6.509","0.005","33.158","0.005","90","","96.346","0.005","90","","1747.8","1.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H56 Ag4 Mn4 N16 O8 -","- C72 H56 Ag4 Mn4 N16 O8 -","- C72 H56 Ag4 Mn4 N16 O8 -","1","0.25","","Anangamohan Panja; Nizamuddin Shaikh; Pavel Vojtíšek; Song Gao; Pradyot Banerjee","Synthesis, crystal structures and magnetic properties of 1D polymeric [MnIII(salen)N3] and [MnIII(salen)Ag(CN)2] complexes","New J. Chem.","2002","26","8","1025","1028","10.1039/b200384h","","","0.71069","MoKα","","0.049","0.0348","","","0.0821","0.0888","","","","","","1.087","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050837","9.8699","0.0001","7.6192","0.0001","7.3171","0.0001","90","0.001","95.803","0.001","90","0.001","547.432","0.012","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H5 Cu O4 P -","- C2 H5 Cu O4 P -","- C8 H20 Cu4 O16 P4 -","4","1","","Menaa, Bouzid; Kariuki, Benson M.; Shannon, Ian J.","Preparation using metal oxide precursors and crystal structures of the copper and zinc vinylphosphonate materials M(O3PC2H3)·H2O (M = Cu, Zn)Electronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams in CHIME format. See http://www.rsc.org/suppdata/nj/b2/b200438k/","New Journal of Chemistry","2002","26","7","906","","10.1039/b200438k","","","1.54178","CuKα","","0.0288","0.0286","","","0.073","0.0732","","","","","","1.154","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050838","5.6805","0.0001","9.8101","0.0001","4.7988","0.0001","90","","90","","90","","267.419","0.008","296","2","296","2","","","","","","","","5","P m n 21","P 2ac -2","31","","","","- C2 H5 O4 P Zn -","- C2 H3 O4 P Zn -","- C4 H6 O8 P2 Zn2 -","2","0.5","","Menaa, Bouzid; Kariuki, Benson M.; Shannon, Ian J.","Preparation using metal oxide precursors and crystal structures of the copper and zinc vinylphosphonate materials M(O3PC2H3)·H2O (M = Cu, Zn)Electronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams in CHIME format. See http://www.rsc.org/suppdata/nj/b2/b200438k/","New Journal of Chemistry","2002","26","7","906","","10.1039/b200438k","","","1.54178","CuKα","","0.0333","0.0333","","","0.0862","0.0862","","","","","","1.077","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050839","5.808","0.001","10.75","0.002","14.772","0.003","90","","93.44","0.03","90","","920.6","0.3","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2,3-{(R,S)-(ferrocene-1,1'-dicarbonyl)}-O-methyl-alpha-D-glucopyranoside","","- C19 H22 Fe O9 -","- C19 H22 Fe O9 -","- C38 H44 Fe2 O18 -","2","1","","Hartinger, Christian G.; Nazarov, Alexey A.; Arion, Vladimir B.; Giester, Gerald; Jakupec, Michael; Galanski, Markus; Keppler, Bernhard K.","Novel glucose-ferrocenyl derivatives: synthesis and properties","New Journal of Chemistry","2002","26","6","671","","10.1039/b200701k","","","0.71073","MoKα","","0.0309","0.0272","","","0.0622","0.0635","","","","","","1.042","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050840","16.4431","0.001","22.1019","0.0011","24.1758","0.0014","90","","90","","90","","8786.1","0.9","","","","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C18 H36 K N2 Ni O6 P S4 -","- C18 H36 K N2 Ni O6 P S4 -","- C216 H432 K12 N24 Ni12 O72 P12 S48 -","12","3","","Bujoli-Doeuff, Martine; Coste, Servane; Evain, Michel; Brec, Raymond; Massiot, Dominique; Jobic, Stéphane","Synthesis and structure of phases containing [Ni~3~P~3~S~12~]~3~^-^ crown-shaped trimers","New Journal of Chemistry","2002","26","7","910","914","10.1039/b200703g","","","","","","","","","","","","","","","1.38","1.38","","","","","has coordinates","189758","2020-10-21","18:00:00",""
"7050841","18.296","0.002","29.174","0.002","13.5323","0.0014","90","","90","","90","","7222.9","1.2","","","","","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C45 H94 K2 N5 Ni3 O12 P3 S12 -","- C45 H94 K2 N5 Ni3 O12 P3 S12 -","- C180 H376 K8 N20 Ni12 O48 P12 S48 -","4","1","","Bujoli-Doeuff, Martine; Coste, Servane; Evain, Michel; Brec, Raymond; Massiot, Dominique; Jobic, Stéphane","Synthesis and structure of phases containing [Ni~3~P~3~S~12~]~3~^-^ crown-shaped trimers","New Journal of Chemistry","2002","26","7","910","914","10.1039/b200703g","","","","","","","","","","","","","","","","","","","","","has coordinates","189759","2020-10-21","18:00:00",""
"7050842","14.3837","0.0006","20.2772","0.0006","21.5187","0.0006","66.41","0.002","79.842","0.002","79.466","0.002","5617.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H82 N2 O14 U -","- C54 H73 N2 O14 U -","- C216 H292 N8 O56 U4 -","4","2","","Thuery, Pierre; Masci, B.; Nierlich, M.","Supramolecular assemblies from uranyl ion complexes of hexahomotrioxacalix[3]arenes and protonated [2.2.2]cryptand","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050843","13.4667","0.0007","39.338","0.002","18.4026","0.0014","90","","93.062","0.004","90","","9734.9","1","100","2","100","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C91 H134 N2 O24 U2 -","- C91 H129 N2 O24 U2 -","- C364 H516 N8 O96 U8 -","4","2","","Thuery, Pierre; Masci, B.; Nierlich, M.","Supramolecular assemblies from uranyl ion complexes of hexahomotrioxacalix[3]arenes and protonated [2.2.2]cryptand","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050844","25.3546","0.0011","13.8369","0.0009","28.0625","0.0014","90","","112.456","0.004","90","","9098.6","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C102 H104 N2 O22 U2 -","- C102 H104 N2 O22 U2 -","- C408 H416 N8 O88 U8 -","4","1","","Thuery, Pierre; Masci, B.; Nierlich, M.","Supramolecular assemblies from uranyl ion complexes of hexahomotrioxacalix[3]arenes and protonated [2.2.2]cryptand","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050845","11.2826","0.0001","17.0485","0.0002","17.5949","0.0003","90","","90","","90","","3384.4","0.08","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H14 Mn N5 O2 -","- C18 H14 Mn N5 O2 -","- C144 H112 Mn8 N40 O16 -","8","1","","Shi, Qian; Cao, Rong; Li, Xing; Luo, Junhua; Hong, Maochun; Chen, Zhongning","Syntheses, structures, electrochemistry and magnetic properties of chain-like dicyanamide manganese(iii) and iron(iii) complexes with salen ligand","New Journal of Chemistry","2002","26","10","1397","","10.1039/b200907b","","","0.71073","MoKα","","0.0756","0.0446","","","0.0921","0.1079","","","","","","1.079","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050846","11.4946","0.0003","16.5213","0.0004","17.8642","0.0001","90","","90","","90","","3392.51","0.12","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H14 Fe N5 O2 -","- C19 H13 Fe N5 O2 -","- C152 H104 Fe8 N40 O16 -","8","1","","Shi, Qian; Cao, Rong; Li, Xing; Luo, Junhua; Hong, Maochun; Chen, Zhongning","Syntheses, structures, electrochemistry and magnetic properties of chain-like dicyanamide manganese(iii) and iron(iii) complexes with salen ligand","New Journal of Chemistry","2002","26","10","1397","","10.1039/b200907b","","","0.71073","MoKα","","0.107","0.053","","","0.1037","0.1264","","","","","","1.088","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050847","12.6709","0.0001","16.4638","0.0001","17.1025","0.0001","105.329","0.0003","109.351","0.0003","99.4126","0.0005","3120.36","0.04","123","1","123","1","","","","","","","","8","P -1","-P 1","2","","","","- C129.76 H121.59 Cl11.47 N2 O8 P8 Rh2 Ru2 -","- C129.764 H121.586 Cl11.47 N2 O8 P8 Rh2 Ru2 -","- C129.764 H121.586 Cl11.47 N2 O8 P8 Rh2 Ru2 -","1","0.5","","Kuhn, Fritz E.; de Biani, F.F.; Herdtweck, Eberhardt; Santos, Ana M.; Zuo, J.-L.","Ruthenium(II) Alkynyl-Hydride and Ruthenium(II) bis-(σ-Pyridylacetylide) as ligands and linkers for Metal-Metal Bonded Complexes","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","277870","2022-09-15","11:09:05",""
"7050848","27.376","0.0006","12.7124","0.0002","34.4278","0.0007","90","","100.957","0.001","90","","11763","0.4","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C88 H104 Cl7 N21 Ni4 O45 S6 -","- C88 H76 Cl7 N21 Ni4 O45 S6 -","- C352 H304 Cl28 N84 Ni16 O180 S24 -","4","0.5","","Krämer, Roland; Kovbasyuk, Larisa; Pritzkow, Hans","Encapsulation of nitrate by a self-assembled tetranickel(II) complex","New Journal of Chemistry","2002","26","5","516","518","10.1039/b201132h","","","0.71073","MoKα","","0.1173","0.0857","","","0.2447","0.28","","","","","","1.039","","","","has coordinates,has disorder","180062","2020-10-21","18:00:00",""
"7050849","9.139","0.002","27.672","0.006","9.204","0.002","90","","112.98","0.03","90","","2142.9","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Binaphthol morpholine","2,2'-dihydroxy-1,1'-binaphthyl morpholine clathrate","","- C26 H27.5 N1.5 O3.5 -","- C26 H26 N1.5 O3.5 -","- C104 H104 N6 O14 -","4","1","","Nassimbeni, Luigi R.; Su, Hong","Inclusion compounds of binaphthol with volatile guests: structures, selectivity and kinetics of desolvation","New Journal of Chemistry","2002","26","8","989","","10.1039/b201255n","","","0.71069","MoKα","","0.1705","0.0919","","","0.2156","0.2555","","","","","","1.053","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050850","14.651","0.002","55.471","0.006","10.259","0.001","90","0.003","90","0.003","90","0.003","8337.5","1.7","173","2","173","2","","","","","","","","3","F d d 2","F 2 -2d","43","Binaphthol THF","2,2'-dihydroxy-1,1'-binaphthyl tetrahydrofuran clathrate","","- C26 H26 O3.5 -","- C26 H26 O3.5 -","- C416 H416 O56 -","16","1","","Nassimbeni, Luigi R.; Su, Hong","Inclusion compounds of binaphthol with volatile guests: structures, selectivity and kinetics of desolvation","New Journal of Chemistry","2002","26","8","989","","10.1039/b201255n","","","0.7107","MoKα","","0.1052","0.0993","","","0.2664","0.2748","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050851","8.453","0.001","8.931","0.001","29.573","0.003","90","0.005","92.928","0.005","90","0.005","2229.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Binaphthol DMSO","2,2'-dihydroxy-1,1'-binaphthyl dimethylsulphoxide clathrate","","- C24 H26 O4 S2 -","- C23.988 H26 O3.994 S2 -","- C95.952 H104 O15.976 S8 -","4","1","","Nassimbeni, Luigi R.; Su, Hong","Inclusion compounds of binaphthol with volatile guests: structures, selectivity and kinetics of desolvation","New Journal of Chemistry","2002","26","8","989","","10.1039/b201255n","","","0.7107","MoKα","","0.0604","0.0459","","","0.1061","0.1146","","","","","","1.051","","","","has coordinates,has disorder","180062","2020-10-21","18:00:00",""
"7050852","8.083","0.001","21.29","0.001","11.094","0.001","90","","107.362","0.01","90","","1822.2","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Binaphthol acetone","2,2'-dihydroxy-1,1'-binaphthyl acetone clathrate","","- C23 H20 O3 -","- C23 H20 O3 -","- C92 H80 O12 -","4","1","","Nassimbeni, Luigi R.; Su, Hong","Inclusion compounds of binaphthol with volatile guests: structures, selectivity and kinetics of desolvation","New Journal of Chemistry","2002","26","8","989","","10.1039/b201255n","","","0.7107","MoKα","","0.0978","0.0471","","","0.1134","0.1308","","","","","","0.98","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050853","20.792","0.003","8.883","0.001","20.8","0.003","90","","105.115","0.005","90","","3708.8","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Binaphthol DMSO","2,2'-dihydroxy-1,1'-binaphthyl dimethylsulphoxide clathrate","","- C22 H20 O3 S -","- C22 H20 O3 S -","- C176 H160 O24 S8 -","8","2","","Nassimbeni, Luigi R.; Su, Hong","Inclusion compounds of binaphthol with volatile guests: structures, selectivity and kinetics of desolvation","New Journal of Chemistry","2002","26","8","989","","10.1039/b201255n","","","0.7107","MoKα","","0.1625","0.1197","","","0.2698","0.2886","","","","","","1.16","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050854","9.127","0.003","16.83","0.003","20.558","0.005","90","","90","","90","","3157.9","1.4","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H32 N4 O6 S2 Zn -","- C31 H32 N4 O6 S2 Zn -","- C124 H128 N16 O24 S8 Zn4 -","4","1","","Manuel R. Bermejo; Miguel Vázquez; Jesús Sanmartín; Ana M. García-Deibe; Matilde Fondo; Carlos Lodeiro","Zinc and cadmium complexes with an achiral symmetric helicand. Crystal structure of an enantiomerically pure Λ-Zn(II) monohelicate","New J. Chem.","2002","26","10","1365","1370","10.1039/b201433p","","","0.71073","MoKα","","0.1165","0.0545","","","0.1046","0.1208","","","","","","0.874","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050855","11.8198","0.0006","18.129","0.002","15.745","0.0007","90","","90","","90","","3373.9","0.4","183","2","183","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C21 H55 Al5 O8 -","- C21 H55 Al5 O8 -","- C84 H220 Al20 O32 -","4","0.5","","Carmalt, Claire J.; Mileham, John D.; White, Andrew J. P.; Williams, David J.","Pentanuclear alkoxyaluminium hydrides","New Journal of Chemistry","2002","26","7","902","","10.1039/b201773n","","","1.54178","CuKα","","0.0668","0.049","","0.1477","0.1314","","","","1.045","1.089","1.089","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050856","20.331","0.002","9.3818","0.001","20.68","0.002","90","","109.252","0.006","90","","3723.9","0.7","183","2","183","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C24 H60 Al5 Cl O9 -","- C24 H60 Al5 Cl O9 -","- C96 H240 Al20 Cl4 O36 -","4","1","","Carmalt, Claire J.; Mileham, John D.; White, Andrew J. P.; Williams, David J.","Pentanuclear alkoxyaluminium hydrides","New Journal of Chemistry","2002","26","7","902","","10.1039/b201773n","","","1.54178","CuKα","","0.0817","0.0658","","0.2093","0.1841","","","","1.062","1.096","1.096","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050857","14.277","0.001","23.8122","0.0018","13.4358","0.0011","90","","90","","90","","4567.7","0.6","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C40 H36 Cl3 Lu N8 O22 -","- C40 H32 Cl3 Lu N8 O22 -","- C160 H128 Cl12 Lu4 N32 O88 -","4","1","","Huskowska, Ewa; Turowska-Tyrk, Ilona; Legendziewicz, Janina; Riehl, James P.","The structure and spectroscopy of lanthanide(III) complexes with 2,2'-bipyridine-1,1'-dioxide in solution and in the solid state: effects of ionic size and solvent on photophysics, ligand structure and coordination","New Journal of Chemistry","2002","26","10","1461","1467","10.1039/b201846m","","","0.71073","MoKα","","0.0812","0.0614","","","0.1069","0.1131","","","","","","1.164","","","","has coordinates","275123","2022-05-06","17:24:23",""
"7050858","14.8396","0.0008","13.562","0.0008","23.0193","0.0014","90","","91.405","0.005","90","","4631.3","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H32 Cl3 N8 Nd O20 -","- C40 H32 Cl3 N8 Nd O20 -","- C160 H128 Cl12 N32 Nd4 O80 -","4","1","","Huskowska, Ewa; Turowska-Tyrk, Ilona; Legendziewicz, Janina; Riehl, James P.","The structure and spectroscopy of lanthanide(III) complexes with 2,2'-bipyridine-1,1'-dioxide in solution and in the solid state: effects of ionic size and solvent on photophysics, ligand structure and coordination","New Journal of Chemistry","2002","26","10","1461","1467","10.1039/b201846m","","","0.71073","MoKα","","0.074","0.0612","","0.1327","0.129","","","","1.252","1.365","1.365","","","","","has coordinates","275123","2022-05-06","17:24:24",""
"7050859","7.791","0.002","7.634","0.002","19.364","0.004","90","","98.42","0.03","90","","1139.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Cu N4 O4 -","- C9 H10 Cu N4 O4 -","- C36 H40 Cu4 N16 O16 -","4","1","","Joaquín Sanchiz; Yolanda Rodríguez-Martín; Catalina Ruiz-Pérez; Alfredo Mederos; Francesc Lloret; Miguel Julve","Ferromagnetic coupling in the malonato-bridged copper(II) chains [Cu(Im)2(mal)]n and [Cu(2-MeIm)2(mal)]n(H2mal=malonic acid, Im=imidazole and 2-MeIm=2-methylimidazole)","New J. Chem.","2002","26","11","1624","1628","10.1039/b201849g","","","0.71073","MoKα","","0.0687","0.0408","","","0.105","0.1166","","","","","","1.077","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050860","7.036","0.002","8.23","0.002","22.932","0.003","90","","90","","90","","1327.9","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H14 Cu N4 O4 -","- C11 H14 Cu N4 O4 -","- C44 H56 Cu4 N16 O16 -","4","1","","Joaquín Sanchiz; Yolanda Rodríguez-Martín; Catalina Ruiz-Pérez; Alfredo Mederos; Francesc Lloret; Miguel Julve","Ferromagnetic coupling in the malonato-bridged copper(II) chains [Cu(Im)2(mal)]n and [Cu(2-MeIm)2(mal)]n(H2mal=malonic acid, Im=imidazole and 2-MeIm=2-methylimidazole)","New J. Chem.","2002","26","11","1624","1628","10.1039/b201849g","","","0.71069","MoKα","","0.0713","0.0408","","","0.1047","0.1157","","","","","","1.062","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050861","14.571","0.004","14.761","0.004","19.596","0.005","90","","90.235","0.005","90","","4214.7","1.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H44 Cl4 Cu2 N8 O12 -","- C34 H44 Cl4 Cu2 N8 O12 -","- C136 H176 Cl16 Cu8 N32 O48 -","4","1","","Du, Miao; Guo, Ya-Mei; Bu, Xian-He; Ribas, Joan; Monfort, Montserrat","Structural and first magnetic characterization of unique mono-µ-chloro bridged dinuclear CuII complexes with heterocycle-functionalized diazamesocyclic ligands","New Journal of Chemistry","2002","26","7","939","","10.1039/b201962k","","","0.71073","MoKα","","0.0758","0.0418","","","0.1092","0.1275","","","","","","0.996","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050862","11.462","0.004","12.79","0.004","26.465","0.009","90","","90","","90","","3880","2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H36 Cl4 Cu2 N12 O12 -","- C26 H36 Cl4 Cu2 N12 O12 -","- C104 H144 Cl16 Cu8 N48 O48 -","4","1","","Du, Miao; Guo, Ya-Mei; Bu, Xian-He; Ribas, Joan; Monfort, Montserrat","Structural and first magnetic characterization of unique mono-µ-chloro bridged dinuclear CuII complexes with heterocycle-functionalized diazamesocyclic ligands","New Journal of Chemistry","2002","26","7","939","","10.1039/b201962k","","","0.71073","MoKα","","0.1529","0.0578","","","0.111","0.1373","","","","","","0.933","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050863","8.3553","0.0008","8.3553","0.0008","26.657","0.004","90","","90","","120","","1611.6","0.3","110","2","110","2","","","","","","","","6","P 61","P 61","169","","","","- C3 H8 N O9 P3 Zn2 -","- C3 H7 N O9 P3 Zn2 -","- C18 H42 N6 O54 P18 Zn12 -","6","1","","Mao, Jiang-Gao; Wang, Zhike; Clearfield, Abraham","Hydrothermal synthesis, characterization and crystal structures of two new zinc(ii) phosphonates: Zn2[(O3PCH2)2NHCH2CO2] and Zn2[HO3PCH2NH(CH2PO3)2]","New Journal of Chemistry","2002","26","8","1010","","10.1039/b202096n","","","0.71073","MoKα","","0.0918","0.0656","","","0.1132","0.1269","","","","","","1.148","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050864","8.0677","0.0012","8.0677","0.0012","27.283","0.006","90","","90","","120","","1537.9","0.5","110","2","293","2","","","","","","","","6","P 61","P 61","169","","","","- C4 H7 N O8 P2 Zn2 -","- C4 H7 N O8 P2 Zn2 -","- C24 H42 N6 O48 P12 Zn12 -","6","1","","Mao, Jiang-Gao; Wang, Zhike; Clearfield, Abraham","Hydrothermal synthesis, characterization and crystal structures of two new zinc(ii) phosphonates: Zn2[(O3PCH2)2NHCH2CO2] and Zn2[HO3PCH2NH(CH2PO3)2]","New Journal of Chemistry","2002","26","8","1010","","10.1039/b202096n","","","0.71073","MoKα","","0.0686","0.0443","","","0.0941","0.103","","","","","","0.955","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050865","14.396","0.0001","16.141","0.0004","6.136","0.0006","90","","90","","90","","1425.8","0.1","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C18 H10 N2 S Se -","- C18 H10 N2 S Se -","- C72 H40 N8 S4 Se4 -","4","0.5","","Krystian, Pluta; Malgorzata, Nowak; Kinga, Suwinska","Synthesis of novel heteropentacenes containing nitrogen, sulfur and oxygen or selenium","New Journal of Chemistry","2002","","","","","10.1039/b202107m","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050866","9.844","0.0003","15.525","0.0003","13.251","0.0006","90","","90","","90","","2025.1","0.1","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C26 H15 N3 S -","- C26 H15 N3 S -","- C104 H60 N12 S4 -","4","0.5","","","","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050867","8.541","0.002","14.92","0.004","17.352","0.005","115.233","0.004","93.117","0.005","96.03","0.005","1977","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H124 N18 Ni3 O26 -","- C54 H82 N18 Ni3 O22 -","- C54 H82 N18 Ni3 O22 -","1","0.5","","Lu, Tong-Bu; Xiang, Hua; Luck, Rudy L.; Jiang, Long; Mao, Zong-Wan; Ji, Liang-Nian","[NiL]3[BTC]2??14H2O [L???=???3,10-bis(2-ethyl)-1,3,5,8,10,12-hexaazacyclotetradecane, BTC???=???1,3,5-benzenetricarboxylate]: synthesis, structure and unique selective guest molecule absorption propertiesElectronic supplementary information (ESI) available: 1H NMR spectra of dried 1, as prepared and after immersion in different solvent mixtures. See http://www.rsc.org/suppdata/nj/b2/b202220f/","New Journal of Chemistry","2002","26","8","969","","10.1039/b202220f","","","0.71073","MoKα","","0.1538","0.07","","","0.1871","0.2302","","","","","","1.096","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050868","15.012","0.0002","16.231","0.0003","31.703","0.0005","88.96","0.0008","86.877","0.0009","84.19","0.0009","7673","0.2","150","2","150","2","","","","","","","synthesized by the authors","9","P -1","-P 1","2","","","","- C93.5 H151 B54 Cl Co3 La N3 O15 P3 -","- C93.5 H151 B54 Cl Co3 La N3 O15 P3 -","- C187 H302 B108 Cl2 Co6 La2 N6 O30 P6 -","2","1","","Bohumír Grüner; Jaromír Plešek; Jiří Báča; Ivana Císařová; Jean François Dozol; Heléne Rouquette; Clara Viňas; Pavel Selucký; Jiří Rais","Cobalt bis(dicarbollide) ions with covalently bonded CMPO groups as selective extraction agents for lanthanide and actinide cations from highly acidic nuclear waste solutions","New J. Chem.","2002","26","10","1519","1527","10.1039/b202374c","","","0.7107","MoKα","","0.1299","0.0828","","","0.2254","0.2559","","","","","","1.115","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050869","9.479","0.004","12.308","0.005","14.402","0.005","90","","90","","90","","1680.2","1.1","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","bis(4-cyanopyridine)-bis(dicyanamide)-manganese(II)","","- C16 H8 Mn N10 -","- C16 H8 Mn N10 -","- C64 H32 Mn4 N40 -","4","0.5","","Dalai, Sudipta; Sarathi Mukherjee, Partha; Zangrando, Ennio; Ray Chaudhuri, Nirmalendu","Synthesis, crystal structure and magnetic properties of two new dicyanamide bridged 2D and 1D complexes of Mn(ii)","New Journal of Chemistry","2002","26","9","1185","","10.1039/b202431b","","","0.71073","mokα","","0.0458","0.0383","","","0.1046","0.112","","","","","","1.03","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050870","13.078","0.004","9.695","0.003","14.592","0.005","90","","105.74","0.02","90","","1780.8","1","293","2","293","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","(1,2-bis(4-pyridyl)ethane)-bis(dicyanamide)-manganese(II)","","- C16 H12 Mn N8 -","- C16 H12 Mn N8 -","- C64 H48 Mn4 N32 -","4","0.5","","Dalai, Sudipta; Sarathi Mukherjee, Partha; Zangrando, Ennio; Ray Chaudhuri, Nirmalendu","Synthesis, crystal structure and magnetic properties of two new dicyanamide bridged 2D and 1D complexes of Mn(ii)","New Journal of Chemistry","2002","26","9","1185","","10.1039/b202431b","","","0.71073","mokα","","0.0463","0.0409","","","0.1106","0.1154","","","","","","1.069","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050871","10.554","0.007","12.21","0.008","14.29","0.005","82.97","0.01","80.82","0.01","89.79","0.01","1804","1.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H70 Ag8 N10 O26 S4 -","- C60 H62 Ag8 N10 O26 S4 -","- C60 H62 Ag8 N10 O26 S4 -","1","0.5","","Tong, Ming-Liang; Shi, Jian-Xin; Chen, Xiao-Ming","Photoluminescent two-dimensional coordination polymers constructed with octanuclear silver(i) clusters or silver(i) ions","New Journal of Chemistry","2002","26","7","814","","10.1039/b202481k","","","0.71073","MoKα","","0.0789","0.0467","","","0.1063","0.1196","","","","","","1.035","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050872","11.461","0.007","17.53","0.007","9.266","0.005","90","","108.2","0.01","90","","1768.5","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Ag N4 O2 -","- C18 H15 Ag N4 O2 -","- C72 H60 Ag4 N16 O8 -","4","1","","Tong, Ming-Liang; Shi, Jian-Xin; Chen, Xiao-Ming","Photoluminescent two-dimensional coordination polymers constructed with octanuclear silver(i) clusters or silver(i) ions","New Journal of Chemistry","2002","26","7","814","","10.1039/b202481k","","","0.71073","MoKα","","0.1028","0.0504","","","0.1048","0.1239","","","","","","1.005","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050873","8.813","0.002","10.229","0.001","14.309","0.003","72.49","0.02","78.36","0.02","82.9","0.02","1202.1","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H21 N S4 -","- C29 H21 N S4 -","- C58 H42 N2 S8 -","2","1","","Carlos Troya; Albert Vidal; Enric Brillas; Jordi Rius; Xavier Torrelles; Carlos Alemán; Jordi Casanovas; Luis Juliá","Dinaphtho[2',3':5,6][1,4]dithiino[2,3-b:2,3-e]pyridine, its 16-butyl derivative and dinaphtho[2',3':5,6][1,4]dioxo[2,3-b:2,3-e]pyridine: novel heterocycles as electron donor compounds","New J. Chem.","2002","26","10","1308","1313","10.1039/b202708a","","","0.71073","MoKα","","0.1252","0.0783","","0.2536","0.2258","","","","1.05","1.185","1.185","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050874","6.09","0.002","22.542","0.006","13.823","0.003","90","","90.24","0.03","90","","1897.6","0.9","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H9 N O4 -","- C17 H9 N O4 -","- C102 H54 N6 O24 -","6","1.5","","Carlos Troya; Albert Vidal; Enric Brillas; Jordi Rius; Xavier Torrelles; Carlos Alemán; Jordi Casanovas; Luis Juliá","Dinaphtho[2',3':5,6][1,4]dithiino[2,3-b:2,3-e]pyridine, its 16-butyl derivative and dinaphtho[2',3':5,6][1,4]dioxo[2,3-b:2,3-e]pyridine: novel heterocycles as electron donor compounds","New J. Chem.","2002","26","10","1308","1313","10.1039/b202708a","","","0.71073","MoKα","","0.1439","0.0419","","0.1117","0.0975","","","","0.796","1.231","1.231","","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050875","12.7452","0.0006","13.4695","0.0006","25.3239","0.0012","87.885","0.001","81.162","0.001","78.936","0.001","4215.8","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C94 H116 Ag25 F72 N12 O58 -","- C94 H96 Ag25 F72 N12 O58 -","- C94 H96 Ag25 F72 N12 O58 -","1","0.5","","Wang, Quan-Ming; Kay Lee, Hung; Mak, Thomas C. W.","A mixed-valent silver(I, II) complex containing a self-assembled silver(I) cluster dimer with encapsulated acetylide dianionIn memory of Dr Richard K. McMullan (1929‒2002).","New Journal of Chemistry","2002","26","5","513","","10.1039/b202709g","","","0.71073","MoKα","","0.0661","0.0469","","","0.1348","0.1449","","","","","","1.065","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050876","25.8219","0.0009","9.2948","0.0004","18.6918","0.0007","90","","132.072","0.001","90","","3330.1","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 Ag N2 O3 -","- C19 H18 Ag N2 O3 -","- C152 H144 Ag8 N16 O24 -","8","1","","Fu, Zhi-Yong; Wu, Xin-Tao; Dai, Jing-Cao; Hu, Sheng-Min; Du, Wen-Xin","A novel mixed-ligand molecular bilayer generated by self-assembly of ""T-shaped"" moieties, displaying an unusual entanglement","New Journal of Chemistry","2002","26","8","978","","10.1039/b202762c","","","0.71073","MoKα","","0.0581","0.0372","","","0.0881","0.0984","","","","","","1.023","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050877","6.1415","0.0002","15.0031","0.0004","11.3715","0.0002","90","","101.215","0.002","90","","1027.78","0.05","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","trans_[PtCl4{NH=C(Me)ON=C(Me)C(Me)(O)}2]","","","- C12 H20 Cl4 N4 O4 Pt -","- C12 H20 Cl4 N4 O4 Pt -","- C24 H40 Cl8 N8 O8 Pt2 -","2","0.5","","Pombeiro, Armando; Bokach, Nadezhda A.; Galanski, Markus; Garnovskii, Dmitrii A.; Haukka, Matti; Keppler, Bernhard K.; Kukushkin, Vadim Yu.; Makarycheva-Mikhailova, Anastassiya V.","Platinum(IV)-mediated Coupling of Dione Monoximes and Nitriles: a Novel Reactivity Pattern of the Classic Oxime-based Chelating Ligands","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050878","7.8552","0.0002","8.5681","0.0002","11.6142","0.0003","88.8886","0.0012","74.9911","0.0012","73.4238","0.0012","722.39","0.03","120","2","120","2","","","","","","","","6","P -1","-P 1","2","trans-(PtCl4{NH=C(Et)ON=C(Me)C(Ph)(=O)}2]","","","- C24 H28 Cl4 N4 O4 Pt -","- C24 H28 Cl4 N4 O4 Pt -","- C24 H28 Cl4 N4 O4 Pt -","1","0.5","","Pombeiro, Armando; Bokach, Nadezhda A.; Galanski, Markus; Garnovskii, Dmitrii A.; Haukka, Matti; Keppler, Bernhard K.; Kukushkin, Vadim Yu.; Makarycheva-Mikhailova, Anastassiya V.","Platinum(IV)-mediated Coupling of Dione Monoximes and Nitriles: a Novel Reactivity Pattern of the Classic Oxime-based Chelating Ligands","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050879","7.4829","0.0015","12.489","0.003","16.111","0.003","71.07","0.03","86.4","0.03","86.11","0.03","1419.6","0.5","120","2","120","2","","","","","","","","7","P -1","-P 1","2","trans-(PtCl4{NH=C(Et)ON=C(Me)C(C6H4F-p)(=O)}2]","","","- C24 H26 Cl4 F2 N4 O4 Pt -","- C24 H26 Cl4 F2 N4 O4 Pt -","- C48 H52 Cl8 F4 N8 O8 Pt2 -","2","1","","Pombeiro, Armando; Bokach, Nadezhda A.; Galanski, Markus; Garnovskii, Dmitrii A.; Haukka, Matti; Keppler, Bernhard K.; Kukushkin, Vadim Yu.; Makarycheva-Mikhailova, Anastassiya V.","Platinum(IV)-mediated Coupling of Dione Monoximes and Nitriles: a Novel Reactivity Pattern of the Classic Oxime-based Chelating Ligands","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050880","12.7602","0.0003","14.1906","0.0004","17.3431","0.0005","87.721","0.001","83.137","0.001","75.782","0.002","3022.21","0.14","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","Phil Gale","","- C38 H31 Fe2 N3 O2 -","- C38 H31 Fe2 N3 O2 -","- C152 H124 Fe8 N12 O8 -","4","2","","Denuault, Guy; Gale, Philip A.; Hursthouse, Michael B.; Light, Mark E.; Warriner, Colin N.","Anion complexation and electrochemical behaviour of ferrocene-appended amido-pyrrole cleftsElectronic supplementary information (ESI) available: 1H and 13C NMR spectra of 1 and 2, 1H NMR titrations of 1 and 2 with various putative anionic guests and with chloride following ferrocene CH resonances. See http://www.rsc.org/suppdata/nj/b2/b202989h/","New Journal of Chemistry","2002","26","7","811","","10.1039/b202989h","","","0.71073","MoKα","","0.0968","0.0456","","","0.0862","0.1016","","","","","","0.955","","","","has coordinates,has disorder","180062","2020-10-21","18:00:00",""
"7050881","12.048","0.002","17.729","0.002","9.155","0.001","90","","112.08","0.01","90","","1812.1","0.4","296.2","","296.2","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C22 H56 Fe N14 Ni2 O8 -","- C22 H40 Fe N14 Ni2 O8 -","- C44 H80 Fe2 N28 Ni4 O16 -","2","0.25","","Shek, Iris P. Y.; Wong, Wing-Tak; Gao, Song; Lau, Tai-Chu","A novel one-dimensional Ni(ii)???Fe(ii) polymer containing ??3-cyanides: [Ni(cyclen)]2[Fe(CN)6]??8H2O","New Journal of Chemistry","2002","26","9","1099","","10.1039/b203077b","","","0.7107","MoKalpha","","","0.0332","","","0.0443","","","","","1.281","1.281","","","","warnings","has coordinates","249448","2020-10-21","18:00:00",""
"7050882","10.1516","0.0001","13.3088","0.0002","24.2596","0.0002","90","","96.108","0.001","90","","3259","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C68 H72 Cu2 N8 O12 -","- C68 H72 Cu2 N8 O12 -","- C136 H144 Cu4 N16 O24 -","2","0.5","","Tian, Yu-Peng; Zhang, Xuan-Jun; Wu, Jie-Ying; Fun, Hoong-Kun; Jiang, Min-Hua; Xu, Zhi-Qiang; Usman, Anwar; Chantrapromma, Suchada; Thompson, Laurence K.","Structural diversity and properties of a series of dinuclear and mononuclear copper(ii) and copper(i) carboxylato complexes","New Journal of Chemistry","2002","26","10","1468","","10.1039/b203334h","","","0.71073","MoKα","","0.1138","0.0638","","","0.169","0.193","","","","","","0.962","","","","has coordinates,has disorder","180062","2020-10-21","18:00:00",""
"7050883","16.1794","0.0001","24.1843","0.0001","16.4207","0.0002","90","","90","","90","","6425.21","0.09","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C40 H28 Cu N4 O4 -","- C40 H28 Cu N4 O4 -","- C320 H224 Cu8 N32 O32 -","8","1","","Tian, Yu-Peng; Zhang, Xuan-Jun; Wu, Jie-Ying; Fun, Hoong-Kun; Jiang, Min-Hua; Xu, Zhi-Qiang; Usman, Anwar; Chantrapromma, Suchada; Thompson, Laurence K.","Structural diversity and properties of a series of dinuclear and mononuclear copper(ii) and copper(i) carboxylato complexes","New Journal of Chemistry","2002","26","10","1468","","10.1039/b203334h","","","0.71073","MoKα","","0.0715","0.0402","","","0.1","0.1126","","","","","","0.904","","","","has coordinates","180062","2020-10-21","18:00:00",""
"7050884","14.2574","0.0004","24.8155","0.0007","21.5853","0.0005","90","","129.63","0.001","90","","5881.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C68 H54 Cl Cu2 N7 O12 -","- C68 H54 Cl Cu2 N7 O12 -","- C272 H216 Cl4 Cu8 N28 O48 -","4","1","","Tian, Yu-Peng; Zhang, Xuan-Jun; Wu, Jie-Ying; Fun, Hoong-Kun; Jiang, Min-Hua; Xu, Zhi-Qiang; Usman, Anwar; Chantrapromma, Suchada; Thompson, Laurence K.","Structural diversity and properties of a series of dinuclear and mononuclear copper(ii) and copper(i) carboxylato complexes","New Journal of Chemistry","2002","26","10","1468","","10.1039/b203334h","","","0.71073","MoKα","","0.214","0.1057","","","0.2616","0.3068","","","","","","0.886","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050885","12.2055","0.0001","13.5557","0.0002","14.4757","0.0001","111.532","0.001","92.833","0.001","109.639","0.001","2057.11","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H40 Cu N O2 P2 -","- C50 H40 Cu N O2 P2 -","- C100 H80 Cu2 N2 O4 P4 -","2","1","","Tian, Yu-Peng; Zhang, Xuan-Jun; Wu, Jie-Ying; Fun, Hoong-Kun; Jiang, Min-Hua; Xu, Zhi-Qiang; Usman, Anwar; Chantrapromma, Suchada; Thompson, Laurence K.","Structural diversity and properties of a series of dinuclear and mononuclear copper(ii) and copper(i) carboxylato complexes","New Journal of Chemistry","2002","26","10","1468","","10.1039/b203334h","","","0.71073","MoKα","","0.1052","0.0698","","","0.1657","0.1866","","","","","","0.871","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050886","10.8966","0.0001","12.9988","0.0002","22.3564","0.0003","90.883","0.001","101.145","0.001","99.031","0.001","3064.97","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H59 Cu2 O2 P3 Se2 -","- C70 H59 Cu2 O2 P3 Se2 -","- C140 H118 Cu4 O4 P6 Se4 -","2","1","","Lu, Zheng; Huang, Wei; Vittal, Jagadese J.","Synthesis, structural characterization, photoluminescence and thermal properties of [(Ph3P)2Cu(??-SeC{O}R)2Cu(PPh3)]Electronic supplementary information (ESI) available: XRPD patterns and SEM images of the residues from pyrolysis of 1???6. See http://www.rsc.org/suppdata/nj/b2/b203466b/","New Journal of Chemistry","2002","26","9","1122","","10.1039/b203466b","","","0.71073","MoKα","","0.089","0.056","","","0.0872","0.0988","","","","","","1.121","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050887","19.4676","0.0002","14.5399","0.0001","20.0449","0.0002","90","","111.69","0.001","90","","5272.12","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H51 Cu2 O2 P3 Se2 -","- C58 H51 Cu2 O2 P3 Se2 -","- C232 H204 Cu8 O8 P12 Se8 -","4","1","","Lu, Zheng; Huang, Wei; Vittal, Jagadese J.","Synthesis, structural characterization, photoluminescence and thermal properties of [(Ph3P)2Cu(??-SeC{O}R)2Cu(PPh3)]Electronic supplementary information (ESI) available: XRPD patterns and SEM images of the residues from pyrolysis of 1???6. See http://www.rsc.org/suppdata/nj/b2/b203466b/","New Journal of Chemistry","2002","26","9","1122","","10.1039/b203466b","","","0.71073","MoKα","","0.0416","0.0288","","","0.0695","0.0769","","","","","","0.988","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050888","9.146","0.003","13.686","0.005","16.544","0.006","68.401","0.006","74.777","0.006","87.234","0.006","1855.2","1.1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H42 La N7 O20 -","- C26 H42 La N7 O20 -","- C52 H84 La2 N14 O40 -","2","1","","Evans, David J.; Junk, Peter C.; Smith, Matthew K.","Intramolecular C???H????? interactions influence the conformation of N,N???-dibenzyl-4,13-diaza-18-crown-6 molecules","New Journal of Chemistry","2002","26","8","1043","","10.1039/b203646k","","","0.71073","MoKα","","0.0433","0.0337","","","0.0793","0.0841","","","","","","0.985","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050889","9.1065","0.0005","13.5946","0.0008","16.5192","0.001","68.578","0.001","75.035","0.001","87.571","0.001","1836.14","0.19","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H42 Eu N7 O20 -","- C26 H42 Eu N7 O20 -","- C52 H84 Eu2 N14 O40 -","2","1","","Evans, David J.; Junk, Peter C.; Smith, Matthew K.","Intramolecular C???H????? interactions influence the conformation of N,N???-dibenzyl-4,13-diaza-18-crown-6 molecules","New Journal of Chemistry","2002","26","8","1043","","10.1039/b203646k","","","0.71073","MoKα","","0.0352","0.0311","","","0.0767","0.0791","","","","","","1.026","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050890","8.139","0.0007","10.6432","0.001","12.1312","0.0011","102.865","0.002","102.057","0.002","91.201","0.002","999.37","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H42 N6 O22 U2 -","- C26 H42 N6 O22 U2 -","- C26 H42 N6 O22 U2 -","1","0.5","","Evans, David J.; Junk, Peter C.; Smith, Matthew K.","Intramolecular C???H????? interactions influence the conformation of N,N???-dibenzyl-4,13-diaza-18-crown-6 molecules","New Journal of Chemistry","2002","26","8","1043","","10.1039/b203646k","","","0.71073","MoKα","","0.0385","0.0333","","","0.0825","0.0933","","","","","","1.111","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7050891","8.782","0.0018","12.828","0.003","14.755","0.003","90","","90.16","0.03","90","","1662.2","0.6","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H44 Cl4 N2 O8 U -","- C26 H44 Cl4 N2 O8 U -","- C52 H88 Cl8 N4 O16 U2 -","2","0.5","","Evans, David J.; Junk, Peter C.; Smith, Matthew K.","Intramolecular C???H????? interactions influence the conformation of N,N???-dibenzyl-4,13-diaza-18-crown-6 molecules","New Journal of Chemistry","2002","26","8","1043","","10.1039/b203646k","","","0.71073","MoKα","","0.079","0.0502","","","0.1354","0.1502","","","","","","1.068","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050892","8.199","0.004","9.361","0.004","13.206","0.006","92.867","0.009","95.03","0.009","96.817","0.009","1000.7","0.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H29 Br2 N O6 -","- C13 H29 Br2 N O6 -","- C26 H58 Br4 N2 O12 -","2","1","","Evans, David J.; Junk, Peter C.; Smith, Matthew K.","Intramolecular C???H????? interactions influence the conformation of N,N???-dibenzyl-4,13-diaza-18-crown-6 molecules","New Journal of Chemistry","2002","26","8","1043","","10.1039/b203646k","","","0.71073","MoKα","","0.0704","0.0574","","","0.1581","0.1681","","","","","","1.019","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050893","14.2352","0.0013","14.2352","0.0013","48.498","0.006","90","","90","","90","","9827.6","1.8","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C53 H41 Au Cl5 N2 P -","- C53 H41 Au Cl5 N2 P -","- C424 H328 Au8 Cl40 N16 P8 -","8","1","","Hansjorg Grutzmacher; Carsten Bohler; Nicola Donati; Daniel Stein","Synthesis of a Tropylidene substituted N-Heterocyclic Carbene (tropNHC): Rearrangement and Formation of its Gold Complex","New Journal of Chemistry","2002","","","","","10.1039/b203670c","","","","","","","0.0958","","","0.2078","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050894","9.7725","0.0014","16.385","0.002","14.939","0.002","90","","97.483","0.004","90","","2371.7","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C33 H24 N2 -","- C33 H24 N2 -","- C132 H96 N8 -","4","1","","Hansjorg Grutzmacher; Carsten Bohler; Nicola Donati; Daniel Stein","Synthesis of a Tropylidene substituted N-Heterocyclic Carbene (tropNHC): Rearrangement and Formation of its Gold Complex","New Journal of Chemistry","2002","","","","","10.1039/b203670c","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050895","10.9073","0.0007","11.0443","0.0003","11.5761","0.0005","95.605","0.004","103.724","0.006","114.101","0.006","1206.47","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[2-Methyl-8-(diphenylphosphino)quinoline]nickel(II) dichloride","","","- C23 H20 Cl4 N Ni P -","- C23 H18 Cl4 N Ni P -","- C46 H36 Cl8 N2 Ni2 P2 -","2","1","","Sun, Wen-Hua; Li, Zilong; Hu, Huaiming; Wu, Biao; Yang, Haijian; Zhu, Ning; Leng, Xuebing; Wang, Honggen","Synthesis and characterization of novel nickel(ii) complexes bearing N,P ligands and their catalytic activity in ethylene oligomerization","New Journal of Chemistry","2002","26","10","1474","","10.1039/b203738f","","","0.71073","MoKα","","0.0726","0.0564","","","0.1497","0.1604","","","","","","1.045","","","","has coordinates,has disorder","180062","2020-10-21","18:00:00",""
"7050896","18.606","0.005","9.184","0.002","34.005","0.009","90","","96.381","0.005","90","","5775","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","chloro(1-naphthyl)[8-(diphenylphosphino)quinoline]nickel(II)","","","- C29 H24.5 Cl N Ni O6 P -","- C31 H23 Cl N Ni O0.75 P -","- C248 H184 Cl8 N8 Ni8 O6 P8 -","8","1","","Sun, Wen-Hua; Li, Zilong; Hu, Huaiming; Wu, Biao; Yang, Haijian; Zhu, Ning; Leng, Xuebing; Wang, Honggen","Synthesis and characterization of novel nickel(ii) complexes bearing N,P ligands and their catalytic activity in ethylene oligomerization","New Journal of Chemistry","2002","26","10","1474","","10.1039/b203738f","","","0.71073","MoKα","","0.1303","0.0536","","","0.1119","0.1305","","","","","","0.947","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050897","11.233","0.003","6.544","0.001","11.231","0.003","90","","95.89","0.02","90","","821.2","0.3","100","1","100","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Aspirin","","","- C9 H8 O4 -","- C9 H8 O4 -","- C36 H32 O16 -","4","1","","Chick Wilson","Interesting proton behaviour in molecular structures. Variable temperature neutron diffraction and ab initio study of acetylsalicylic acid: characterising librational motions and comparing protons in different hydrogen bonding potentials","New Journal of Chemistry","2002","","","","","10.1039/b203775k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050898","11.273","0.003","6.555","0.001","11.271","0.003","90","","95.82","0.02","90","","828.6","0.3","140","1","140","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Aspirin","","","- C9 H8 O4 -","- C9 H8 O4 -","- C36 H32 O16 -","4","1","","Chick Wilson","Interesting proton behaviour in molecular structures. Variable temperature neutron diffraction and ab initio study of acetylsalicylic acid: characterising librational motions and comparing protons in different hydrogen bonding potentials","New Journal of Chemistry","2002","","","","","10.1039/b203775k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050899","11.305","0.003","6.563","0.001","11.305","0.003","90","","95.88","0.02","90","","834.4","0.3","180","1","180","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Aspirin","","","- C9 H8 O4 -","- C9 H8 O4 -","- C36 H32 O16 -","4","1","","Chick Wilson","Interesting proton behaviour in molecular structures. Variable temperature neutron diffraction and ab initio study of acetylsalicylic acid: characterising librational motions and comparing protons in different hydrogen bonding potentials","New Journal of Chemistry","2002","","","","","10.1039/b203775k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050900","11.186","0.003","6.54","0.001","11.217","0.003","90","","96.07","0.02","90","","816","0.3","20","1","20","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Aspirin","","","- C9 H8 O4 -","- C9 H8 O4 -","- C36 H32 O16 -","4","1","","Chick Wilson","Interesting proton behaviour in molecular structures. Variable temperature neutron diffraction and ab initio study of acetylsalicylic acid: characterising librational motions and comparing protons in different hydrogen bonding potentials","New Journal of Chemistry","2002","","","","","10.1039/b203775k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050901","11.34","0.003","6.574","0.001","11.318","0.003","90","","95.87","0.02","90","","839.3","0.3","220","1","220","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Aspirin","","","- C9 H8 O4 -","- C9 H8 O4 -","- C36 H32 O16 -","4","1","","Chick Wilson","Interesting proton behaviour in molecular structures. Variable temperature neutron diffraction and ab initio study of acetylsalicylic acid: characterising librational motions and comparing protons in different hydrogen bonding potentials","New Journal of Chemistry","2002","","","","","10.1039/b203775k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050902","11.416","0.005","6.598","0.002","11.483","0.005","90","","95.6","0.03","90","","860.8","0.6","300","1","300","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Aspirin","","","- C9 H8 O4 -","- C9 H8 O4 -","- C36 H32 O16 -","4","1","","Chick Wilson","Interesting proton behaviour in molecular structures. Variable temperature neutron diffraction and ab initio study of acetylsalicylic acid: characterising librational motions and comparing protons in different hydrogen bonding potentials","New Journal of Chemistry","2002","","","","","10.1039/b203775k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050903","11.204","0.003","6.544","0.001","11.223","0.003","90","","95.95","0.02","90","","818.4","0.3","60","1","60","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Aspirin","","","- C9 H8 O4 -","- C9 H8 O4 -","- C36 H32 O16 -","4","1","","Chick Wilson","Interesting proton behaviour in molecular structures. Variable temperature neutron diffraction and ab initio study of acetylsalicylic acid: characterising librational motions and comparing protons in different hydrogen bonding potentials","New Journal of Chemistry","2002","","","","","10.1039/b203775k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050904","14.563","0.006","40.993","0.016","15.378","0.006","90","","100.376","0.008","90","","9030","6","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C60 H62 F24 N24 Ni4 O P4 S4 -","- C60 H62.01 F24 N24 Ni4 O P4 S4 -","- C240 H248.04 F96 N96 Ni16 O4 P16 S16 -","4","1","","Han Gang; Guo Dong; Duan Chun-Ying; Mo Hong; Meng Qing-jin","Self-assembly of a novel mixed-valence tetranuclear molecular square [FeII3FeIIIL2(HL)2]3+ and [M(HL)]44+ squares (M=Ni, Zn and Cd){H2L=bis(2-acetylpyridine) thiocarbazone}","New J. Chem.","2002","26","10","1371","1377","10.1039/b203819f","","","0.71073","MoKα","","0.1842","0.0775","","","0.1305","0.1572","","","","","","1.012","","","","has coordinates,has disorder","180063","2020-10-21","18:00:00",""
"7050905","13.448","0.005","14.955","0.005","21.554","0.007","87.124","0.006","80.677","0.006","71.389","0.006","4054","2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C60 H61 B4 F16 N24 O0.5 S4 Zn4 -","- C60 H60 B4 F16 N24 O0.5 S4 Zn4 -","- C120 H120 B8 F32 N48 O S8 Zn8 -","2","1","","Han Gang; Guo Dong; Duan Chun-Ying; Mo Hong; Meng Qing-jin","Self-assembly of a novel mixed-valence tetranuclear molecular square [FeII3FeIIIL2(HL)2]3+ and [M(HL)]44+ squares (M=Ni, Zn and Cd){H2L=bis(2-acetylpyridine) thiocarbazone}","New J. Chem.","2002","26","10","1371","1377","10.1039/b203819f","","","0.71073","MoKα","","0.1702","0.0794","","","0.1399","0.1537","","","","","","1.002","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050906","31.6186","0.0017","20.4906","0.0011","29.7552","0.0017","90","","102.644","0.001","90","","18810.4","1.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C69 H69 Cl12 Fe7 N24 O S4 -","- C69 H67 Cl12 Fe7 N24 O S4 -","- C552 H536 Cl96 Fe56 N192 O8 S32 -","8","1","","Han Gang; Guo Dong; Duan Chun-Ying; Mo Hong; Meng Qing-jin","Self-assembly of a novel mixed-valence tetranuclear molecular square [FeII3FeIIIL2(HL)2]3+ and [M(HL)]44+ squares (M=Ni, Zn and Cd){H2L=bis(2-acetylpyridine) thiocarbazone}","New J. Chem.","2002","26","10","1371","1377","10.1039/b203819f","","","0.71073","MoKα","","0.1156","0.0679","","","0.1769","0.1945","","","","","","0.918","","","","has coordinates,has disorder","180063","2020-10-21","18:00:00",""
"7050907","16.9482","0.0003","17.549","0.0001","18.0086","0.0003","61.78","0.001","64.065","0.001","66.171","0.001","4110.71","0.11","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H42 F6 N O2 P3 Pd -","- C41 H42 F6 N O2 P3 Pd -","- C164 H168 F24 N4 O8 P12 Pd4 -","4","2","","Roberto Mosteiro; Alberto Fernández; Margarita López-Torres; Digna Vázquez-García; Antonio Suárez; Jesús J. Fernández; José M. Vila","Nucleophilic addition of 1,3-dicarbonyl compounds as a route to functionalized cyclopalladated complexes with chelated 1,1-bis(diphenylphosphino)ethene","New J. Chem.","2002","26","10","1425","1432","10.1039/b203864a","","","0.71073","MoKα","","0.1151","0.0688","","","0.1671","0.2027","","","","","","1.074","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050908","21.0537","0.0002","9.722","0.0003","23.3385","0.0001","90","","90.661","0.001","90","","4776.7","0.16","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H54 F6 N O5 P3 Pd -","- C48 H54 F6 N O5 P3 Pd -","- C192 H216 F24 N4 O20 P12 Pd4 -","4","1","","Roberto Mosteiro; Alberto Fernández; Margarita López-Torres; Digna Vázquez-García; Antonio Suárez; Jesús J. Fernández; José M. Vila","Nucleophilic addition of 1,3-dicarbonyl compounds as a route to functionalized cyclopalladated complexes with chelated 1,1-bis(diphenylphosphino)ethene","New J. Chem.","2002","26","10","1425","1432","10.1039/b203864a","","","0.71073","MoKα","","0.1069","0.055","","","0.1417","0.1854","","","","","","0.868","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050909","9.8575","0.0017","10.3607","0.0017","22.02","0.004","90","","96.544","0.003","90","","2234.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Cl4 N4 Ru -","- C22 H16 Cl4 N4 Ru -","- C88 H64 Cl16 N16 Ru4 -","4","1","","Das, Chayan; Kamar, Kunal K.; Ghosh, Amit K.; Majumdar, Partha; Hung, Chen-Hsuing; Goswami, Sreebrata","Ruthenium complexes of quinone related N-aryl-1,2-diimines. Metal mediated synthesis, X-ray structure and chemical reactionElectronic supplementary information (ESI) available: partial energy level diagram and molecular orbitals of 1c. See http://www.rsc.org/suppdata/nj/b2/b203956g/","New Journal of Chemistry","2002","26","10","1409","","10.1039/b203956g","","","0.71073","MoKα","","0.034","0.0232","","","0.0335","0.0353","","","","","","0.978","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050910","13.192","0.001","7.6662","0.0006","28.549","0.002","90","","100.341","0.002","90","","2840.3","0.4","120","","120","","","","","","","","","8","P 1 2/n 1","-P 2yac","13","","","","- C25.78 H37.134 Cl2 Fe N O1.288 Ru S4 -","- C25.78 H33 Cl2 Fe N O1.288 Ru S4 -","- C103.12 H132 Cl8 Fe4 N4 O5.152 Ru4 S16 -","4","1","","Carla D. Nunes; Teresa M. Santos; Helena M. Carapuça; Alan Hazell; Martyn Pillinger; João Madureira; Wen-Mei Xue; Fritz E. Kühn; Isabel S. Gonçalves","Synthesis and characterisation of ruthenium(II) complexes containing ferrocenyl-derived ligands","New J. Chem.","2002","26","10","1384","1388","10.1039/b204002f","","","0.71073","MoKα","","","0.052","","","","0.046","","","","","","0.945","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050911","11.2388","0.0007","14.3914","0.0008","21.7918","0.0013","100.185","0.002","90.251","0.002","99.638","0.002","3418","0.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H37 Cl2 N P2 Pt Se -","- C36 H37 Cl2 N P2 Pt Se -","- C144 H148 Cl8 N4 P8 Pt4 Se4 -","4","2","","Durran, Sean E.; Elsegood, Mark R. J.; Smith, Martin B.","New complexes of functionalised ligands bearing P/N/Se or P2Se donor sets","New Journal of Chemistry","2002","26","10","1402","","10.1039/b204005k","","","0.71073","MoKα","","0.0417","0.0326","","","0.0751","0.0792","","","","","","1.045","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050912","14.6694","0.001","11.6913","0.0008","22.9159","0.0016","90","","102.898","0.002","90","","3831","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H36 Cl5 N P2 Pd Se -","- C36 H36 Cl5 N P2 Pd Se -","- C144 H144 Cl20 N4 P8 Pd4 Se4 -","4","1","","Durran, Sean E.; Elsegood, Mark R. J.; Smith, Martin B.","New complexes of functionalised ligands bearing P/N/Se or P2Se donor sets","New Journal of Chemistry","2002","26","10","1402","","10.1039/b204005k","","","0.71073","MoKα","","0.0909","0.0534","","","0.1306","0.1554","","","","","","1.073","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050913","19.9268","0.0007","10.3898","0.0004","26.4969","0.001","90","","92.509","0.002","90","","5480.5","0.4","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 Cl2 N P Pt Se -","- C29 H28 Cl2 N P Pt Se -","- C232 H224 Cl16 N8 P8 Pt8 Se8 -","8","2","","Durran, Sean E.; Elsegood, Mark R. J.; Smith, Martin B.","New complexes of functionalised ligands bearing P/N/Se or P2Se donor sets","New Journal of Chemistry","2002","26","10","1402","","10.1039/b204005k","","","0.71073","MoKα","","0.0415","0.025","","","0.0514","0.0573","","","","","","1.027","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050914","10.2746","0.0008","14.3334","0.0011","14.3424","0.0011","98.698","0.002","108.957","0.002","100.683","0.002","1911.5","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C31.5 H30.5 Cl9.5 N P Pd Se -","- C31.5 H30.5 Cl9.5 N P Pd Se -","- C63 H61 Cl19 N2 P2 Pd2 Se2 -","2","1","","Durran, Sean E.; Elsegood, Mark R. J.; Smith, Martin B.","New complexes of functionalised ligands bearing P/N/Se or P2Se donor sets","New Journal of Chemistry","2002","26","10","1402","","10.1039/b204005k","","","0.71073","MoKα","","0.0737","0.0442","","","0.1061","0.1206","","","","","","1.023","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050915","9.5384","0.0004","9.5384","0.0004","33.0881","0.0016","90","","90","","120","","2607.1","0.2","150","2","150","2","","","","","","","","7","P 32","P 32","145","","","","- C35 H35 Au2 Cl2 N P2 Se -","- C35 H35 Au2 Cl2 N P2 Se -","- C105 H105 Au6 Cl6 N3 P6 Se3 -","3","1","","Durran, Sean E.; Elsegood, Mark R. J.; Smith, Martin B.","New complexes of functionalised ligands bearing P/N/Se or P2Se donor sets","New Journal of Chemistry","2002","26","10","1402","","10.1039/b204005k","","","0.71073","MoKα","","0.0192","0.0176","","","0.0343","0.0346","","","","","","0.843","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050916","9.8693","0.0007","23.8471","0.0017","11.7404","0.0008","90","","99.652","0.002","90","","2724","0.3","150","2","150","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 B Cl F4 N P Pt Se -","- C28 H26 B Cl F4 N P Pt Se -","- C112 H104 B4 Cl4 F16 N4 P4 Pt4 Se4 -","4","1","","Durran, Sean E.; Elsegood, Mark R. J.; Smith, Martin B.","New complexes of functionalised ligands bearing P/N/Se or P2Se donor sets","New Journal of Chemistry","2002","26","10","1402","","10.1039/b204005k","","","0.71073","MoKα","","0.0605","0.0338","","","0.0705","0.0822","","","","","","1.037","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050917","18.759","0.005","17.551","0.005","9.964","0.005","90","","91.31","0.005","90","","3280","2","223","0.1","223","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H56 Fe P2 -","- C32 H56 Fe P2 -","- C128 H224 Fe4 P8 -","4","1","","Xavier Sava; Mohand Melaimi; Nicolas Mézailles; Louis Ricard; François Mathey; Pascal Le Floch","Cationic diphosphaferrocene gallium dichloride complexes","New J. Chem.","2002","26","10","1378","1383","10.1039/b204075c","","","0.71069","MoKα","","0.0555","0.0374","","","0.0911","0.0986","","","","","","1.037","","","","has coordinates,has disorder","180063","2020-10-21","18:00:00",""
"7050918","11.558","0.005","14.425","0.005","25.091","0.005","90","0.005","90","0.005","90","0.005","4183","2","150","1","150","1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H56 Cl6 Fe Ga2 P2 -","- C32 H56 Cl6 Fe Ga2 P2 -","- C128 H224 Cl24 Fe4 Ga8 P8 -","4","1","","Xavier Sava; Mohand Melaimi; Nicolas Mézailles; Louis Ricard; François Mathey; Pascal Le Floch","Cationic diphosphaferrocene gallium dichloride complexes","New J. Chem.","2002","26","10","1378","1383","10.1039/b204075c","","","0.71069","MoKα","","0.0404","0.031","","","0.0678","0.0716","","","","","","1.017","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050919","9.7114","0.0002","10.4231","0.0002","11.8636","0.0003","70.951","0.001","70.758","0.001","70.161","0.001","1034.91","0.04","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","3-{4-[4-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl}-1, 1-diphenyl-prop-2-yn-1-ol dimethylformamide solvate","","- C48 H44 N4 O4 -","- C48 H44 N4 O4 -","- C48 H44 N4 O4 -","1","0.5","","Scott, Janet; Asami, Masaya; Tanaka, Koichi","Novel chromogenic, guest-sensitive host compounds","New Journal of Chemistry","2002","26","12","1822","","10.1039/b204221e","","","0.71073","MoKα","","0.132","0.0524","","","0.129","0.1559","","","","","","0.966","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050920","5.8554","0.0002","9.3045","0.0005","14.6994","0.0005","71.827","0.003","89.422","0.003","78.702","0.002","745.04","0.06","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","3-{4-[4-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl}-1, 1-diphenyl-prop-2-yn-1-ol","","- C42 H30 N2 O2 -","- C42 H30 N2 O2 -","- C42 H30 N2 O2 -","1","0.5","","Scott, Janet; Asami, Masaya; Tanaka, Koichi","Novel chromogenic, guest-sensitive host compounds","New Journal of Chemistry","2002","26","12","1822","","10.1039/b204221e","","","0.71073","MoKα","","0.0532","0.0415","","","0.1011","0.1092","","","","","","1.033","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050921","11.7388","0.0003","12.0389","0.0002","16.7993","0.0003","76.252","0.001","72.534","0.001","61.24","0.001","1972.91","0.07","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","3-{2-[2-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl} -1,1-diphenyl-prop-2-yn-1-ol DMSO solvate","","- C46 H42 N2 O4 S2 -","- C46 H42 N2 O4 S2 -","- C92 H84 N4 O8 S4 -","2","1","","Scott, Janet; Asami, Masaya; Tanaka, Koichi","Novel chromogenic, guest-sensitive host compounds","New Journal of Chemistry","2002","26","12","1822","","10.1039/b204221e","","","0.71073","MoKα","","0.1481","0.0524","","","0.1046","0.1287","","","","","","0.893","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050922","29.7426","0.0002","12.4739","0.0002","9.5222","0.0004","90","","92.875","0.001","90","","3528.35","0.16","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","3-{3-[3-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl} -1,1-diphenyl-prop-2-yn-1-ol DMSO solvate","","- C44 H36 N2 O3 S -","- C44 H30 N2 O3 S -","- C176 H120 N8 O12 S4 -","4","0.5","","Scott, Janet; Asami, Masaya; Tanaka, Koichi","Novel chromogenic, guest-sensitive host compounds","New Journal of Chemistry","2002","26","12","1822","","10.1039/b204221e","","","0.71073","MoKα","","0.0856","0.0531","","","0.1456","0.1628","","","","","","1.045","","","","has coordinates,has disorder","180063","2020-10-21","18:00:00",""
"7050923","8.6442","0.0001","11.6634","0.0002","20.1599","0.0004","90","","101.248","0.001","90","","1993.5","0.06","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-{3-[3-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl} -1,1-diphenyl-prop-2-yn-1-ol DMF solvate","","- C48 H44 N4 O4 -","- C48 H44 N4 O4 -","- C96 H88 N8 O8 -","2","0.5","","Scott, Janet; Asami, Masaya; Tanaka, Koichi","Novel chromogenic, guest-sensitive host compounds","New Journal of Chemistry","2002","26","12","1822","","10.1039/b204221e","","","0.71073","MoKα","","0.1013","0.0459","","","0.0971","0.112","","","","","","0.941","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050924","11.8006","0.0002","22.0051","0.0004","15.1395","0.0003","90","","91.658","0.001","90","","3929.68","0.12","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-{4-[4-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-phenylazo]-phenyl} -1,1-diphenyl-prop-2-yn-1-ol 3 DMSO solvate","","- C46 H42 N2 O4 S2 -","- C46 H42 N2 O4 S2 -","- C184 H168 N8 O16 S8 -","4","1","","Scott, Janet; Asami, Masaya; Tanaka, Koichi","Novel chromogenic, guest-sensitive host compounds","New Journal of Chemistry","2002","26","12","1822","","10.1039/b204221e","","","0.71073","MoKα","","0.1119","0.0533","","","0.1128","0.1264","","","","","","1.066","","","","has coordinates,has disorder","180063","2020-10-21","18:00:00",""
"7050925","9.5039","0.0006","16.3981","0.0011","23.0294","0.0016","90","","94.339","0.002","90","","3578.8","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H46 Mg N4 O2 -","- C38 H46 Mg N4 O2 -","- C152 H184 Mg4 N16 O8 -","4","1","","Junk, Peter Courtney; Cole, Marcus L.; Evans, David J.; Louis, Lance M.","Structural and synthetic studies of magnesium and zinc tolylformamidinate complexes","New Journal of Chemistry","2002","","","","","10.1039/b204304a","","","","","","","","","","","","","","","","","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050926","13.7728","0.0019","13.7728","0.0019","17.993","0.004","90","","90","","90","","3413.1","1","123","2","123","2","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C38 H46 Mg N4 O2 -","- C38 H46 Mg N4 O2 -","- C152 H184 Mg4 N16 O8 -","4","0.5","","Junk, Peter Courtney; Cole, Marcus L.; Evans, David J.; Louis, Lance M.","Structural and synthetic studies of magnesium and zinc tolylformamidinate complexes","New Journal of Chemistry","2002","","","","","10.1039/b204304a","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050927","10.125","0.009","22.47","0.02","8.326","0.008","90","","90","","90","","1894","3","296","2","296","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C38 H50 Mg N4 O4 -","- C38 H50 Mg N4 O4 -","- C76 H100 Mg2 N8 O8 -","2","0.5","","Junk, Peter Courtney; Cole, Marcus L.; Evans, David J.; Louis, Lance M.","Structural and synthetic studies of magnesium and zinc tolylformamidinate complexes","New Journal of Chemistry","2002","","","","","10.1039/b204304a","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050928","13.519","0.007","14.559","0.008","18.815","0.01","90","","111.055","0.007","90","","3456","3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H46 Mg N6 -","- C36 H46 Mg N6 -","- C144 H184 Mg4 N24 -","4","1","","Junk, Peter Courtney; Cole, Marcus L.; Evans, David J.; Louis, Lance M.","Structural and synthetic studies of magnesium and zinc tolylformamidinate complexes","New Journal of Chemistry","2002","","","","","10.1039/b204304a","","","","","","","","","","","","","","","","","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050929","28.594","0.003","28.594","0.003","28.594","0.003","90","","90","","90","","23380","4","296","2","296","2","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","[(eta4-O)Zn(FTolP)6]","","","- C90 H90 N12 O Zn4 -","- C90 H90 N12 O Zn4 -","- C720 H720 N96 O8 Zn32 -","8","0.0833333","","Junk, Peter Courtney; Cole, Marcus L.; Evans, David J.; Louis, Lance M.","Structural and synthetic studies of magnesium and zinc tolylformamidinate complexes","New Journal of Chemistry","2002","","","","","10.1039/b204304a","","","","","","","","","","","","","","","","","","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7050930","16.3548","0.0005","10.4935","0.0004","13.0115","0.0004","90","","122.023","0.0019","90","","1893.23","0.12","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H14 Cd N8 -","- C17 H14 Cd N8 -","- C68 H56 Cd4 N32 -","4","0.5","","Gao, En-Qing; Wang, Zhe-Ming; Liao, Chun-Sheng; Yan, Chun-Hua","Topological isomerism in the formation of a novel three-dimensional metal-organic polycatenane","New Journal of Chemistry","2002","26","9","1096","","10.1039/b204324f","","","0.71073","MoKα","","0.0878","0.0341","","","0.0678","0.0801","","","","","","1.005","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050931","13.214","0.0002","21.7332","0.0004","28.7125","0.0005","90","","90","","90","","8245.7","0.2","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C17 H14 Cd N8 -","- C17 H14 Cd N8 -","- C272 H224 Cd16 N128 -","16","0.5","","Gao, En-Qing; Wang, Zhe-Ming; Liao, Chun-Sheng; Yan, Chun-Hua","Topological isomerism in the formation of a novel three-dimensional metal-organic polycatenane","New Journal of Chemistry","2002","26","9","1096","","10.1039/b204324f","","","0.71073","MoKα","","0.065","0.0438","","","0.1272","0.1493","","","","","","1.084","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050932","9.1945","0.0011","9.7882","0.0012","10.9604","0.0012","91.929","0.014","106.072","0.013","99.804","0.015","930.6","0.2","173","1","173","1","","","","","","","see text","4","P -1","-P 1","2","","","","- C26 H18 Mo O2 -","- C26 H18 Mo O2 -","- C52 H36 Mo2 O4 -","2","1","","Maria J. Calhorda; Isabel S. Gonçalves; Brian J. Goodfellow; Eberhardt Herdtweck; Carlos C. Romão; Beatriz Royo; Luís F. Veiros","Exocyclic coordination of the η3-fluorenyl, η3-cyclopenta[def]phenanthrenyl and η3-8,9-dihydrocyclopenta[def]phenanthrenyl anions: X-ray crystal structures, NMR fluxionality and theoretical studies","New J. Chem.","2002","26","11","1552","1558","10.1039/b204418h","","","0.71073","MoKα","","0.0244","0.0205","","","0.0515","0.0523","","","","","","1.011","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050933","9.76","0.0008","10.8026","0.001","17.744","0.002","90","","95.899","0.01","90","","1860.9","0.3","123","1","123","1","","","","","","","see text","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H16 Mo O2 -","- C26 H16 Mo O2 -","- C104 H64 Mo4 O8 -","4","1","","Maria J. Calhorda; Isabel S. Gonçalves; Brian J. Goodfellow; Eberhardt Herdtweck; Carlos C. Romão; Beatriz Royo; Luís F. Veiros","Exocyclic coordination of the η3-fluorenyl, η3-cyclopenta[def]phenanthrenyl and η3-8,9-dihydrocyclopenta[def]phenanthrenyl anions: X-ray crystal structures, NMR fluxionality and theoretical studies","New J. Chem.","2002","26","11","1552","1558","10.1039/b204418h","","","0.71073","MoKα","","0.0249","0.0222","","","0.0587","0.0598","","","","","","1.046","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050934","10.242","0.004","17.141","0.006","16.496","0.006","90","","100.767","0.008","90","","2845","1.8","296","2","296","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C22 H24 Cl2 N2.5 -","- C22 H24 Cl2 N2.5 -","- C88 H96 Cl8 N10 -","4","1","","Cole, Marcus L.; Jones, Cameron; Junk, Peter C.","Studies of the reactivity of N-heterocyclic carbenes with halogen and halide sources","New Journal of Chemistry","2002","26","10","1296","","10.1039/b204422f","","","0.71073","MoKα","","0.1278","0.0759","","","0.1946","0.2256","","","","","","0.956","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050935","11.4179","0.0012","14.837","0.0016","13.4527","0.0014","90","","114.275","0.002","90","","2077.5","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Br2 N2 -","- C21 H22 Br2 N2 -","- C84 H88 Br8 N8 -","4","1","","Cole, Marcus L.; Jones, Cameron; Junk, Peter C.","Studies of the reactivity of N-heterocyclic carbenes with halogen and halide sources","New Journal of Chemistry","2002","26","10","1296","","10.1039/b204422f","","","0.71073","MoKα","","0.0799","0.0579","","","0.1418","0.1553","","","","","","0.934","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050936","11.5086","0.0015","19.474","0.003","13.6523","0.0018","90","","101.511","0.002","90","","2998.2","0.7","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 Br2 N5 -","- C27 H33 Br2 N5 -","- C108 H132 Br8 N20 -","4","1","","Cole, Marcus L.; Jones, Cameron; Junk, Peter C.","Studies of the reactivity of N-heterocyclic carbenes with halogen and halide sources","New Journal of Chemistry","2002","26","10","1296","","10.1039/b204422f","","","0.71073","MoKα","","0.0718","0.048","","","0.1131","0.1249","","","","","","0.965","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050937","8.7182","0.0009","14.0483","0.0015","16.2655","0.0018","90","","101.879","0.002","90","","1949.5","0.4","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H25 Br N2 -","- C21 H25 Br N2 -","- C84 H100 Br4 N8 -","4","2","","Cole, Marcus L.; Jones, Cameron; Junk, Peter C.","Studies of the reactivity of N-heterocyclic carbenes with halogen and halide sources","New Journal of Chemistry","2002","26","10","1296","","10.1039/b204422f","","","0.71073","MoKα","","0.0583","0.0424","","","0.0933","0.0992","","","","","","0.943","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050938","16.952","0.003","18.808","0.003","19.068","0.003","63.838","0.003","88.463","0.004","77.431","0.004","5309.3","1.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H96 Al4 Cl20 N8 -","- C84 H96 Al4 Cl20 N8 -","- C168 H192 Al8 Cl40 N16 -","2","1","","Cole, Marcus L.; Jones, Cameron; Junk, Peter C.","Studies of the reactivity of N-heterocyclic carbenes with halogen and halide sources","New Journal of Chemistry","2002","26","10","1296","","10.1039/b204422f","","","0.71073","MoKα","","0.229","0.0688","","","0.1462","0.2101","","","","","","0.818","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050939","11.6652","0.0008","18.8842","0.0012","16.81","0.0011","90","","101.261","0.001","90","","3631.7","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H32 N10 O6 Ru -","- C32 H28 N10 O5.98 Ru -","- C128 H112 N40 O23.92 Ru4 -","4","0.5","","Byabartta, P.; Jasimuddin, Sk.; Ghosh, B. K.; Sinha, C.; Slawin, A. M. Z.; Woollins, J. D.","Nitro???ruthenium(ii)???arylazoimidazoles: synthesis, spectra, crystal structure and electrochemistry of dinitro-bis{1-alkyl-2-(arylazo)imidazole}ruthenium(ii). Nitro???nitroso derivatives and reactivity of the electrophilic {Ru-NO}6 system","New Journal of Chemistry","2002","26","10","1415","","10.1039/b204442k","","","0.71073","MoKα","","0.1259","0.0768","","0.293","0.1889","","","","1.007","1.068","1.068","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050940","10.2946","0.0002","10.9414","0.0002","10.9792","0.0002","87.57","0.001","66.034","0.001","71.624","0.001","1067.18","0.04","150","","150","","","","","","","","","5","P -1","-P 1","2","","rac-[2-(diphenylphosphino)ferrocenyl]methyl acetate","","- C25 H23 Fe O2 P -","- C25 H23 Fe O2 P -","- C50 H46 Fe2 O4 P2 -","2","1","","Petr Štěpnička; Ivana Císařová","Hydrogen bonding and self-assembly in the crystal structures of ferrocenylmethanol derivatives having different phosphorus substituents on the ferrocene unit","New J. Chem.","2002","26","10","1389","1396","10.1039/b204655p","","","0.71073","MoKα","","0.033","0.029","","","0.0736","0.076","","","","","","1.057","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050941","7.8638","0.0001","10.1888","0.0002","12.027","0.0002","89.292","0.001","81.086","0.001","80.009","0.001","937.46","0.03","150","","150","","","","","","","","","5","P -1","-P 1","2","","rac-2-(diphenylphosphino)ferrocenylmethanol","","- C23 H21 Fe O P -","- C23 H21 Fe O P -","- C46 H42 Fe2 O2 P2 -","2","1","","Petr Štěpnička; Ivana Císařová","Hydrogen bonding and self-assembly in the crystal structures of ferrocenylmethanol derivatives having different phosphorus substituents on the ferrocene unit","New J. Chem.","2002","26","10","1389","1396","10.1039/b204655p","","","0.71073","MoKα","","0.0357","0.0307","","","0.0799","0.0834","","","","","","1.057","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050942","7.8574","0.0002","10.1678","0.0002","12.1411","0.0003","90.566","0.002","100.6","0.002","97.935","0.002","943.68","0.04","150","","150","","","","","","","","","5","P -1","-P 1","2","","2-(diphenylphosphinoyl)ferrocenylmethanol","","- C23 H21 Fe O2 P -","- C23 H21 Fe O2 P -","- C46 H42 Fe2 O4 P2 -","2","1","","Petr Štěpnička; Ivana Císařová","Hydrogen bonding and self-assembly in the crystal structures of ferrocenylmethanol derivatives having different phosphorus substituents on the ferrocene unit","New J. Chem.","2002","26","10","1389","1396","10.1039/b204655p","","","0.71073","MoKα","","0.0373","0.0314","","","0.0784","0.0819","","","","","","1.05","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050943","8.6792","0.0001","17.6265","0.0003","13.2883","0.0002","90","","105.749","0.001","90","","1956.58","0.05","150","","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(diphenylthiophosphoryl)ferrocenylmethanol","","- C23 H21 Fe O P S -","- C23 H21 Fe O P S -","- C92 H84 Fe4 O4 P4 S4 -","4","1","","Petr Štěpnička; Ivana Císařová","Hydrogen bonding and self-assembly in the crystal structures of ferrocenylmethanol derivatives having different phosphorus substituents on the ferrocene unit","New J. Chem.","2002","26","10","1389","1396","10.1039/b204655p","","","0.71073","MoKα","","0.0328","0.0294","","","0.0691","0.0712","","","","","","1.066","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050944","23.81","0.005","13.142","0.003","12.281","0.003","90","","99.48","0.03","90","","3790.4","1.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N5 O3 -","- C20 H21 N5 O3 -","- C160 H168 N40 O24 -","8","2","","Rachid Jalal; Malika El Messaoudi; Aïssa Hasnaoui; M'hamed Esseffar; Mohamed Selkti; Jean-Pierre Lavergne; Philippe Compain","Synthesis of a novel heterocyclic ring system by way of highly regio- and chemoselective 1,3-dipolar cycloaddition of nitrilimines to 1,3,4-benzotriazepin-5-one derivatives","New J. Chem.","2002","26","11","1545","1548","10.1039/b204659h","","","0.71073","MoKα","","0.1352","0.0665","","","0.1329","0.1637","","","","","","1.009","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050945","8.063","0.002","14.142","0.003","19.642","0.004","90","","92.98","0.03","90","","2236.7","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 N5 O3 -","- C26 H25 N5 O3 -","- C104 H100 N20 O12 -","4","1","","Rachid Jalal; Malika El Messaoudi; Aïssa Hasnaoui; M'hamed Esseffar; Mohamed Selkti; Jean-Pierre Lavergne; Philippe Compain","Synthesis of a novel heterocyclic ring system by way of highly regio- and chemoselective 1,3-dipolar cycloaddition of nitrilimines to 1,3,4-benzotriazepin-5-one derivatives","New J. Chem.","2002","26","11","1545","1548","10.1039/b204659h","","","0.71073","MoKα","","0.1303","0.0635","","","0.1534","0.1882","","","","","","1.024","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050946","10.1511","0.0011","24.438","0.003","9.844","0.0011","90","","90","","90","","2442.1","0.5","223","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C22 H38 As Cl P2 -","- C22 H38 As Cl P2 -","- C88 H152 As4 Cl4 P8 -","4","0.5","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7050947","10.441","0.002","18.702","0.004","15.226","0.003","90","","103.99","0.03","90","","2885","1","150","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H40 O5 P2 W -","- C27 H40 O5 P2 W -","- C108 H160 O20 P8 W4 -","4","1","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050948","9.427","0.0019","16.555","0.003","16.512","0.003","90","","93.34","0.03","90","","2572.6","0.9","150","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H40 Cl2 P4 -","- C22 H40 Cl2 P4 -","- C88 H160 Cl8 P16 -","4","1","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050949","8.138","0.0016","12.136","0.002","16.208","0.003","90","","95.58","0.03","90","","1593.2","0.5","150","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H20 Cl4 P2 -","- C11 H20 Cl4 P2 -","- C44 H80 Cl16 P8 -","4","1","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050950","10.367","0.002","27.93","0.006","10.889","0.002","90","","114.71","0.03","90","","2864.2","1","150","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H40 Cl4 P2 Sb2 -","- C22 H40 Cl4 P2 Sb2 -","- C88 H160 Cl16 P8 Sb8 -","4","1","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050951","9.7667","0.0008","9.8576","0.0006","12.5778","0.0009","87.871","0.005","69.191","0.006","69.303","0.006","1053.47","0.13","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H30 P2 -","- C23 H30 P2 -","- C46 H60 P4 -","2","1","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050952","10.012","0.004","10.877","0.004","15.047","0.007","72.31","0.03","89.79","0.03","66.25","0.03","1415.7","1","150","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H51 P3 -","- C28 H51 P3 -","- C56 H102 P6 -","2","1","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050953","10.124","0.002","23.941","0.005","9.791","0.002","90","","90","","90","","2373.1","0.8","150","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C22 H40 Cl P3 -","- C22 H38 Cl P3 -","- C88 H152 Cl4 P12 -","4","0.5","","Jones, Cameron; Junk, Peter; Richards, Anne F.; Waugh, M.","The interaction of phosphavinyl Grignard reagents with group 15 halides: synthesis and structural characterization of novel heterocyclic and heterocage compounds","New Journal of Chemistry","2002","","","","","10.1039/b204663f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7050954","8.2477","0.0002","10.7053","0.0003","10.4233","0.0003","103.085","0.0011","91.7871","0.0015","100.806","0.0011","877.91","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C5 H9 Cl I5 N5 O -","- C5 H9 Cl I5 N5 O -","- C10 H18 Cl2 I10 N10 O2 -","2","1","","Cheng, Ya-Jun; Wang, Zhe-Ming; Liao, Chun-Sheng; Yan, Chun-Hua","Novel sheet-like supramolecular architectures constructed from infinite hydrogen-bonded, protonated adenine???water???halide and polyiodide ribbons","New Journal of Chemistry","2002","26","10","1360","","10.1039/b204805a","","","0.71073","MoKα","","0.0605","0.0319","","","0.0653","0.0729","","","","","","0.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050955","8.4401","0.0003","10.5059","0.0004","10.647","0.0003","102.676","0.002","92.067","0.002","101.766","0.0016","898.48","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C5 H9 Br I5 N5 O -","- C5 H9 Br I5 N5 O -","- C10 H18 Br2 I10 N10 O2 -","2","1","","Cheng, Ya-Jun; Wang, Zhe-Ming; Liao, Chun-Sheng; Yan, Chun-Hua","Novel sheet-like supramolecular architectures constructed from infinite hydrogen-bonded, protonated adenine???water???halide and polyiodide ribbons","New Journal of Chemistry","2002","26","10","1360","","10.1039/b204805a","","","0.71073","MoKα","","0.0608","0.0396","","","0.0938","0.1036","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050956","12.4041","0.0004","12.8322","0.0005","12.5015","0.0003","90","","105.352","0.002","90","","1918.88","0.11","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H9 Br I5 N5 O -","- C5 H11 I6 N5 O2 -","- C20 H44 I24 N20 O8 -","4","1","","Cheng, Ya-Jun; Wang, Zhe-Ming; Liao, Chun-Sheng; Yan, Chun-Hua","Novel sheet-like supramolecular architectures constructed from infinite hydrogen-bonded, protonated adenine???water???halide and polyiodide ribbons","New Journal of Chemistry","2002","26","10","1360","","10.1039/b204805a","","","0.71073","MoKα","","0.0537","0.0319","","","0.0623","0.0687","","","","","","1.036","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050957","11.261","0.002","13.805","0.003","21.546","0.004","90","","90","","90","","3349.5","1.1","160","2","160","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H45 N3 O6 S3 -","- C33 H45 N3 O6 S3 -","- C132 H180 N12 O24 S12 -","4","1","","Scheuermann, J. Erik W.; Ronketti, Fiona; Motevalli, Majid; Griffiths, D. Vaughan; Watkinson, Michael","The synthesis of C2-symmetric 1,4,7-triazacyclononane ligands derived from chiral aziridines","New Journal of Chemistry","2002","26","8","1054","","10.1039/b204818c","","x-ray","0.71073","MoKα","","0.1912","0.0569","","","0.1036","0.1327","","","","","","1.037","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050958","8.18","0.005","23.468","0.008","10.149","0.004","90","","90","","90","","1948.3","1.6","293","2","293","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H28 N2 O2 S -","- C21 H28 N2 O2 S -","- C84 H112 N8 O8 S4 -","4","1","","Scheuermann, J. Erik W.; Ronketti, Fiona; Motevalli, Majid; Griffiths, D. Vaughan; Watkinson, Michael","The synthesis of C2-symmetric 1,4,7-triazacyclononane ligands derived from chiral aziridines","New Journal of Chemistry","2002","26","8","1054","","10.1039/b204818c","","x-ray","0.71073","MoKα","","0.0506","0.0384","","","0.1116","0.1288","","","","","","1.106","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050959","5.687","0.0009","11.0509","0.0017","6.8521","0.0011","90","","102.624","0.003","90","","420.22","0.11","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,2'-Dimethyl-2,2'-bi-1,3-dioxolanyl","","- C8 H14 O4 -","- C8 H14 O4 -","- C16 H28 O8 -","2","0.5","","Chen, Wang; Lam, Yu-Lin; Wong, Ming Wah; Huang, Hsing Hua; Liang, Eping","Gauche/trans equilibria of 2,2'-bi-1,3-dioxolanyl, 2,2'-dimethyl-2,2'-bi-1,3-dioxolanyl, 2,2'-bi-1,3-dithiolanyl and 2,2'-dimethyl-2,2'-bi-1,3-dithiolanyl in different media–theory and experiment","New Journal of Chemistry","2002","26","11","1686","1692","10.1039/b205139g","","","0.71073","MoKα","","0.0836","0.0668","","","0.1634","0.1963","","","","","","1.1","","","","has coordinates","275124","2022-05-06","17:30:31",""
"7050960","6.486","0.006","7.358","0.007","12.386","0.012","101.2","0.02","95.68","0.02","106.4","0.02","548.8","0.9","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","2,2'-Dimethyl-2,2'-bi-1,3-dithiolanyl","","- C8 H14 S4 -","- C8 H14 S4 -","- C16 H28 S8 -","2","1","","Chen, Wang; Lam, Yu-Lin; Wong, Ming Wah; Huang, Hsing Hua; Liang, Eping","Gauche/trans equilibria of 2,2'-bi-1,3-dioxolanyl, 2,2'-dimethyl-2,2'-bi-1,3-dioxolanyl, 2,2'-bi-1,3-dithiolanyl and 2,2'-dimethyl-2,2'-bi-1,3-dithiolanyl in different media–theory and experiment","New Journal of Chemistry","2002","26","11","1686","1692","10.1039/b205139g","","","0.71073","MoKα","","0.0839","0.0584","","","0.1245","0.135","","","","","","0.972","","","","has coordinates","275124","2022-05-06","17:30:31",""
"7050961","8.732","0.0017","9.807","0.002","12.723","0.003","75.09","0.03","78.35","0.03","86.02","0.03","1031","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H56 Cl2 N6 O16 Zn2 -","- C32 H56 Cl2 N6 O16 Zn2 -","- C32 H56 Cl2 N6 O16 Zn2 -","1","0.5","","Li, Shu-An; Yang, De-Xi; Li, Dong-Feng; Huang, Jin; Tang, Wen-Xia","Carboxyester hydrolysis promoted by dizinc(ii) macrocyclic polyamine complexes with hydroxyethyl pendants: a model study for the role of the serine alkoxide nucleophile in zinc enzymes","New Journal of Chemistry","2002","26","12","1831","","10.1039/b205302k","","","0.71073","MoKα","","0.0679","0.0334","","","0.0749","0.085","","","","","","1.027","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050962","23.236","0.003","17.497","0.004","19.446","0.003","90","","90.055","0.013","90","","7906","2","295","2","295","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C45 H39 Cl N3 O P2 Rh S -","- C45 H39 Cl N3 O P2 Rh S -","- C360 H312 Cl8 N24 O8 P16 Rh8 S8 -","8","2","","Dutta, Swati; Basuli, Falguni; Peng, Shie-Ming; Lee, Gene-Hsiang; Bhattacharya, Samaresh","Synthesis, structure and redox properties of some thiosemicarbazone complexes of rhodium","New Journal of Chemistry","2002","26","11","1607","","10.1039/b205338c","","","0.71073","MoKα","","0.0778","0.0429","","","0.0902","0.1012","","","","","","1.004","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050963","8.3715","0.0007","18.4","0.0012","12.2042","0.0009","90","","95.958","0.01","90","","1869.7","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H28 Cl N7 Ni O4 -","- C10 H28 Cl N7 Ni O4 -","- C40 H112 Cl4 N28 Ni4 O16 -","4","1","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia; Helen Stoeckli-Evans","Four new NiII antiferromagnetic complexes with azido bridges","New J. Chem.","2002","26","11","1601","1606","10.1039/b205404c","","","0.71073","MoKα","","0.0781","0.0381","","","0.0821","0.0915","","","","","","0.801","","","","has coordinates,has disorder","180063","2020-10-21","18:00:00",""
"7050964","6.385","0.021","8.841","0.036","9.102","0.007","116.77","0.22","91.86","0.19","109.07","0.27","424","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H24 F6 N7 Ni P -","- C8 H24 F6 N7 Ni P -","- C8 H24 F6 N7 Ni P -","1","0.5","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia; Helen Stoeckli-Evans","Four new NiII antiferromagnetic complexes with azido bridges","New J. Chem.","2002","26","11","1601","1606","10.1039/b205404c","","","0.71069","MoKα","","0.0647","0.0542","","0.1599","0.1262","","","","0.984","1.028","1.028","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050965","11.258","0.003","12.38","0.01","18.941","0.005","90","","103.43","0.02","90","","2568","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H32 F6 N7 Ni P -","- C15.61 H35 F3 N7 Ni P -","- C62.44 H140 F12 N28 Ni4 P4 -","4","1","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia; Helen Stoeckli-Evans","Four new NiII antiferromagnetic complexes with azido bridges","New J. Chem.","2002","26","11","1601","1606","10.1039/b205404c","","","0.71069","MoKα","","0.219","0.0611","","0.2485","0.1466","","","","1.006","1.137","1.137","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050966","10.401","0.002","9.286","0.003","17.429","0.002","90","","106.406","0.012","90","","1614.8","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H24 Cl N7 Ni O4 -","- C8 H24 Cl N7 Ni O4 -","- C32 H96 Cl4 N28 Ni4 O16 -","4","1","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia; Helen Stoeckli-Evans","Four new NiII antiferromagnetic complexes with azido bridges","New J. Chem.","2002","26","11","1601","1606","10.1039/b205404c","","","0.71069","MoKα","","0.1227","0.0538","","","0.1163","0.1386","","","","","","0.998","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050967","7.394","0.002","19.603","0.002","8.107","0.001","90","","94.56","0.01","90","","1171.3","0.4","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-cyclopentanedionate, 2,6-diaminopyridinium, hydrate","","- C10 H15 N3 O3 -","- C10 H15 N3 O3 -","- C40 H60 N12 O12 -","4","1","","Bertolasi, Valerio; Pretto, Loretta; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone","Hydrogen-bonded supramolecular structures in co-crystals of ??- or ??-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine","New Journal of Chemistry","2002","26","11","1559","","10.1039/b205705k","","","0.71073","MoKα","","0.0949","0.0481","","","0.1197","0.135","","","","","","1.03","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050968","27.78","0.005","6.912","0.001","13.005","0.004","90","","114.85","0.02","90","","2266","0.9","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-cyclopentanedionate, 2,6-diaminopyrimidinium, hydrate","","- C9 H14 N4 O3 -","- C9 H14 N4 O3 -","- C72 H112 N32 O24 -","8","1","","Bertolasi, Valerio; Pretto, Loretta; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone","Hydrogen-bonded supramolecular structures in co-crystals of ??- or ??-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine","New Journal of Chemistry","2002","26","11","1559","","10.1039/b205705k","","","0.71073","MoKα","","0.0681","0.0453","","","0.1217","0.1311","","","","","","1.06","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050969","8.642","0.002","10.132","0.002","10.721","0.005","91.37","0.03","92.95","0.02","106.66","0.02","897.4","0.5","296","","296","","","","","","","","","4","P -1","-P 1","2","","1,3-cyclohexanedionate, 2,6-diaminopyridinium, 1,3-cyclohexanedione enol, hydrate","","- C16 H24 N4 O5 -","- C16 H24 N4 O5 -","- C32 H48 N8 O10 -","2","1","","Bertolasi, Valerio; Pretto, Loretta; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone","Hydrogen-bonded supramolecular structures in co-crystals of ??- or ??-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine","New Journal of Chemistry","2002","26","11","1559","","10.1039/b205705k","","","0.71073","MoKα","","0.0854","0.054","","","0.1587","0.1731","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050970","17.474","0.002","5.27","0.002","22.478","0.003","90","","110.42","0.01","90","","1939.9","0.8","296","","296","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","5-Methyl-1,3-cyclohexanedionate, 2,6-diaminopyridinium, 5-methyl-1,3-cyclohexanedione enol","","- C19 H27 N3 O4 -","- C19 H27 N3 O4 -","- C76 H108 N12 O16 -","4","1","","Bertolasi, Valerio; Pretto, Loretta; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone","Hydrogen-bonded supramolecular structures in co-crystals of ??- or ??-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine","New Journal of Chemistry","2002","26","11","1559","","10.1039/b205705k","","","0.71073","MoKα","","0.1412","0.0622","","","0.145","0.1739","","","","","","1.011","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050971","10.376","0.003","17.697","0.002","14.647","0.003","90","","109.23","0.02","90","","2539.5","0.9","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 N6 O6 -","- C12 H15 N3 O3 -","- C96 H120 N24 O24 -","8","2","","V. Bertolasi; V. Ferretti; P. Gilli; Gastone Gilli; L. Pretto","Hydrogen-bonded supramolecular structurs in co-crystals of beta- or zeta-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine.","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050972","10.976","0.002","19.178","0.004","12.415","0.003","90","","90","","90","","2613.3","1","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C60 H40 Co4 N8 O18 -","- C60 H36 Co4 N8 O18 -","- C120 H72 Co8 N16 O36 -","2","0.25","","Li, Yangguang; Zhang, Hong; Wang, Enbo; Hao, Na; Hu, Changwen; Yan, Yu; Hall, Donavan","A novel chiral coordination polymer with a two-dimensional undulated (6,4)-network: [Co4(2,2???-bipy)4(H2O)2(btec)2]n (btec???=???1,2,4,5-benzenetetracarboxylate)Electronic supplementary information (ESI) available: packing diagram and XPS, IR and TG spectra of 1. See http://www.rsc.org/suppdata/nj/b2/b205718b/.","New Journal of Chemistry","2002","26","11","1619","","10.1039/b205718b","","","0.71073","MoKα","","0.0501","0.0472","","","0.1191","0.1207","","","","","","1.02","","","","has coordinates","288503","2023-12-22","13:36:34",""
"7050973","9.007","0.002","9.976","0.003","12.993","0.004","103.41","0.03","95.47","0.03","99.95","0.02","1107.3","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H32 Co O6 -","- C23 H32 Co O6 -","- C46 H64 Co2 O12 -","2","1","","Braga, Dario; Eckert, Matthieu; Fraccastoro, Matteo; Maini, Lucia; Grepioni, Fabrizia; Caneschi, Andrea; Sessoli, Roberta","The hydrogen oxalate anion allows one-dimensional columnar aggregation of organometallic sandwich cations","New Journal of Chemistry","2002","26","10","1280","","10.1039/b205782d","","","0.71073","MoKα","","0.0747","0.0473","","","0.1286","0.1442","","","","","","1.02","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050974","7.688","0.003","16.539","0.005","9.8","0.006","90","","96.75","0.04","90","","1237.5","1","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C24 H33 Fe O8 -","- C24 H31 Fe O8 -","- C48 H62 Fe2 O16 -","2","0.5","","Braga, Dario; Eckert, Matthieu; Fraccastoro, Matteo; Maini, Lucia; Grepioni, Fabrizia; Caneschi, Andrea; Sessoli, Roberta","The hydrogen oxalate anion allows one-dimensional columnar aggregation of organometallic sandwich cations","New Journal of Chemistry","2002","26","10","1280","","10.1039/b205782d","","","0.71073","MoKα","","0.1323","0.0512","","","0.1376","0.1737","","","","","","0.993","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050975","6.778","0.006","17.963","0.007","11.03","0.003","90","","99.35","0.04","90","","1325.1","1.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 Cr O5 -","- C14 H15 Cr O5 -","- C56 H60 Cr4 O20 -","4","1","","Braga, Dario; Eckert, Matthieu; Fraccastoro, Matteo; Maini, Lucia; Grepioni, Fabrizia; Caneschi, Andrea; Sessoli, Roberta","The hydrogen oxalate anion allows one-dimensional columnar aggregation of organometallic sandwich cations","New Journal of Chemistry","2002","26","10","1280","","10.1039/b205782d","","","0.71073","MoKα","","0.0868","0.0473","","","0.1203","0.1389","","","","","","1.049","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050976","6.978","0.006","17.143","0.008","11.24","0.006","90","","102.94","0.06","90","","1310.4","1.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 Co O7 -","- C13 H13 Co O7 -","- C52 H52 Co4 O28 -","4","1","","Braga, Dario; Eckert, Matthieu; Fraccastoro, Matteo; Maini, Lucia; Grepioni, Fabrizia; Caneschi, Andrea; Sessoli, Roberta","The hydrogen oxalate anion allows one-dimensional columnar aggregation of organometallic sandwich cations","New Journal of Chemistry","2002","26","10","1280","","10.1039/b205782d","","","0.71073","MoKα","","0.1369","0.0691","","","0.153","0.1804","","","","","","1.054","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050977","6.821","0.005","8.904","0.005","11.176","0.006","76.42","0.06","80.11","0.05","86.56","0.06","649.8","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H14 Cl Co O5 -","- C12 H13 Cl Co O5 -","- C24 H26 Cl2 Co2 O10 -","2","1","","Braga, Dario; Eckert, Matthieu; Fraccastoro, Matteo; Maini, Lucia; Grepioni, Fabrizia; Caneschi, Andrea; Sessoli, Roberta","The hydrogen oxalate anion allows one-dimensional columnar aggregation of organometallic sandwich cations","New Journal of Chemistry","2002","26","10","1280","","10.1039/b205782d","","","0.71073","MoKα","","0.0668","0.0468","","","0.1316","0.1449","","","","","","1.029","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050978","8.97","0.002","9.976","0.004","13.019","0.005","103.08","0.04","95.36","0.03","99.83","0.02","1107.5","0.7","253","2","253","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H32 Fe O6 -","- C23 H32 Fe O6 -","- C46 H64 Fe2 O12 -","2","1","","Braga, Dario; Eckert, Matthieu; Fraccastoro, Matteo; Maini, Lucia; Grepioni, Fabrizia; Caneschi, Andrea; Sessoli, Roberta","The hydrogen oxalate anion allows one-dimensional columnar aggregation of organometallic sandwich cations","New Journal of Chemistry","2002","26","10","1280","","10.1039/b205782d","","","0.71073","MoKα","","0.1236","0.0515","","","0.1298","0.1576","","","","","","1.011","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050979","10.5995","0.0011","13.3972","0.0014","17.435","0.0019","71.24","0.002","72.668","0.002","89.64","0.002","2226.9","0.4","218","2","218","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H58 Cl Ge Li N6 O2 -","- C46 H58 Cl Ge Li N6 O2 -","- C92 H116 Cl2 Ge2 Li2 N12 O4 -","2","1","","Olaf Kühl; Peter Lönnecke; Joachim Heinicke","Diaminocarbene homologues: synthesis and crystal structure of the first diaminogermylene LiCl adduct displaying an electrophilic germanium centre","New J. Chem.","2002","26","10","1304","1307","10.1039/b205902a","","","0.71073","MoKα","","0.1298","0.053","","","0.092","0.1123","","","","","","0.882","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050980","16.801","0.003","6.951","0.001","24.335","0.006","90","","90","","90","","2841.9","1","291.2","","291.2","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C13 H9 Cl2 Cu N3 O S -","- C13 H9 Cl2 Cu N3 O S -","- C104 H72 Cl16 Cu8 N24 O8 S8 -","8","1","","Li, Gang; Che, De-Ji; Li, Zi-Feng; Zhu, Yu; Zou, Da-Peng","Versatile coordination patterns in the reaction system of N-benzoyl-N???-(2-pyridyl)thiourea with CuCl2. Their reaction conditions, systematic isolation and crystal structures","New Journal of Chemistry","2002","26","11","1629","","10.1039/b206257g","","","0.7107","MoKα","","0.0834","0.0623","","0.112","0.0973","","","","1.277","1.217","1.217","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050981","10.761","0.003","36.62","0.01","7.511","0.009","90","","116.186","0.006","90","","2656","3","293.2","","293.2","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C26 H22 Cl Cu N6 O2 S2 -","- C26 H22 Cl Cu N6 O2 S2 -","- C104 H88 Cl4 Cu4 N24 O8 S8 -","4","1","","Li, Gang; Che, De-Ji; Li, Zi-Feng; Zhu, Yu; Zou, Da-Peng","Versatile coordination patterns in the reaction system of N-benzoyl-N???-(2-pyridyl)thiourea with CuCl2. Their reaction conditions, systematic isolation and crystal structures","New Journal of Chemistry","2002","26","11","1629","","10.1039/b206257g","","","0.7107","MoKα","","0.0559","","","0.0503","","","","","1.05","1.04","1.04","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050982","9.674","0.004","11.085","0.006","7.751","0.003","97.63","0.03","102.76","0.03","108.18","0.02","751.7","0.6","293.2","","293.2","","","","","","","","","7","P -1","-P 1","2","","","","- C13 H11 Cl2 Cu N3 O S -","- C13 H11 Cl2 Cu N3 O S -","- C26 H22 Cl4 Cu2 N6 O2 S2 -","2","1","","Li, Gang; Che, De-Ji; Li, Zi-Feng; Zhu, Yu; Zou, Da-Peng","Versatile coordination patterns in the reaction system of N-benzoyl-N???-(2-pyridyl)thiourea with CuCl2. Their reaction conditions, systematic isolation and crystal structures","New Journal of Chemistry","2002","26","11","1629","","10.1039/b206257g","","","0.7107","MoKα","","0.0739","0.0732","","0.0663","0.0661","","","","1.072","1.075","1.075","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050983","12.57","0.004","13.78","0.004","15.869","0.005","75.363","0.004","69.196","0.005","65.697","0.004","2323.4","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H28 O26 Yb4 -","- C48 H24 O26 Yb4 -","- C96 H48 O52 Yb8 -","2","1","","Wan, Yonghong; Jin, Linpei; Wang, Kezhi; Zhang, Liping; Zheng, Xiangjun; Lu, Shaozhe","Hydrothermal synthesis and structural studies of novel 2-D lanthanide coordination polymers with phthalic acid","New Journal of Chemistry","2002","26","11","1590","","10.1039/b206280c","","","0.71073","MoKα","","0.0477","0.0423","","","0.111","0.1158","","","","","","1.029","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050984","8.638","0.003","10.625","0.003","14.376","0.004","96.975","0.005","102.11","0.004","104.372","0.004","1228.5","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H14 La2 O13 -","- C24 H14 La2 O13 -","- C48 H28 La4 O26 -","2","1","","Wan, Yonghong; Jin, Linpei; Wang, Kezhi; Zhang, Liping; Zheng, Xiangjun; Lu, Shaozhe","Hydrothermal synthesis and structural studies of novel 2-D lanthanide coordination polymers with phthalic acid","New Journal of Chemistry","2002","26","11","1590","","10.1039/b206280c","","","0.71073","MoKα","","0.0384","0.0348","","","0.0921","0.097","","","","","","1.029","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050985","7.998","0.003","26.397","0.009","11.677","0.004","90","","107.226","0.004","90","","2354.7","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H14 Eu2 O13 -","- C24 H14 Eu2 O13 -","- C96 H56 Eu8 O52 -","4","1","","Wan, Yonghong; Jin, Linpei; Wang, Kezhi; Zhang, Liping; Zheng, Xiangjun; Lu, Shaozhe","Hydrothermal synthesis and structural studies of novel 2-D lanthanide coordination polymers with phthalic acid","New Journal of Chemistry","2002","26","11","1590","","10.1039/b206280c","","","0.71073","MoKα","","0.0337","0.03","","","0.0703","0.0721","","","","","","1.032","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050986","8.024","0.005","26.656","0.016","11.743","0.007","90","","107.018","0.009","90","","2402","3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H14 O13 Tb2 -","- C24 H14 O13 Tb2 -","- C96 H56 O52 Tb8 -","4","1","","Wan, Yonghong; Jin, Linpei; Wang, Kezhi; Zhang, Liping; Zheng, Xiangjun; Lu, Shaozhe","Hydrothermal synthesis and structural studies of novel 2-D lanthanide coordination polymers with phthalic acid","New Journal of Chemistry","2002","26","11","1590","","10.1039/b206280c","","","0.71073","MoKα","","0.1026","0.0865","","","0.166","0.174","","","","","","1.135","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050987","12.2764","0.0004","15.3093","0.0006","21.7463","0.0008","104.381","0.002","90.547","0.002","106.997","0.002","3771.2","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H36 Co2 O4 P2 -","- C43 H36 Co2 O4 P2 -","- C172 H144 Co8 O16 P8 -","4","2","","Mays, Martin J.; Golovko, Vladimir B.; Woods, Anthony D.","Double Dehydration of a Diyne Diol Promoted by a Single Co2(CO)6 Unit; Activation of an uncoordinated propargylic centre.","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050988","11.119","0.0003","13.79","0.0003","18.7716","0.0005","91.375","0.002","92.809","0.002","97.593","0.002","2848.25","0.12","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H14 Co4 O12 -","- C26 H14 Co4 O12 -","- C104 H56 Co16 O48 -","4","2","","Mays, Martin J.; Golovko, Vladimir B.; Woods, Anthony D.","Double Dehydration of a Diyne Diol Promoted by a Single Co2(CO)6 Unit; Activation of an uncoordinated propargylic centre.","New Journal of Chemistry","2002","","","","","","","","","","","","0.0442","","","0.0943","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050989","8.6002","0.0004","9.6688","0.0003","7.8745","0.0005","107.718","0.004","112.927","0.002","77.416","0.002","570.77","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H10 Co0.5 N7 S -","- C8 H10 Co0.5 N7 S -","- C16 H20 Co N14 S2 -","2","1","","Qihua Zhao; Haifang Li; Xiaofeng Wang; Zhida Chen","Synthesis and structure of a one-dimensional cobalt(II) coordination polymer with 1,3-bis(1,2,4-triazol-1-yl)propane","New Journal of Chemistry","2002","","","","","10.1039/b206315h","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050990","13.501","0.002","3.995","0.001","11.98","0.002","90","","90","","90","","646.2","0.2","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C4 N6 Pb -","- C4 N6 Pb -","- C16 N24 Pb4 -","4","0.5","","Shi, Yu-Jun; Chen, Xue-Tai; Li, Yi-Zhi; Xue, Ziling; You, Xiao-Zeng","Pb(dca)2 (dca???=???dicyanamide): a novel 3D compound with unusual coordination modes of dicyanamide","New Journal of Chemistry","2002","26","12","1711","","10.1039/b206332h","","","0.71073","MoKα","","0.0478","0.038","","","0.124","0.1366","","","","","","1.002","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050991","11.0102","0.0002","11.3676","0.0002","13.6847","0.0003","76.117","0.005","82.625","0.005","65.319","0.005","1510.07","0.05","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C74 H58 Cu N14 O6 -","- C74 H58 Cu0.5 N14 O6 -","- C74 H58 Cu0.5 N14 O6 -","1","0.5","","M. Hosseini; Veronique Bulach; Andre de Cian; Marie Hutin; Nathalie Kyritsakas; Bertrand Zimmer","A 3-D network based on porphyrin and copper : an interplay between coordination bonding, Pi-Pi interactions and H-bonding","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7050992","12.8117","0.0002","13.0953","0.0002","13.5473","0.0003","104.664","0.005","111.913","0.005","104.738","0.005","1879.54","0.06","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C73 H51 Cl15 N12 O4 -","- C73 H40 Cl15 N12 O4 -","- C73 H40 Cl15 N12 O4 -","1","0.5","","","","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7050993","9.9533","0.0002","13.2375","0.0004","13.3971","0.0003","88.813","0.005","69.005","0.005","88.363","0.004","1647.2","0.07","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C72 H66 Cu N12 O11 -","- C72 H44 Cu0.5 N12 O11 -","- C72 H44 Cu0.5 N12 O11 -","1","0.5","","","","New Journal of Chemistry","2002","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7050994","12.1292","0.0013","12.2378","0.0013","16.3811","0.0018","90","","90","","90","","2431.5","0.5","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 Cl5 Cr N3 O2 -","- C18 H25 Cl5 Cr N3 O2 -","- C72 H100 Cl20 Cr4 N12 O8 -","4","1","","Miguel A. Esteruelas; Ana M. López; Luis Méndez; Montserrat Oliván; Enrique Oñate","Synthesis, X-ray structure, and polymerisation activity of a bis(oxazolinyl)pyridine chromium(III) complex","New J. Chem.","2002","26","11","1542","1544","10.1039/b207093f","","","0.71073","MoKα","","0.0722","0.0554","","","0.1233","0.1294","","","","","","0.956","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050995","11.806","0.001","13.508","0.001","8.426","0.002","90","","97.15","0.01","90","","1333.3","0.4","180","2","180","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","hexafluorobenzene : naphthalene","","- C16 H8 F6 -","- C16 H8 F6 -","- C64 H32 F24 -","4","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Robins, Edward G.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Clark, Stewart J.; Marder, Todd B.","Arene‒perfluoroarene interactions in crystal engineering 8: structures of 1:1 complexes of hexafluorobenzene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2002","26","12","1740","1746","10.1039/B207102A","","","0.71073","MoKα","","0.0748","0.0496","","","0.1084","0.1209","","","","","","1.061","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050996","16.122","0.003","12.086","0.002","8.955","0.002","90","","118.39","0.03","90","","1535","0.7","150","2","150","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","hexafluorobenzene : anthracene","","- C20 H10 F6 -","- C20 H10 F6 -","- C80 H40 F24 -","4","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Robins, Edward G.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Clark, Stewart J.; Marder, Todd B.","Arene‒perfluoroarene interactions in crystal engineering 8: structures of 1:1 complexes of hexafluorobenzene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2002","26","12","1740","1746","10.1039/B207102A","","","1.54178","CuKα","","0.0575","0.0501","","0.1551","0.1437","","","","1.049","1.076","1.076","","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050997","6.929","0.002","7.308","0.001","15.991","0.003","91.51","0.01","102.16","0.01","100.16","0.01","777.5","0.3","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","hexafluorobenzene : phenanthrene complex (1:1)","","- C20 H10 F6 -","- C20 H10 F6 -","- C40 H20 F12 -","2","1","","Collings, Jonathan C.; Roscoe, Karl P.; Robins, Edward G.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Clark, Stewart J.; Marder, Todd B.","Arene‒perfluoroarene interactions in crystal engineering 8: structures of 1:1 complexes of hexafluorobenzene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2002","26","12","1740","1746","10.1039/B207102A","","","0.71073","MoKα","","0.059","0.0427","","","0.1197","0.1316","","","","","","1.035","","","","has coordinates,has disorder","180063","2020-10-21","18:00:00",""
"7050998","6.9467","0.0014","13.331","0.003","9.301","0.0019","90","","106.67","0.03","90","","825.1","0.3","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","hexafluorobenzene : pyrene","","- C22 H10 F6 -","- C22 H10 F6 -","- C44 H20 F12 -","2","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Robins, Edward G.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Clark, Stewart J.; Marder, Todd B.","Arene‒perfluoroarene interactions in crystal engineering 8: structures of 1:1 complexes of hexafluorobenzene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2002","26","12","1740","1746","10.1039/B207102A","","","0.71073","MoKα","","0.0736","0.0441","","","0.1096","0.1249","","","","","","1.018","","","","has coordinates","180063","2020-10-21","18:00:00",""
"7050999","13.935","0.002","7.211","0.002","17.37","0.008","90","","92.55","0.01","90","","1743.7","1","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","hexafluorobenzene : triphenylene","","- C24 H12 F6 -","- C24 H12 F6 -","- C96 H48 F24 -","4","1","","Collings, Jonathan C.; Roscoe, Karl P.; Robins, Edward G.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Clark, Stewart J.; Marder, Todd B.","Arene‒perfluoroarene interactions in crystal engineering 8: structures of 1:1 complexes of hexafluorobenzene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2002","26","12","1740","1746","10.1039/B207102A","","","0.71073","MoKα","","0.1674","0.1019","","","0.2446","0.285","","","","","","1.128","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051000","9.764","0.002","10.273","0.002","17.099","0.003","90","","95.55","0.03","90","","1707.1","0.6","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 N O2 -","- C22 H17 N O2 -","- C88 H68 N4 O8 -","4","1","","Jacek Gawronski; Marcin Kwit; Urszula Rychlewska","Induced Homohelicity of Diphenimide Bis-propellers","New Journal of Chemistry","2002","","","","","10.1039/b207375g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051001","9.907","0.002","12.579","0.003","21.288","0.004","90","","98.9","0.03","90","","2621","1","295","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C34 H26 N2 O4 -","- C34 H26 N2 O4 -","- C136 H104 N8 O16 -","4","2","","Jacek Gawronski; Marcin Kwit; Urszula Rychlewska","Induced Homohelicity of Diphenimide Bis-propellers","New Journal of Chemistry","2002","","","","","10.1039/b207375g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051002","9.855","0.002","12.28","0.002","20.602","0.004","90","","97.97","0.03","90","","2469.2","0.8","295","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H20 N2 O4 -","- C34 H20 N2 O4 -","- C136 H80 N8 O16 -","4","1","","Jacek Gawronski; Marcin Kwit; Urszula Rychlewska","Induced Homohelicity of Diphenimide Bis-propellers","New Journal of Chemistry","2002","","","","","10.1039/b207375g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051003","17.325","0.003","8.587","0.002","14.868","0.003","90","","106.36","0.03","90","","2122.4","0.8","295","2","295","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H18 N2 O4 -","- C29 H18 N2 O4 -","- C116 H72 N8 O16 -","4","0.5","","Jacek Gawronski; Marcin Kwit; Urszula Rychlewska","Induced Homohelicity of Diphenimide Bis-propellers","New Journal of Chemistry","2002","","","","","10.1039/b207375g","","","","","","","","","","","","","","","","","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051004","17.797","0.012","10.521","0.004","23.33","0.012","90","","106.53","0.05","90","","4188","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Ethyl 1-[(diethoxyphosphoryl)sulfanyl]-5- phenyl-2-oxocyclohexanecarboxylate","","","- C19 H27 O6 P S -","- C19 H27 O6 P S -","- C152 H216 O48 P8 S8 -","8","1","","Ewa Krawczyk; Krzysztof Owsianik; Aleksandra Skowrońska; Michał Wieczorek; Wiesław Majzner","An expedient, stereoselective synthesis of highly functionalized cyclic compounds","New J. Chem.","2002","26","12","1753","1767","10.1039/b207700k","","","1.54178","CuKα","","0.0618","0.0484","","0.171","","0.1358","","","1.093","","","1.099","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051005","6.075","0.002","19.042","0.005","20.889","0.008","90","","90","","90","","2416.4","1.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ethyl 1-[(dineopentoxyphosphoryl)sulfanyl]-3- methyl-2-oxocyclohexanecarboxylate","","","- C20 H37 O6 P S -","- C20 H37 O6 P S -","- C80 H148 O24 P4 S4 -","4","1","","Ewa Krawczyk; Krzysztof Owsianik; Aleksandra Skowrońska; Michał Wieczorek; Wiesław Majzner","An expedient, stereoselective synthesis of highly functionalized cyclic compounds","New J. Chem.","2002","26","12","1753","1767","10.1039/b207700k","","","1.54178","CuKα","","0.0924","0.0503","","0.1368","","0.1136","","","1.042","","","1.107","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051006","13.705","0.003","11.378","0.002","15.252","0.003","90","","103.02","0.03","90","","2317.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","sulphoxide","Ethyl 2-[(diethoxyphosphoryl)oxy]-5-phenyl-1- (methylsylfinyl)cyclohexanecarboxylate","","- C20 H31 O7 P S -","- C20 H31 O7 P S -","- C80 H124 O28 P4 S4 -","4","1","","Ewa Krawczyk; Krzysztof Owsianik; Aleksandra Skowrońska; Michał Wieczorek; Wiesław Majzner","An expedient, stereoselective synthesis of highly functionalized cyclic compounds","New J. Chem.","2002","26","12","1753","1767","10.1039/b207700k","","","1.54178","CuKα","","0.0635","0.057","","0.1734","","0.1641","","","1.044","","","1.073","","","","has coordinates","287888","2023-11-30","13:37:23",""
"7051007","15.006","0.0001","17.611","0.0002","17.9379","0.0002","84.1973","0.0003","65.6599","0.0004","82.3658","0.0005","4275.18","0.08","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Chloro-tris[5-tertbutylpyrazole]zinc(II) bis[nido-undecahydro-7,8-dicarbanonaborato]cobalt(III)","","- C25 H58 B18 Cl Co N6 Zn -","- C25 H58 B18 Cl Co N6 Zn -","- C100 H232 B72 Cl4 Co4 N24 Zn4 -","4","2","","Renard, Sylvie L.; Franken, Andreas; Kilner, Colin A.; Kennedy, John D.; Halcrow, Malcolm A.","Carbaborane salts of [ZnCl(HpztBu)3]+, a host for inorganic anions (HpztBu???=???5-tert-butylpyrazole)","New Journal of Chemistry","2002","26","11","1634","","10.1039/b207966f","","","0.71073","MoKα","","0.0532","0.0365","","","0.0947","0.104","","","","","","1.022","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051008","10.8007","0.0001","15.4087","0.0001","24.7967","0.0003","100.366","0.0004","97.0776","0.0004","100.92","0.0006","3932.71","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","[Chloro-tris(5-tertbutylpyrazole)zinc(II)][1-phenyl-nonahydro-closo-1- carbanonaborate] pentane solvate","","- C29 H52.4 B9 Cl N6 Zn -","- C29 H52.4 B9 Cl N6 Zn -","- C116 H209.6 B36 Cl4 N24 Zn4 -","4","2","","Renard, Sylvie L.; Franken, Andreas; Kilner, Colin A.; Kennedy, John D.; Halcrow, Malcolm A.","Carbaborane salts of [ZnCl(HpztBu)3]+, a host for inorganic anions (HpztBu???=???5-tert-butylpyrazole)","New Journal of Chemistry","2002","26","11","1634","","10.1039/b207966f","","","0.71073","MoKα","","0.0643","0.0443","","","0.1165","0.1279","","","","","","1.03","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051009","24.011","0.0002","12.3005","0.0001","27.2856","0.0003","90","","90","","90","","8058.73","0.13","150","2","150","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","[Chloro-tris(5-tertbutylpyrazole)zinc(II)] [6,7,8,9,10-pentabromo-pentahydro-closo-1-carbanonaborate] hydrate","","- C22 H43 B9 Br5 Cl N6 O Zn -","- C22 H43 B9 Br5 Cl N6 O Zn -","- C176 H344 B72 Br40 Cl8 N48 O8 Zn8 -","8","1","","Renard, Sylvie L.; Franken, Andreas; Kilner, Colin A.; Kennedy, John D.; Halcrow, Malcolm A.","Carbaborane salts of [ZnCl(HpztBu)3]+, a host for inorganic anions (HpztBu???=???5-tert-butylpyrazole)","New Journal of Chemistry","2002","26","11","1634","","10.1039/b207966f","","","0.71073","MoKα","","0.0505","0.0321","","","0.0708","0.0781","","","","","","1.019","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051010","14.5841","0.0012","18.0586","0.0012","22.677","0.002","69.951","0.006","77.476","0.006","89.341","0.007","5464.1","0.8","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C140 H107 Cl2 N5 O6 -","- C135 H99 N3 O6 -","- C270 H198 N6 O12 -","2","1","","Colquhoun, Howard M.; Arico, Fabio; Williams, David J.","Non-covalent dimerisation of a bicyclic aromatic oligomer via loop???loop interlocking in the solid state","New Journal of Chemistry","2002","26","12","1703","","10.1039/b208002h","","","1.54178","CuKα","","0.0747","0.0557","","0.1648","0.1522","","","","1.068","1.149","1.149","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051011","13.152","0.002","18.72","0.003","20.918","0.003","90","","99.4","0.02","90","","5081","1.4","120","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44.5 H27 B4 Cl3 F24 O Ta -","- C44.5 H27 B Cl3 F24 O Ta -","- C178 H108 B4 Cl12 F96 O4 Ta4 -","4","1","","Sabo-Etienne, Sylviane; Rodriguez, Venancio; Donnadieu, Bruno; Chaudret, Bruno; Abou el Makarim, Hassna; Barthelat, Jean-Claude; Ulrich, Stefan; Limbach, Hans-Heinrich; Moïse, Claude","Synthesis, X-ray crystal structure, NMR characterization and theoretical calculations on [Cp2Ta(η2-H2)(CO)]+, the first thermally stable group 5 dihydrogen complex","New Journal of Chemistry","2001","25","1","55","","10.1039/b002073g","","","0.71073","MoK(","","","0.0512","","","0.0623","","","","","0.9868","0.9868","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051012","10.844","0.002","20.697","0.004","22.722","0.005","91.629","0.013","91.462","0.013","101.89","0.012","4985.7","1.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Bis-(Methyltropp)rhodium-hexafluorophosphate","","","- C58 H49 F6 N P3 Rh -","- C58 H49 F6 N P3 Rh -","- C232 H196 F24 N4 P12 Rh4 -","4","2","","Deblon, Stephan; Rüegger, Heinz; Schönberg, Hartmut; Loss, Sandra; Gramlich, Volker; Grützmacher, Hansjörg","Highly distorted d8-rhodium(+I) and d10-rhodium(-I) complexes: synthesis, reactivity, and structures in solution and solid state","New Journal of Chemistry","2001","25","1","83","","10.1039/b002906h","","","0.71073","MoKα","","0.0706","0.0361","","0.0769","0.0721","","","","0.751","0.964","0.964","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051013","45.899","0.051","10.159","0.01","19.773","0.019","90","","102.27","0.08","90","","9009","16","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Allyltropp-methyltropp-rhodium","","","- C56.5 H45.5 Cl1.5 P2 Rh -","- C56.5 H45.5 Cl1.5 P2 Rh -","- C452 H364 Cl12 P16 Rh8 -","8","1","","Deblon, Stephan; Rüegger, Heinz; Schönberg, Hartmut; Loss, Sandra; Gramlich, Volker; Grützmacher, Hansjörg","Highly distorted d8-rhodium(+I) and d10-rhodium(-I) complexes: synthesis, reactivity, and structures in solution and solid state","New Journal of Chemistry","2001","25","1","83","","10.1039/b002906h","","","1.54178","CuKα","","0.0605","0.0455","","0.1218","0.1132","","","","1.073","1.122","1.122","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051014","17.293","0.002","9.7528","0.0013","17.6784","0.0006","90","","115.284","0.0009","90","","2695.9","0.5","180.2","","180.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 N2 O2 P2 Pd -","- C32 H30 N2 O2 P2 Pd -","- C128 H120 N8 O8 P8 Pd4 -","4","1","","Pierre Braunstein; Frédéric Naud; Steven J. Rettig","A new class of anionic phosphinooxazoline ligands in palladium and ruthenium complexes: catalytic properties for the transfer hydrogenation of acetophenone","New J. Chem.","2001","25","1","32","39","10.1039/b004786o","","","0.7107","MoKα","","0.0773","0.0773","","0.0675","","0.0675","","","1.365","","","1.365","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051015","9.743","0.002","13.474","0.007","18.902","0.011","90","","107.08","0.03","90","","2372","2","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","choline tetraphenylborate","","- C29 H34 B N O -","- C29 H34 B N O -","- C116 H136 B4 N4 O4 -","4","1","","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Making very short O‒H···Ph hydrogen bonds: the example of tetraphenylborate salts","New Journal of Chemistry","2001","25","1","174","","10.1039/b004932h","","","0.71073","MoKα","","0.1526","0.0871","","","0.1811","0.2231","","","","","","1.144","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051016","11.2759","0.0006","11.6163","0.0004","13.0526","0.0006","69.066","0.003","70.612","0.002","61.747","0.003","1378.77","0.12","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","triethanolammonium tetraphenylborate dihydrate","","- C30 H40 B N O5 -","- C30 H40 B N O5 -","- C60 H80 B2 N2 O10 -","2","1","","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Making very short O‒H···Ph hydrogen bonds: the example of tetraphenylborate salts","New Journal of Chemistry","2001","25","1","174","","10.1039/b004932h","","","0.71073","MoKα","","0.0692","0.0509","","","0.1121","0.1246","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051017","33.832","0.016","10.11","0.02","17.45","0.04","90","","117.75","0.005","90","","5282","16","125","2","125","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6-ammonium-n-hexanoic acid tetraphenylborate monohydrate","","- C30 H36 B N O3 -","- C30 H36 B N O3 -","- C240 H288 B8 N8 O24 -","8","1","","Steiner, Thomas; Schreurs, Antoine M. M.; Lutz, Martin; Kroon, Jan","Making very short O‒H···Ph hydrogen bonds: the example of tetraphenylborate salts","New Journal of Chemistry","2001","25","1","174","","10.1039/b004932h","","","0.71073","MoKα","","0.0812","0.0553","","","0.125","0.1408","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051018","7.455","0.003","10.0294","0.0013","10.568","0.005","90","","109.2","0.02","90","","746.2","0.5","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","ferroceneylaspartic acid","","","- C15 H15.668 Fe N O5.334 -","- C15 H15 Fe N O5.334 -","- C30 H30 Fe2 N2 O10.668 -","2","1","","Baker, Murray V.; Kraatz, Heinz-Bernhard; Wilson Quail, J.","Solvent effects on the redox properties of ferrocenoyl-dipeptides","New Journal of Chemistry","2001","25","3","427","","10.1039/b005125j","","","0.71069","MoKα","","0.0296","0.0216","","","0.0544","0.0565","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051019","8.892","0.001","8.892","0.001","8.892","0.001","65.63","0.017","65.63","0.017","65.63","0.017","557.92","0.15","293","2","293","2","","","","","","","","6","R -3 :R","-P 3*","148","K[Re6Se5Cl9](H2O)2","potassium penta-μ~eq~3-seleno-tri-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III) dihydrate","","- Cl9 H4 K O2 Re6 Se5 -","- Cl8.9 K O2 Re6 Se5.078 -","- Cl8.9 K O2 Re6 Se5.078 -","1","0.166667","","Santiago Uriel; Kamal Boubekeur; Patrick Batail; Jesus Orduna; André Perrin","Inertness of the [Re6Se5Cl3]5+ cluster core to substitution by OH− in organic solutions: synthesis, structural and liquid secondary ion mass spectroscopy characterization of K(H2O)2[Re6Se5Cl9] and (n-Bu4N)[Re6Se5Cl9] and the crystal structure of (n-Bu4N)2[Re6Se6Cl8]","New J. Chem.","2001","25","5","737","740","10.1039/b005231k","","","0.71073","MoKα","","0.0577","0.0401","","","0.0489","0.0558","","","","","","0.872","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051020","10.775","0.002","17.101","0.003","10.602","0.002","100.83","0.03","99.62","0.03","87.51","0.03","1891.6","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(nBu4N)[Re6Se5Cl9]","tetra-n-butylammonium penta-μ~eq~3-seleno-tri-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III)","","- C16 H36 Cl9 N Re6 Se5 -","- C16 H36 Cl9.05 N Re6 Se4.95 -","- C32 H72 Cl18.1 N2 Re12 Se9.9 -","2","1","","Santiago Uriel; Kamal Boubekeur; Patrick Batail; Jesus Orduna; André Perrin","Inertness of the [Re6Se5Cl3]5+ cluster core to substitution by OH− in organic solutions: synthesis, structural and liquid secondary ion mass spectroscopy characterization of K(H2O)2[Re6Se5Cl9] and (n-Bu4N)[Re6Se5Cl9] and the crystal structure of (n-Bu4N)2[Re6Se6Cl8]","New J. Chem.","2001","25","5","737","740","10.1039/b005231k","","","0.71073","MoKα","","0.1","0.0345","","0.1545","","0.1295","","","1.188","","","1.311","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051021","12.833","0.003","11.588","0.002","18.563","0.004","90","","90.04","0.03","90","","2760.5","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(nBu4N)2[Re6Se6Cl8]","bis-tetra-n-butylammonium hexa-μ~eq~3-seleno-di-μ~eq~3-chloro- hexachloro-octahedro-hexarhenate(III)","","- C32 H72 Cl8 N2 Re6 Se6 -","- C32 H72 Cl8.14 N2 Re6 Se5.848 -","- C64 H144 Cl16.28 N4 Re12 Se11.696 -","2","0.5","","Santiago Uriel; Kamal Boubekeur; Patrick Batail; Jesus Orduna; André Perrin","Inertness of the [Re6Se5Cl3]5+ cluster core to substitution by OH− in organic solutions: synthesis, structural and liquid secondary ion mass spectroscopy characterization of K(H2O)2[Re6Se5Cl9] and (n-Bu4N)[Re6Se5Cl9] and the crystal structure of (n-Bu4N)2[Re6Se6Cl8]","New J. Chem.","2001","25","5","737","740","10.1039/b005231k","","","0.71073","MoKα","","0.1272","0.0539","","","0.1588","0.1885","","","","","","1.201","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051022","8.4308","0.0004","10.5457","0.0005","15.6538","0.0008","90","","90","","90","","1391.76","0.12","200","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O6 -","- C13 H20 O6 -","- C52 H80 O24 -","4","1","","Banwell, Martin G.; Bray, Andrew M.; Edwards, Alison J.; Wong, David J.","Chemoenzymatic synthesis of the epimeric 6C-methyl-D-mannoses from toluene","New Journal of Chemistry","2001","25","1","3","","10.1039/b005312k","","","0.71073","MoKα","","","0.049","","","","0.0224","","","","","","0.9997","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051023","6.9393","0.0005","10.5584","0.0008","19.7333","0.0008","90","","90","","90","","1445.82","0.16","200","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H22 O6 -","- C13 H22 O6 -","- C52 H88 O24 -","4","1","","Banwell, Martin G.; Bray, Andrew M.; Edwards, Alison J.; Wong, David J.","Chemoenzymatic synthesis of the epimeric 6C-methyl-D-mannoses from toluene","New Journal of Chemistry","2001","25","1","3","","10.1039/b005312k","","","0.71073","MoKα","","","0.0397","","","","0.0463","","","","","","0.9641","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051024","6.5102","0.0002","8.9104","0.0004","23.7859","0.0009","90","","90","","90","","1379.78","0.09","200","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O6 -","- C13 H20 O6 -","- C52 H80 O24 -","4","1","","Banwell, Martin G.; Bray, Andrew M.; Edwards, Alison J.; Wong, David J.","Chemoenzymatic synthesis of the epimeric 6C-methyl-D-mannoses from toluene","New Journal of Chemistry","2001","25","1","3","","10.1039/b005312k","","","0.71073","MoKα","","","0.0307","","","","0.0204","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051025","9.612","0.009","15.884","0.015","15.884","0.015","105.35","0.02","92.65","0.03","92.65","0.03","2332","4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H46 N8 O4 Zn -","- C47.5 H36 N8 O4 Zn -","- C95 H72 N16 O8 Zn2 -","2","1","","Che, Chi-Ming; Wan, Chun-Wai; Ho, Kin-Ying; Zhou, Zhong-Yun","Strongly luminescent metal‒organic compounds: spectroscopic properties and crystal structure of substituted 1,8-naphthyridine and its zinc(II) complex","New Journal of Chemistry","2001","25","1","63","","10.1039/b005644h","","","0.71073","MoKα","","0.3155","0.0851","","","0.2129","0.3072","","","","","","0.818","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051026","6.632","0.002","19.859","0.002","34.049","0.004","90","","90","","90","","4484.4","1.5","293","2","293","2","","","","","","","","4","P b c 21","P 2c -2b","29","","4-phenil-4-(N-ciclohexyl)imidoyl-6-(4-methylphenyl)- 2-methoxi-3,4-dihydropyridin","","- C26 H30 N2 O -","- C26 H30 N2 O -","- C208 H240 N16 O8 -","8","2","","José Barluenga; Miguel Tomás; Alfredo Ballesteros; Javier Santamaría; Raúl Corzo-Suárez; Santiago García-Granda","Reaction of Fischer alkynylcarbene complexes with 1-azadiene derivatives: unexpected formation of 3,4-dihydropyridines","New J. Chem.","2001","25","1","8","10","10.1039/b005648k","","","0.71073","MoKα","","0.245","0.0591","","","0.1485","0.2829","","","1.029","","","1.306","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051027","6.486","0.004","12.445","0.001","18.327","0.002","90","","90","","90","","1479.3","0.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4S)-4-Benzyl-3-(4,5-dimethyl-3-pyrazolyl)-1,3-oxazolidin-2-one","","- C15 H17 N3 O2 -","- C15 H17 N3 O2 -","- C60 H68 N12 O8 -","4","1","","Marcial Moreno-Mañas; Rosa M. Sebastián; Adelina Vallribera; Juan F. Piniella; Angel Álvarez-Larena; María Luisa Jimeno; José Elguero","Structure of chiral pyrazoles in the solid state and in solution","New J. Chem.","2001","25","2","329","335","10.1039/b005920j","","","0.71069","MoKα","","0.0479","0.0414","","","0.111","0.113","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051028","6.601","0.009","14.743","0.004","18.895","0.009","90","","90","","90","","1839","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4S)-4-Benzyl-3-(4-benzyl-5-methyl-3-pyrazolyl)-1,3-oxazolidin-2-one","","- C21 H21 N3 O2 -","- C21 H21 N3 O2 -","- C84 H84 N12 O8 -","4","1","","Marcial Moreno-Mañas; Rosa M. Sebastián; Adelina Vallribera; Juan F. Piniella; Angel Álvarez-Larena; María Luisa Jimeno; José Elguero","Structure of chiral pyrazoles in the solid state and in solution","New J. Chem.","2001","25","2","329","335","10.1039/b005920j","","","0.71069","MoKα","","0.08","0.0463","","","0.0984","0.1022","","","","","","0.886","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051029","9.309","0.002","12.306","0.004","13.322","0.003","90","","104.8","0.02","90","","1475.5","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(2R)-N-(5-methyl-3-pyrazolyl)bornane-10,2-sultam","","- C14 H21 N3 O2 S -","- C14 H21 N3 O2 S -","- C56 H84 N12 O8 S4 -","4","2","","Marcial Moreno-Mañas; Rosa M. Sebastián; Adelina Vallribera; Juan F. Piniella; Angel Álvarez-Larena; María Luisa Jimeno; José Elguero","Structure of chiral pyrazoles in the solid state and in solution","New J. Chem.","2001","25","2","329","335","10.1039/b005920j","","","0.71069","MoKα","","0.033","0.0301","","","0.0816","0.0823","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051030","16.795","0.003","12.09","0.003","17.268","0.002","90","","116.549","0.012","90","","3136.6","1.1","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H29 Cl4 N O3 P Pd -","- C30 H29 Cl4 N O3 P Pd -","- C120 H116 Cl16 N4 O12 P4 Pd4 -","4","1","","Carlos Cativiela; Larry R. Falvello; Juan Carlos Ginés; Rafael Navarro; Esteban P. Urriolabeitia","Synthesis, structure and reactivity of PdII complexes with the terdentate imino alcohol ligand C6H3-3,4-(OMe)2‒C(H)NCH2CH2OH","New J. Chem.","2001","25","2","344","352","10.1039/b006140i","","","0.71073","MoKα","","0.0448","0.034","","","0.0826","0.0864","","","","","","1.032","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051031","23.732","0.002","8.039","0.002","14.922","0.002","90","","90","","90","","2846.8","0.8","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C29 H29 Cl N O7 P Pd -","- C29 H29 Cl N O7 P Pd -","- C116 H116 Cl4 N4 O28 P4 Pd4 -","4","1","","Carlos Cativiela; Larry R. Falvello; Juan Carlos Ginés; Rafael Navarro; Esteban P. Urriolabeitia","Synthesis, structure and reactivity of PdII complexes with the terdentate imino alcohol ligand C6H3-3,4-(OMe)2‒C(H)NCH2CH2OH","New J. Chem.","2001","25","2","344","352","10.1039/b006140i","","","0.71073","MoKα","","0.0927","0.0506","","","0.1054","0.117","","","","","","0.963","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051032","16.504","0.007","7.561","0.005","12.142","0.003","90","","92.54","0.02","90","","1513.7","1.2","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H26 Cl O3 P -","- C13 H26 Cl O3 P -","- C52 H104 Cl4 O12 P4 -","4","1","","Berrigan, Rebecca A.; Russell, Douglas K.; Henderson, William; Leach, Meto T.; Nicholson, Brian K.; Woodward, Gary; Harris, Christopher","Camphene-derived primary and hydroxymethyl phosphines","New Journal of Chemistry","2001","25","2","322","","10.1039/b006252i","","","0.71073","MoKα","","0.0927","0.0467","","0.11","0.0936","","","","1.023","1.104","1.104","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051033","11.344","0.01","12.614","0.016","9.846","0.013","112.43","0.1","96.62","0.1","98.5","0.09","1265","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","nickelbis(triethylphosphine)(eta2‒1,2-octafluoronaphthalene)","","- C22 H30 F8 Ni P2 -","- C22 H30 F8 Ni P2 -","- C44 H60 F16 Ni2 P4 -","2","1","","Braun, Thomas; Cronin, Leroy; Higgitt, Catherine L.; McGrady, John E.; Perutz, Robin N.; Reinhold, Meike","Coordination and oxidative addition of octafluoronaphthalene at a nickel centre: isolation of an intermediate in C‒F bond activation","New Journal of Chemistry","2001","25","1","19","","10.1039/b006368l","","","0.71069","MoKα","","0.0857","0.0442","","0.1334","","0.1114","","","1.014","","","1.04","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051034","12.8812","0.0011","13.0279","0.0012","14.2552","0.0009","78.667","0.007","86.219","0.006","60.753","0.009","2045.3","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H55 Cl2 Cu3 Fe N15 O13 -","- C21 H52 Cl2 Cu3 Fe N15 O13 -","- C42 H104 Cl4 Cu6 Fe2 N30 O26 -","2","1","","","""Synthesis, structure and magnetic behaviour of a two-dimensional cyano-bridged complex [(Cu(ept))_3Fe(CN)_6](ClO_4)_2·5H_2O (ept = N-(2-aminoethy","New Journal of Chemistry","2001","","","","","10.1039/b006741p","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051035","20.712","0.004","14.805","0.003","21.362","0.004","90","","111.5","0.03","90","","6095","2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H94 N4 O11 W2 -","- C56 H84 N4 O11 W2 -","- C224 H336 N16 O44 W8 -","4","1","","Wong, Yee-Lok; Yang, Qingchuan; Zhou, Zhong-Yuan; Kay Lee, Hung; Mak, Thomas C. W.; Ng, Dennis K. P.","Synthesis, structure and oxo-transfer properties of dioxotungsten(VI) complexes with pyridine-based NO-and NS-bidentate ligands","New Journal of Chemistry","2001","25","2","353","","10.1039/b006979p","","","0.71073","MoKα","","0.0536","0.0468","","","0.1264","0.1336","","","","","","0.894","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051036","13.467","0.003","24.756","0.005","11.723","0.002","90","","100.04","0.03","90","","3848.5","1.4","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 N4 O6 W -","- C42 H28 N4 O6 W -","- C168 H112 N16 O24 W4 -","4","1","","Wong, Yee-Lok; Yang, Qingchuan; Zhou, Zhong-Yuan; Kay Lee, Hung; Mak, Thomas C. W.; Ng, Dennis K. P.","Synthesis, structure and oxo-transfer properties of dioxotungsten(VI) complexes with pyridine-based NO-and NS-bidentate ligands","New Journal of Chemistry","2001","25","2","353","","10.1039/b006979p","","","0.71073","MoKα","","0.0777","0.0531","","0.1639","0.1487","","","","1.058","1.056","1.056","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051037","17.66","0.003","16.118","0.001","19.974","0.003","90","","106.76","0.003","90","","5444","1.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C53.5 H63.5 N2.5 O4.5 W -","- C53.5 H63.5 N2.5 O4.5 W -","- C214 H254 N10 O18 W4 -","4","1","","Wong, Yee-Lok; Yang, Qingchuan; Zhou, Zhong-Yuan; Kay Lee, Hung; Mak, Thomas C. W.; Ng, Dennis K. P.","Synthesis, structure and oxo-transfer properties of dioxotungsten(VI) complexes with pyridine-based NO-and NS-bidentate ligands","New Journal of Chemistry","2001","25","2","353","","10.1039/b006979p","","","0.71073","MoKα","","0.1285","0.0845","","","0.1741","0.1951","","","","","","1.17","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051038","24.684","0.004","15.202","0.002","25.368","0.004","90","","97.78","0.003","90","","9432","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H68 Fe N18 Ni2 O8 -","- C30 H44 Fe N18 Ni2 O8 -","- C240 H352 Fe8 N144 Ni16 O64 -","8","1","","Lu, Tongbu; Xiang, Hua; Su, Chengyong; Cheng, Peng; Mao, Zongwan; Ji, Liangnian","[NiL]2[Fe(CN)6]·4H2O [L = 3,10-bis(2-hydroxyethyl)-1,3,5,8,10,12-hexaazacyclotetradecane]: a novel three-dimensional iron(II)‒nickel(II) cyanide-bridged bimetallic assembly with a vat-like structure","New Journal of Chemistry","2001","25","2","216","","10.1039/b007406n","","","0.71073","MoKα","","0.1235","0.0789","","","0.1783","0.2047","","","","","","1.035","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051039","39.72","0.04","10.198","0.013","24.59","0.03","90","","123.777","0.01","90","","8279","17","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C45 H40 Cl Cu N2 O4 P2 -","- C45 H40 Cl Cu N2 O4 P2 -","- C360 H320 Cl8 Cu8 N16 O32 P16 -","8","1","","Hati, Sanchita; Patra, Goutam K.; Naskar, Jnan P.; Drew, Michael G. B.; Datta, Dipankar","First structurally characterised metal complex of a 2H-benzimidazole derivative. Copper mediated synthesis of 2,2-dimethyl-2H-benzimidazole from 1,2-phenylenediamine and acetone","New Journal of Chemistry","2001","25","2","218","","10.1039/b007410l","","","0.71073","MoKα","","0.0907","0.0599","","","0.1591","0.1775","","","","","","1.084","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051040","18.0285","0.0013","10.6208","0.0007","7.7084","0.0005","90","","98.223","0.002","90","","1460.81","0.17","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Fe N O2 -","- C18 H15 Fe N O2 -","- C72 H60 Fe4 N4 O8 -","4","1","","Jose A. Mata; Eduardo Peris; Inge Asselberghs; Roel Van Boxel; André Persoons","Syntheses, characterization and second-order nonlinear optical behavior of new ferrocenyl-terminated phenylethenyl oligomers with a pendant nitro group","New J. Chem.","2001","25","2","299","304","10.1039/b007411j","","","0.71073","MoKα","","0.0591","0.0306","","","0.0679","0.0833","","","","","","0.946","","","","has coordinates","192781","2020-10-21","18:00:00",""
"7051041","16.1351","0.0007","16.3746","0.0006","19.6653","0.0007","109.763","0.003","93.411","0.003","90.83","0.003","4877.7","0.3","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C114 H90 Cl4 N8 Ni2 O4 -","- C114 H82 Cl4 N8 Ni2 O4 -","- C228 H164 Cl8 N16 Ni4 O8 -","2","1","","François Jérôme; Jean-Michel Barbe; Claude P. Gros; Roger Guilard; Jean Fischer; Raymond Weiss","Peculiar reactivity of face to face biscorrole and porphyrin‒corrole with a nickel(II) salt. X-Ray structural characterization of a new nickel(II) bisoxocorrole","New J. Chem.","2001","25","1","93","101","10.1039/b007623f","","","0.71073","Mo-Kα","","0.121","0.073","","0.137","","0.107","","","1.348","","","1.04","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051042","8.8875","0.0009","11.9248","0.0012","26.99","0.003","91.405","0.011","94.482","0.011","99.522","0.011","2810.4","0.5","180","2","180","2","","","","","","","synthesized as described","5","P -1","-P 1","2","","","","- C60 H68 I2 N4 O11 -","- C60 H68 I2 N4 O11 -","- C120 H136 I4 N8 O22 -","2","1","","Lacroix, Pascal G.; Lepetit, Christine; Claude Daran, Jean","Switching nonlinear optical properties by proton transfer in hydrogen-bonded merocyanine dyes: a theoretical investigation at the semi-empirical level","New Journal of Chemistry","2001","25","3","451","","10.1039/b007726g","","","0.71073","MoKα","","","0.0282","","","","0.0329","","","","","","0.9349","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051043","13.1025","0.0001","13.5227","0.0001","16.4607","0.0001","94.579","0.001","102.822","0.001","105.621","0.001","2708.33","0.04","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H42 B4 F16 N10 Ru -","- C52 H42 B4 F16 N10 Ru -","- C104 H84 B8 F32 N20 Ru2 -","2","1","","Benniston, Andrew C.; Mackie, Philip R.; Farrugia, Louis J.; Smith, Graeme; Teat, Simon J.; McLean, Andrew J.","Detailed photophysical properties of a functionalized ruthenium(II) polypyridyl complex: through-space solvent effects","New Journal of Chemistry","2001","25","3","458","","10.1039/b007962f","","","0.6849","synchrotron","","0.0772","0.0595","","","0.1555","0.1643","","","","","","0.984","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051044","6.3652","0.0009","35.256","0.011","7.6591","0.0017","90","","108.033","0.017","90","","1634.4","0.7","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H26 F12 N6 P2 -","- C32 H26 F12 N6 P2 -","- C64 H52 F24 N12 P4 -","2","0.5","","Benniston, Andrew C.; Mackie, Philip R.; Farrugia, Louis J.; Smith, Graeme; Teat, Simon J.; McLean, Andrew J.","Detailed photophysical properties of a functionalized ruthenium(II) polypyridyl complex: through-space solvent effects","New Journal of Chemistry","2001","25","3","458","","10.1039/b007962f","","","0.6875","synchrotron","","0.173","0.0973","","","0.1556","0.1812","","","","","","1.068","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051045","7.4721","0.001","7.531","0.001","11.0761","0.0009","93.4149","0.0008","102.042","0.001","100.486","0.001","596.29","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","1","0.5","","Rahaman Laskar, Inamur; Das, Debasis; Mostafa, Golam; Lu, Tian-Huey; Keng, Tai-Chiun; Wang, Ju-Chun; Ghosh, Ashutosh; Ray Chaudhuri, Nirmalendu","First report on thermally induced nitro→nitrito(O,O) linkage isomerization in diamine complexes of nickel(II) in the solid state: X-ray single crystal structural analyses of nitro and nitrito isomers","New Journal of Chemistry","2001","25","5","764","","10.1039/b008254f","","","0.71073","MoKα","","0.082","0.0803","","0.2157","0.2134","","","","1.094","1.115","1.115","","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051046","10.283","0.0009","19.467","0.002","12.124","0.002","90","","95.4","0.01","90","","2416.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","- C64 H160 N24 Ni4 O16 -","4","1","","Rahaman Laskar, Inamur; Das, Debasis; Mostafa, Golam; Lu, Tian-Huey; Keng, Tai-Chiun; Wang, Ju-Chun; Ghosh, Ashutosh; Ray Chaudhuri, Nirmalendu","First report on thermally induced nitro→nitrito(O,O) linkage isomerization in diamine complexes of nickel(II) in the solid state: X-ray single crystal structural analyses of nitro and nitrito isomers","New Journal of Chemistry","2001","25","5","764","","10.1039/b008254f","","","0.71073","MoKα","","0.1082","0.0521","","0.1372","0.1086","","","","1.006","1.048","1.048","","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051047","10.3131","0.0007","19.2548","0.0012","12.0523","0.0008","90","","96.47","0.01","90","","2378.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 N6 Ni O4 -","- C16 H40 N6 Ni O4 -","- C64 H160 N24 Ni4 O16 -","4","1","","Rahaman Laskar, Inamur; Das, Debasis; Mostafa, Golam; Lu, Tian-Huey; Keng, Tai-Chiun; Wang, Ju-Chun; Ghosh, Ashutosh; Ray Chaudhuri, Nirmalendu","First report on thermally induced nitro→nitrito(O,O) linkage isomerization in diamine complexes of nickel(II) in the solid state: X-ray single crystal structural analyses of nitro and nitrito isomers","New Journal of Chemistry","2001","25","5","764","","10.1039/b008254f","","","0.71073","MoKα","","0.0423","0.0404","","0.1095","0.1069","","","","1.05","1.049","1.049","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051048","10.259","0.0005","14.7368","0.0007","5.1617","0.0004","93.601","0.005","111.643","0.005","85.992","0.004","772.88","0.08","298","","298","","","","","","","","","2","P -1","-P 1","2","","","","- C22 H20 -","- C22 H20 -","- C44 H40 -","2","1","","Takehiko Yamato; Naozumi Sakaue; Kan Tanaka; Hirohisa Tsuzuki","Medium-sized cyclophanes, 55: Synthesis and conformational studies of [2.1.1]orthocyclophanes","New Journal of Chemistry","2001","","","","","","","","","","","","","","","0.081","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"7051049","15.669","0.001","15.669","0.001","11.4392","0.0004","90","","90","","90","","2808.5","0.3","294","","294","","","","","","","","","3","P -4 21 c","P -4 2n","114","","","","- C60 H60 N4 -","- C60 H60 N4 -","- C120 H120 N8 -","2","0.25","","Cédric Klein; Ernest Graf; Mir Wais Hosseini; André De Cian","Design and structural analysis of interpenetrated 3-D co-ordination networks formed by self-assembly using tetrapyridinoocyclophane and silver cations","New J. Chem.","2001","25","2","207","209","10.1039/b008259g","","","0.71073","Mo-Kα","","0.15","0.084","","0.302","","0.119","","","2.938","","","1.128","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051050","24.4478","0.0004","24.4478","0.0004","68.74","0.001","90","","90","","90","","41085.5","1.1","173","","173","","","","","","","","","8","I 41/a c d :2","-I 4bd 2c","142","","","","- C36 H44 Ag Cl2 F6 N2 O5 P -","- C35.75 H30 Ag Cl2 F6 N2 O5 P -","- C1144 H960 Ag32 Cl64 F192 N64 O160 P32 -","32","1","","Cédric Klein; Ernest Graf; Mir Wais Hosseini; André De Cian","Design and structural analysis of interpenetrated 3-D co-ordination networks formed by self-assembly using tetrapyridinoocyclophane and silver cations","New J. Chem.","2001","25","2","207","209","10.1039/b008259g","","","0.71073","Mo-Kα","","0.291","0.134","","0.798","","0.173","","","25.92","","","1.179","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051051","15.642","0.003","29.006","0.006","6.556","0.0011","90","","90","","90","","2974.5","0.9","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C6 H8 N2 O3 -","- C6 H8 N2 O3 -","- C96 H128 N32 O48 -","16","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008262g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051052","8.181","0.002","12.891","0.002","7.758","0.002","104.73","0.02","116.1","0.02","73.34","0.02","696","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H15 N5 O5 -","- C12 H15 N5 O5 -","- C24 H30 N10 O10 -","2","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008262g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051053","7.586","0.002","16.547","0.002","10.856","0.002","90","","97.1","0.02","90","","1352.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 N4 O5 -","- C12 H14 N4 O5 -","- C48 H56 N16 O20 -","4","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008262g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051054","11.223","0.001","7.226","0.002","40.737","0.005","90","","90.53","0.01","90","","3303.5","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 N14 O6 -","- C30 H34 N14 O6 -","- C120 H136 N56 O24 -","4","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008262g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051055","7.262","0.001","9.466","0.003","9.839","0.001","91.28","0.02","109.46","0.01","94.01","0.02","635.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H15 N5 O3 -","- C11 H15 N5 O3 -","- C22 H30 N10 O6 -","2","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008262g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051056","10.111","0.002","11.747","0.002","9.369","0.002","107.72","0.01","109.66","0.01","66.16","0.01","940","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H20 N6 O7 -","- C17 H20 N6 O7 -","- C34 H40 N12 O14 -","2","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008262g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051057","13.612","0.002","15.789","0.004","10.172","0.004","100.5","0.03","102.23","0.02","97.16","0.02","2070.2","1.1","298.2","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H41.5 Ag3 Cl3 N8.5 O12 -","- C31 H40 Ag3 Cl3 N8.5 O12 -","- C62 H80 Ag6 Cl6 N17 O24 -","2","1","","Fei, Bao-Li; Sun, Wei-Yin; Okamura, Taka-aki; Tang, Wen-Xia; Ueyama, Norikazu","Synthesis and crystal structure of a luminescent infinite 2D brick-wall network with two- and three-coordinate silver(I) atoms and ligand-unsupported silver‒silver interactions","New Journal of Chemistry","2001","25","2","210","","10.1039/b008266j","","","0.7107","MoKα","","","0.0421","","","","0.1517","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051058","8.7139","0.0004","12.6362","0.0005","16.8896","0.0007","81.778","0.001","80.395","0.001","78.851","0.001","1787.22","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H29 Cl2 N7 O10 Ru -","- C36 H29 Cl2 N7 O10 Ru -","- C72 H58 Cl4 N14 O20 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.0451","0.0356","","","0.0888","0.0932","","","","","","1.028","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051059","11.83","0.004","13.271","0.005","17.791","0.006","97.664","0.006","92.213","0.006","115.897","0.006","2475.4","1.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H46 Cl2 N10 O12 Ru -","- C47 H34 Cl2 N9 O12 Ru -","- C94 H68 Cl4 N18 O24 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.1009","0.0525","","","0.1149","0.1252","","","","","","0.894","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051060","12.748","0.004","13.181","0.004","13.847","0.004","90","0.03","107.04","0.03","90","0.02","2224.6","1.2","173","2","173","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C44 H45 Cl2 F0 N7 Na0 O14 P0 Ru -","- C44 H45 Cl2 N7 O14 Ru -","- C88 H90 Cl4 N14 O28 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.0795","0.055","","","0.1326","0.1469","","","","","","1.025","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051061","12.485","0.002","13.085","0.004","17.988","0.004","71.249","0.014","76.915","0.016","82.05","0.02","2703.6","1.1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H50 Cl3 Li N10 O17 Ru -","- C48 H47 Cl3 Li N10 O17 Ru -","- C96 H94 Cl6 Li2 N20 O34 Ru2 -","2","1","","Rice, Craig R.; Guerrero, Ana; Bell, Zöe R.; Paul, Rowena L.; Motson, Graham R.; Jeffery, John C.; Ward, Michael D.","New hybrid ditopic ligands containing fused phenanthroline and crown ether units","New Journal of Chemistry","2001","25","2","185","","10.1039/b008378j","","","0.71073","MoKα","","0.0977","0.0633","","","0.1769","0.1932","","","","","","0.985","","","","has coordinates,has disorder","180064","2020-10-21","18:00:00",""
"7051062","8.9218","0.0011","11.9058","0.0014","18.795","0.002","71.592","0.002","76.372","0.002","88.482","0.002","1838.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H32 Ag2 N12 O13 -","- C30 H32 Ag2 N12 O13 -","- C60 H64 Ag4 N24 O26 -","2","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008383f","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051063","9.038","0.006","6.373","0.003","23.946","0.016","90","","100.79","0.02","90","","1354.9","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H8 Ag N5 O6 -","- C11 H8 Ag N5 O6 -","- C44 H32 Ag4 N20 O24 -","4","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b008383f","","","","","","","","","","","","","","","","","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051064","9.593","0.002","10.825","0.002","19.936","0.004","89.54","0.03","80.41","0.03","68.45","0.03","1895.4","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H30 Au2 P2 Se4 W -","- C36 H31 Au2 P2 Se4 W -","- C72 H62 Au4 P4 Se8 W2 -","2","1","","Zhang, Qian-Feng; Leung, Wa-Hung; Song, Ying-Lin; Hong, Mao-Chun; Kennard, Colin H. L.; Xin, Xin-Quan","Skeleton atomic effect on nonlinear optical properties of linear trinuclear heteroselenometallic compounds with univalent coinage metals","New Journal of Chemistry","2001","25","3","465","","10.1039/b008466m","","","0.71073","MoKα","","0.0713","0.0656","","0.1452","0.1213","","","","1.008","1.085","1.085","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051065","17.921","0.007","17.472","0.003","18.196","0.007","90","","95.86","0.02","90","","5668","3","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C54.5 H45 Ag2 Cl P3 Se4 W -","- C54.5 H45 Ag2 Cl P3 Se4 W -","- C218 H180 Ag8 Cl4 P12 Se16 W4 -","4","1","","Zhang, Qian-Feng; Leung, Wa-Hung; Song, Ying-Lin; Hong, Mao-Chun; Kennard, Colin H. L.; Xin, Xin-Quan","Skeleton atomic effect on nonlinear optical properties of linear trinuclear heteroselenometallic compounds with univalent coinage metals","New Journal of Chemistry","2001","25","3","465","","10.1039/b008466m","","","0.71069","MoKα","","0.0921","0.0507","","0.1614","0.112","","","","0.998","1.152","1.152","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051066","12.183","0.0006","12.955","0.0006","14.3375","0.0007","85.988","0.001","89.019","0.001","68.267","0.001","2096.81","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H51 N4 O24 P5 Zn4 -","- C16 H11 N4 O24 P5 Zn4 -","- C32 H22 N8 O48 P10 Zn8 -","2","1","","Ayi, Ayi A.; Choudhury, Amitava; Natarajan, Srinivasan; Rao, C. N. R.","Cyclic acetate dimers formed by C‒H···O hydrogen bonds in an open-framework zinc phosphate-acetate","New Journal of Chemistry","2001","25","2","213","","10.1039/b008498k","","","0.71073","MoKα","","0.0971","0.0661","","0.187","0.1684","","","","0.978","1.088","1.088","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051067","13.334","0.0012","5.8545","0.0005","21.617","0.002","90","","90.761","0.002","90","","1687.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 Cl N2 P -","- C18 H16 Cl N2 P -","- C72 H64 Cl4 N8 P4 -","4","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.71073","MoKα","","0.1537","0.0881","","0.3183","0.1656","","","","1.142","1.197","1.197","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051068","9.849","0.003","11.647","0.003","9.054","0.002","109.31","0.02","95.75","0.03","102.41","0.03","940.6","0.5","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H16 Au Cl2 N2 P -","- C18 H16 Au Cl2 N2 P -","- C36 H32 Au2 Cl4 N4 P2 -","2","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.7107","MoKα","","0.0258","0.0258","","0.0245","","0.0245","","","1.349","","","1.349","","","","has coordinates","191941","2020-10-21","18:00:00",""
"7051069","11.944","0.003","14.623","0.002","16.14","0.002","90","","91.36","0.02","90","","2818.1","0.9","293.2","","293.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 Cl2 N3 P Pd -","- C30 H28 Cl2 N3 P Pd -","- C120 H112 Cl8 N12 P4 Pd4 -","4","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.7107","MoKα","","0.0369","0.0369","","0.0481","","0.0481","","","1.438","","","1.438","","","","has coordinates","191941","2020-10-21","18:00:00",""
"7051070","9.226","0.002","12.365","0.006","8.559","0.004","98.9","0.04","107.85","0.02","106.17","0.03","861.3","0.6","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H16 Cl N2 O P -","- C18 H16 Cl N2 O P -","- C36 H32 Cl2 N4 O2 P2 -","2","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.7107","MoKα","","0.0342","0.0342","","0.0332","","0.0332","","","2.399","","","2.399","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051071","12.8214","0.0001","18.0482","0.0002","17.5951","0.0002","90","","93.954","0.0005","90","","4061.87","0.07","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C36 H32 B2 Cl2 F8 N4 P2 Pt -","- C36 H32 B2 Cl2 F8 N4 P2 Pt -","- C144 H128 B8 Cl8 F32 N16 P8 Pt4 -","4","1","","Coles, Simon J.; Durran, Sean E.; Hursthouse, Michael B.; Slawin, Alexandra M. Z.; Smith, Martin B.","Late transition metal complexes of a new P-N ligand Ph~2~PCH~2~N(H)C~5~H~3~(Cl-5)N: synthesis and structural studies","New Journal of Chemistry","2001","25","3","416","422","10.1039/b008502m","","","0.71073","MoKα","","0.0534","0.043","","","0.1176","0.1251","","","","","","0.958","","","","has coordinates","191941","2020-10-21","18:00:00",""
"7051072","8.0095","0.0019","17.599","0.003","8.826","0.002","90","","105.42","0.03","90","","1199.3","0.5","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 N2 O2 -","- C15 H10 N2 O2 -","- C60 H40 N8 O8 -","4","1","","Eastmond, Geoffrey C.; Gilchrist, Thomas L.; Paprotny, Jerzy; Steiner, Alexander","Cyano-activated fluoro displacement reactions in the synthesis of cyanophenoxazines and related compounds","New Journal of Chemistry","2001","25","3","385","","10.1039/b008503k","","","0.71073","MoKα","","0.1225","0.0651","","","0.169","0.194","","","","","","0.918","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051073","8.6688","0.0013","9.4019","0.001","19.222","0.002","90","","90","","90","","1566.7","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H18 O2 -","- C20 H18 O2 -","- C80 H72 O8 -","4","1","","Eastmond, Geoffrey C.; Paprotny, Jerzy; Steiner, Alexander; Swanson, Linda","Synthesis of cyanodibenzo[1,4]dioxines and their derivatives by cyano-activated fluoro displacement reactions","New Journal of Chemistry","2001","25","3","379","","10.1039/b008508l","","","0.71073","MoKα","","0.0407","0.0322","","","0.0712","0.0735","","","","","","0.982","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051074","34.48","0.09","8.96","0.02","17.67","0.03","90","","96.82","0.09","90","","5420","2","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H36 F3 P2 Rh -","- C27 H36 F3 P2 Rh -","- C216 H288 F24 P16 Rh8 -","8","1","","Herber, Ulrich; Guerrero Sanchez, Rita; Gevert, Olaf; Laubender, Matthias; Werner, Helmut","PX3-induced migratory insertion reactions of half-sandwich-type carbenerhodium(I) complexes","New Journal of Chemistry","2001","25","3","396","","10.1039/b008601k","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051075","10.17","0.003","11.177","0.002","17.401","0.003","85.68","0.01","84.78","0.02","88.03","0.02","1963.4","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H51 O3 P2 Rh -","- C45 H51 O3 P2 Rh -","- C90 H102 O6 P4 Rh2 -","2","1","","Herber, Ulrich; Guerrero Sanchez, Rita; Gevert, Olaf; Laubender, Matthias; Werner, Helmut","PX3-induced migratory insertion reactions of half-sandwich-type carbenerhodium(I) complexes","New Journal of Chemistry","2001","25","3","396","","10.1039/b008601k","","","0.71073","MoKα","","0.1115","0.073","","0.1943","0.1633","","","","1.068","1.084","1.084","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051076","8.949","0.003","11.071","0.004","14.162","0.002","77.739","0.0003","78.887","0.0003","75.016","0.0005","1310.3","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H25 Cu N3 O6 S2 -","- C26 H25 Cu N3 O6 S2 -","- C52 H50 Cu2 N6 O12 S4 -","2","1","","Bermejo, M. R.; Fondo, M.; Garcia-Deibe, A.; Piro, O.; Sousa, A.; Sousa-Pedrares, A.","Structural characterisation of metal complexes containing 1-[(4-methylphenyl)sulfonamido(-2-([1-(2-pyridylmethylidene]amino(benzene","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051077","9.33","0.002","10.721","0.004","14.634","0.003","101.684","0.0003","103.956","0.0003","105.54","0.0005","1311.7","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H25 N3 O6 S2 Zn -","- C26 H25 N3 O6 S2 Zn -","- C52 H50 N6 O12 S4 Zn2 -","2","1","","Bermejo, M. R.; Fondo, M.; Garcia-Deibe, A.; Piro, O.; Sousa, A.; Sousa-Pedrares, A.","Structural characterisation of metal complexes containing 1-[(4-methylphenyl)sulfonamido(-2-([1-(2-pyridylmethylidene]amino(benzene","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051078","10.78","0.002","15.226","0.003","11.158","0.002","90","","103.235","0.004","90","","1782.9","0.6","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H32 Co N6 O4 S2 -","- C38 H32 Co N6 O4 S2 -","- C76 H64 Co2 N12 O8 S4 -","2","1","","Bermejo, M. R.; Fondo, M.; Garcia-Deibe, A.; Piro, O.; Sousa, A.; Sousa-Pedrares, A.","Structural characterisation of metal complexes containing 1-[(4-methylphenyl)sulfonamido(-2-([1-(2-pyridylmethylidene]amino(benzene","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051079","42.6482","0.0004","14.7187","0.0002","17.7055","0.0001","90","","112.885","0.001","90","","10239.4","0.18","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C57 H48 Cu1.5 N9 O6 S3 -","- C57 H48 Cu1.5 N9 O6 S3 -","- C456 H384 Cu12 N72 O48 S24 -","8","1","","Bermejo, M. R.; Fondo, M.; Garcia-Deibe, A.; Piro, O.; Sousa, A.; Sousa-Pedrares, A.","Structural characterisation of metal complexes containing 1-[(4-methylphenyl)sulfonamido(-2-([1-(2-pyridylmethylidene]amino(benzene","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051080","11.372","0.002","11.7922","0.0013","14.668","0.006","98.446","0.018","92.76","0.02","95.033","0.012","1934.4","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H38 N8 O4 S2 Zn -","- C42 H38 N8 O4 S2 Zn -","- C84 H76 N16 O8 S4 Zn2 -","2","1","","Bermejo, M. R.; Fondo, M.; Garcia-Deibe, A.; Piro, O.; Sousa, A.; Sousa-Pedrares, A.","Structural characterisation of metal complexes containing 1-[(4-methylphenyl)sulfonamido(-2-([1-(2-pyridylmethylidene]amino(benzene","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051081","9.708","0.003","10.855","0.002","20.083","0.005","82.78","0.02","86.35","0.02","77.9","0.02","2051.4","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H50 Fe2 O6 P2 -","- C44 H50 Fe2 O6 P2 -","- C88 H100 Fe4 O12 P4 -","2","1","","Richard Frantz; Francis Carré; Jean-Olivier Durand; Gérard F. Lanneau","New phosphonates containing a π-conjugated ferrocenyl unit","New J. Chem.","2001","25","2","188","190","10.1039/b008937k","","","0.71069","MoKα","","0.0629","0.0421","","0.112","0.1094","","","","0.939","1.066","1.066","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051082","7.181","0.002","12.321","0.002","14.958","0.003","88.55","0.02","83.61","0.02","86.5","0.02","1312.5","0.5","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H72 Co3 Cu2 N4 O24 -","- C36 H66 Co3 Cu2 N4 O24 -","- C36 H66 Co3 Cu2 N4 O24 -","1","0.5","","Valeriya G. Makhankova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Brian W. Skelton; Jan Reedijk; Gerard A. Van Albada; Lorenzo Sorace; Dante Gatteschi","A unique heteropentanuclear CuII2CoIICoIII2 complex, synthesised from metallic Cu and Co acetate in the presence of triethanolamine. Magnetic properties and a strong H-bond stabilised lattice","New J. Chem.","2001","25","5","685","689","10.1039/b009194o","","","0.71073","MoKα","","0.114","0.062","","0.076","","0.066","","","1.19","","","1.318","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051083","7.701","0.002","30.779","0.006","9.425","0.002","90","","92.98","0.03","90","","2231","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11 N3 O5 S -","- C8 H11 N3 O5 S -","- C64 H88 N24 O40 S8 -","8","2","","Veneta Videnova-Adrabinska; El¿bieta Janeczko; Teresa Borowiak; Grzegorz Dutkiewicz","","New Journal of Chemistry","2001","","","","","10.1039/b009197i","","","","","","","0.0512","","","0.1346","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051084","10.626","0.002","15.597","0.003","7.182","0.001","90","","103.38","0.02","90","","1158","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11 N3 O5 S -","- C8 H11 N3 O5 S -","- C32 H44 N12 O20 S4 -","4","1","","Veneta Videnova-Adrabinska; El¿bieta Janeczko; Teresa Borowiak; Grzegorz Dutkiewicz","","New Journal of Chemistry","2001","","","","","10.1039/b009197i","","","","","","","0.0428","","","0.118","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051085","13.617","0.001","14.569","0.001","16.28","0.001","64.67","0.01","84.612","0.001","68.296","0.001","2704.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H64 Cl3 N O11 -","- C55 H64 Cl2.964 N O11 -","- C110 H128 Cl5.928 N2 O22 -","2","1","","Wojciech Wasikiewicz; Michal Slaski; Gabriel Rokicki; V. Boehmer; Ch. Schmidt; E. F. Paulus","","New Journal of Chemistry","2001","","","","","10.1039/b009260f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051086","14.358","0.0007","14.358","0.0007","37.944","0.002","90","","90","","90","","7822.2","0.7","293","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C50 H37 Co O4 -","- C50 H37 Co O4 -","- C400 H296 Co8 O32 -","8","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.4191","0.0629","","","0.1486","0.2076","","","","","","0.644","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051087","13.2613","0.0004","13.2613","0.0004","33.4406","0.0015","90","","90","","90","","5880.9","0.4","293","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C40 H30 Co O3 -","- C40 H30 Co O3 -","- C320 H240 Co8 O24 -","8","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.1186","0.0331","","","0.0625","0.075","","","","","","0.812","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051088","10.4464","0.0016","14.85","0.002","15.985","0.002","68.894","0.005","80.311","0.005","87.814","0.005","2279.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C51.5 H41.5 Co N1.5 O7 -","- C51.5 H41.5 Co N1.5 O7 -","- C103 H83 Co2 N3 O14 -","2","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.3358","0.0763","","","0.1959","0.2554","","","","","","0.717","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051089","10.622","0.001","12.39","0.001","12.59","0.001","89.4","0.01","112.13","0.01","100.14","0.01","1508.1","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H27 Cs O4 -","- C40 H27 Cs O4 -","- C80 H54 Cs2 O8 -","2","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.0736","0.0475","","","0.134","0.1564","","","","","","0.889","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051090","10.682","0.001","12.214","0.001","12.668","0.001","90","0.01","112.6","0.01","100.03","0.01","1498.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H27 O4 Rb -","- C40 H27 O4 Rb -","- C80 H54 O8 Rb2 -","2","1","","Grepioni, Fabrizia; Gladiali, Serafino; Scaccianoce, Laura; Ribeiro, Paulinha; Braga, Dario","Crystal engineering of chiral superstructures based on (R)-(+)-1,1'-bi-2-naphthol and the alkali derivatives of racemic (R,S)-1,1'-bi-2-naphthol","New Journal of Chemistry","2001","25","5","690","","10.1039/b009665m","","","0.71073","MoKα","","0.1121","0.0657","","","0.1712","0.1998","","","","","","1.032","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051091","23.255","0.003","11.484","0.002","6.936","0.009","90","","90","","90","","1852","2","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C12 H9 N O -","- C12 H9 N O -","- C96 H72 N8 O8 -","8","1","","Touzani, Rachid; Ben-Hadda, Taibi; Elkadiri, Sghir; Ramdani, Abdelkrim; Maury, Olivier; Le Bozec, Hubert; Toupet, Loic; Dixneuf, Pierre H.","Solution, solid state structure and fluorescence studies of 2,3-functionalized quinoxalines: evidence for a π-delocalized keto-enamine form with N‒H···O intramolecular hydrogen bonds","New Journal of Chemistry","2001","25","3","391","","10.1039/b009667i","","","0.71069","MoKα","","0.1056","0.0408","","","0.0957","0.1156","","","","","","0.999","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051092","11.008","0.003","18.305","0.003","10.524","0.006","90","","109.91","0.03","90","","1993.9","1.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C48 H48 N4 O4 -","- C48 H48 N4 O4 -","- C96 H96 N8 O8 -","2","1","","Touzani, Rachid; Ben-Hadda, Taibi; Elkadiri, Sghir; Ramdani, Abdelkrim; Maury, Olivier; Le Bozec, Hubert; Toupet, Loic; Dixneuf, Pierre H.","Solution, solid state structure and fluorescence studies of 2,3-functionalized quinoxalines: evidence for a π-delocalized keto-enamine form with N‒H···O intramolecular hydrogen bonds","New Journal of Chemistry","2001","25","3","391","","10.1039/b009667i","","","0.71069","MoKα","","0.2081","0.0511","","","0.104","0.1465","","","","","","0.905","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051093","8.3994","0.001","14.738","0.002","18.901","0.003","90","","99.35","0.01","90","","2308.7","0.6","293","2","193","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","tetrakis(octanoato O,O')bis(2-aminopyridine)dicopper(II)","","- C42 H72 Cu2 N4 O8 -","- C42 H72 Cu2 N4 O8 -","- C84 H144 Cu4 N8 O16 -","2","0.5","","Lah, Nina; Giester, Gerald; Lah, Jurij; Šegedin, Primož; Leban, Ivan","Copper(II) carboxylates with 2-aminopyridine. Synthesis, characterization and a study of the dimer‒monomer equilibrium in acetonitrile solutions by VIS-spectroscopic and microcalorimetric titrations","New Journal of Chemistry","2001","25","5","753","","10.1039/b009807h","","","0.71073","MoKα","","0.0787","0.0548","","","0.1494","0.1738","","","","","","0.909","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051094","8.427","0.002","25.312","0.005","13.734","0.003","90","","105.42","0.03","90","","2824.1","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(octanoato-O)bis(2-aminopyridine)copper(II)","","- C26 H42 Cu N4 O4 -","- C26 H42 Cu N4 O4 -","- C104 H168 Cu4 N16 O16 -","4","1","","Lah, Nina; Giester, Gerald; Lah, Jurij; Šegedin, Primož; Leban, Ivan","Copper(II) carboxylates with 2-aminopyridine. Synthesis, characterization and a study of the dimer‒monomer equilibrium in acetonitrile solutions by VIS-spectroscopic and microcalorimetric titrations","New Journal of Chemistry","2001","25","5","753","","10.1039/b009807h","","","0.71073","MoKα","","0.129","0.069","","","0.1312","0.1492","","","","","","1.024","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051095","17.676","0.006","18.784","0.008","22.185","0.011","90","","90","","90","","7366","5","200","2","200","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C31 H69 N5 P2 -","- C31 H69 N5 P2 -","- C248 H552 N40 P16 -","8","1","","Baceiredo, Antoine; Bertrand, Guy; Dyer, Philip W.; Fawcett, John; Griep-Raming, Nina; Guerret, Olivier; Hanton, Martin J.; Russell, David R.; Williamson, Anna-Maria","The 'one-pot' syntheses of α,α'-diphosphino-substituted imines: a unique reaction of bulky bis(dialkylamino)chlorophosphines","New Journal of Chemistry","2001","25","4","591","","10.1039/b009867l","","","0.71073","MoKα","","0.163","0.0776","","","0.1628","0.2","","","","","","0.983","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051096","15.684","0.002","18.737","0.001","11.044","0.003","90","","90","","90","","3245.5","1","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","5-tert-butyl-8-cyanometaparacyclophane-1,9-diene","","","- C21 H19 N -","- C21 H19 N -","- C168 H152 N8 -","8","2","","Yamato, Takehiko; Noda Kozo; Tsuzuki, Hirohisa","Medium-sized cyclophanes. Part 56 5-tert-Butyl-8-substituted [2.2]metaparacyclophane-1,9-dienes. Preparation, X-ray diffraction studies, and their treatment with Lewis acid and protic acid","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051097","13.7985","0.0015","7.0222","0.0005","23.996","0.002","90","","92.546","0.012","90","","2322.8","0.4","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","F2PDT-TTF, TCNQF4","","","- C21 H6 F6 N4 S6 -","- C21 H6 F6 N4 S6 -","- C84 H24 F24 N16 S24 -","4","1","","Dautel, O. J.; Fourmigue, M.","","New Journal of Chemistry","2001","","","","","10.1039/b010099o","","","","","","","0.0449","","","0.1057","","","","","","","","","","","has coordinates","180064","2020-10-21","18:00:00",""
"7051098","8.5798","0.0017","11.544","0.002","15.944","0.003","93.28","0.03","101.93","0.03","92.84","0.03","1539.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","F2PDT-EDT-TTF, TCNQF4, TCE","","","- C25 H11 Cl3 F6 N4 S8 -","- C25 H11 Cl3 F6 N4 S8 -","- C50 H22 Cl6 F12 N8 S16 -","2","1","","","","New Journal of Chemistry","2001","","","","","10.1039/b010099o","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051099","13.342","0.002","16.113","0.002","25.563","0.002","80.02","0.01","77.7","0.01","69.65","0.01","5004.6","1.1","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C89 H111 N5 O3 Ru -","- C89 H111 N5 O3 Ru -","- C178 H222 N10 O6 Ru2 -","2","1","","Maiya, Bhaskar G.; Bampos, Nick; Asok Kumar, A.; Feeder, Neil; Sanders, Jeremy K. M.","A supramolecular array assembled via the complementary binding properties of ruthenium(II) and tin(IV) porphyrins","New Journal of Chemistry","2001","25","6","797","","10.1039/b010148f","","","0.71073","MoKα","","0.1153","0.0779","","","0.2352","0.264","","","","","","1.055","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7051100","12.978","0.0008","20.976","0.001","11.3418","0.0007","90","","93.216","0.001","90","","3082.6","0.3","298.2","","298.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C40 H54 N8 O25 Tb4 -","- C40 H54 N8 O25 Tb4 -","- C80 H108 N16 O50 Tb8 -","2","0.5","","Gao, S.; Lam, A. W.-H.; Wen, G.; Wong, W.-T.; Zhang, X.-X.","","New Journal of Chemistry","2001","","","","","10.1039/b010193l","","","","","","","0.0605","","","0.071","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051101","9.191","0.001","12.292","0.001","21.682","0.002","90","","90","","90","","2449.5","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H32 N3 -","- C30 H33 N3 -","- C120 H132 N12 -","4","1","","Ch. Schmidt; E. F. Paulus; V. Boehmer; W. Vogt","","New Journal of Chemistry","2001","","","","","10.1039/b010210p","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051102","14.969","0.004","7.986","0.007","20.429","0.01","90","","90","","90","","2442","2","293","2","293","2","","","","","","","","7","C m c m","-C 2c 2","63","","","","- C25 H16 F3 Mn N6 O5 S -","- C25 H12 F3 Mn N6 O5 S -","- C100 H48 F12 Mn4 N24 O20 S4 -","4","0.25","","Courseille, Christian; Dautant, A.; Mathoniere, C.; Pierre, C.; Verlhac, Jean-Baptiste; Vincent, J.-M.","","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051103","9.0532","0.0004","18.5975","0.0009","13.4262","0.0008","90","","92.218","0.002","90","","2258.8","0.2","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C54 H52 N2 P2 S2 -","- C54 H52 N2 P2 S2 -","- C108 H104 N4 P4 S4 -","2","1","","Andrieu, Jacques; Camus, Jean-Michel; Poli, Rinaldo; Richard, Philippe","New chiral α-aminophosphine oxides and sulfides: an unprecedented rhodium-catalyzed ligand epimerization","New Journal of Chemistry","2001","25","8","1015","","10.1039/b100217l","","","0.71069","MoKα","","0.0689","0.0425","","","0.0753","0.0829","","","","","","0.992","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051104","5.804","0.001","16.911","0.003","23.518","0.006","90","","90","","90","","2308.3","0.8","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H26 N O P -","- C27 H26 N O P -","- C108 H104 N4 O4 P4 -","4","1","","Andrieu, Jacques; Camus, Jean-Michel; Poli, Rinaldo; Richard, Philippe","New chiral α-aminophosphine oxides and sulfides: an unprecedented rhodium-catalyzed ligand epimerization","New Journal of Chemistry","2001","25","8","1015","","10.1039/b100217l","","","0.71073","MoKα","","0.0409","0.0358","","","0.0858","0.0891","","","","","","1.045","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051105","8.023","0.0001","8.234","0.0001","33.321","0.0005","90","","90.401","0.0005","90","","2201.18","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H30 Cl2 N2 Ru -","- C23 H30 Cl2 N2 Ru -","- C92 H120 Cl8 N8 Ru4 -","4","1","","Bekir Çetinkaya; Serpil Demir; Ismail Özdemir; Loïc Toupet; David Sémeril; Christian Bruneau; Pierre H. Dixneuf","First ruthenium complexes with a chelating arene carbene ligand as catalytic precursors for alkene metathesis and cycloisomerisation","New J. Chem.","2001","25","4","519","521","10.1039/b100264n","","","0.71069","MoKα","","0.0381","0.0319","","","0.0907","0.0953","","","","","","1.04","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051106","11.6439","0.0001","12.7731","0.0002","15.5221","0.0003","81.983","0.001","71.16","","86.863","0.001","2163.43","0.06","293","2","","","","","","","","","","6","P 1","P 1","1","","","","- C77 H83 Cl16 Co N6 O8 -","- C77 H83 Cl16 Co N6 O8 -","- C77 H83 Cl16 Co N6 O8 -","1","1","","Jean-Pierre Simonato; Sabrina Chappellet; Jacques Pécaut; Paul Baret; Jean-Claude Marchon","Evaluation of cobalt(III) tetramethylchiroporphyrin as an analytical reagent for the determination of enantiomer composition of primary amines and aziridines by 1H NMR spectroscopy","New J. Chem.","2001","25","5","714","720","10.1039/b100268f","","","0.71073","MoKα","","0.0796","0.0632","","0.1702","0.1576","","","","0.995","1.053","1.053","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051107","11.8042","0.0001","11.8042","0.0001","38.5292","0.0001","90","","90","","120","","4649.37","0.06","193","2","","","","","","","","","","6","P 62 2 2","P 62 2 (0 0 4)","180","","","","- C56 H84 Cl Co N6 O12 -","- C56 H74 Cl Co N6 O12 -","- C168 H222 Cl3 Co3 N18 O36 -","3","0.25","","Jean-Pierre Simonato; Sabrina Chappellet; Jacques Pécaut; Paul Baret; Jean-Claude Marchon","Evaluation of cobalt(III) tetramethylchiroporphyrin as an analytical reagent for the determination of enantiomer composition of primary amines and aziridines by 1H NMR spectroscopy","New J. Chem.","2001","25","5","714","720","10.1039/b100268f","","","0.71073","MoKα","","0.0891","0.0684","","","0.1737","0.1857","","","","","","1.304","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051108","11.798","0.007","9.585","0.007","14.167","0.003","90","","110.95","0.02","90","","1496.2","1.4","293","2","293","2","","","","","","","","6","P 1 2/a 1","-P 2ya","13","","","","- C36 H88 Cl3 Cu4 N11 O24 -","- C36 H88 Cl3 Cu4 N11 O24 -","- C36 H88 Cl3 Cu4 N11 O24 -","1","0.25","","Chaudhuri, N. R.; Hibbs, W.; Maji, T. K.; Mostafa, G.; Mukherjee, Partha Sarathi","","New Journal of Chemistry","2001","","","","","10.1039/b100468i","","","","","","","0.0988","","","0.2261","","","","","","","","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051109","17.626","0.0006","18.719","0.0005","19.882","0.0005","115.972","0.0015","94.19","0.0017","104.525","0.0016","5581.4","0.3","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H44 N7 Na O14 -","- C48 H29 N4 Na O8 -","- C192 H116 N16 Na4 O32 -","4","2","","Diskin-Posner, Yael; Goldberg, I.","","New Journal of Chemistry","2001","","","","","10.1039/b100580b","","","","","","","","","","","","","","","","","","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7051110","19.271","0.0005","26.212","0.0009","24.016","0.0007","90","","92.218","0.0018","90","","12122.1","0.6","110","2","110","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C72 H49 N8 Na O16 -","- C54 H34 N5 Na O10 -","- C432 H272 N40 Na8 O80 -","8","1","","Diskin-Posner, Yael; Goldberg, I.","","New Journal of Chemistry","2001","","","","","10.1039/b100580b","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051111","10.864","0.0007","21.562","0.0011","45.165","0.003","90","","93.858","0.002","90","","10555.9","1","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H49 N4 Na O9 Zn -","- C48 H27 N4 Na O9 Zn -","- C384 H216 N32 Na8 O72 Zn8 -","8","2","","Diskin-Posner, Yael; Goldberg, I.","","New Journal of Chemistry","2001","","","","","10.1039/b100580b","","","","","","","","","","","","","","","","","","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7051112","30.715","0.0005","13.796","0.0003","33.555","0.0008","90","","92.799","0.0006","90","","14201.8","0.5","110","2","110","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C142 H145 N10 Na5 O38 Zn2 -","- C130 H92 N10 Na5 O26 Zn2 -","- C520 H368 N40 Na20 O104 Zn8 -","4","1","","Diskin-Posner, Yael; Goldberg, I.","","New Journal of Chemistry","2001","","","","","10.1039/b100580b","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051113","9.5318","0.0016","15.85","0.002","10.3573","0.0011","90","","110.16","","90","","1468.9","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,10-Dibromo-4,7-bis-(3-bromo-prop-1-ynyl)-4,7-bisbenzoyloxy-dodeca- 2,8-diyne","","- C30 H26 Br4 O2 -","- C30 H26 Br4 O2 -","- C60 H52 Br8 O4 -","2","0.5","","König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G.","Synthesis and structure of bicyclic enediynes via twofold carbenoid ring closure","New Journal of Chemistry","2001","25","7","912","916","10.1039/b101572a","","","0.71073","MoKα","","0.1093","0.047","","0.1061","0.0932","","","","0.903","1.1","1.1","","","","","has coordinates","210356","2020-10-21","18:00:00",""
"7051114","9.108","0.004","11.199","0.003","25.19","0.006","96.03","0.03","97.718","0.018","109.5","0.03","2369","1.4","143","2","143","2","","","","","","","","3","P -1","-P 1","2","","1,8-Dibenzoyloxy-bicyclo[6.6.4]octadeca-4,11-diene-2,6,9,13-tetrayne","","- C32 H26 O2 -","- C32 H26 O2 -","- C128 H104 O8 -","4","2","","König, Burkhard; Pitsch, Wolfgang; Dix, Ina; Jones, Peter G.","Synthesis and structure of bicyclic enediynes via twofold carbenoid ring closure","New Journal of Chemistry","2001","25","7","912","916","10.1039/b101572a","","","0.71073","MoKα","","0.1476","0.0612","","0.1446","0.1111","","","","1.018","1.137","1.137","","","","","has coordinates,has disorder","210356","2020-10-21","18:00:00",""
"7051115","11.7417","0.0002","15.7638","0.0002","16.3452","0.0002","61.8921","0.0003","88.7569","0.0008","78.1825","0.0009","2602.21","0.07","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H18 N2 -","- C14 H18 N2 -","- C112 H144 N16 -","8","4","","Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose","The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent","New Journal of Chemistry","2001","25","6","819","","10.1039/b101733k","","","0.71073","MoKα","","0.1115","0.0646","","","0.1678","0.2059","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051116","18.9969","0.001","18.9969","0.001","13.3498","0.001","90","","90","","90","","4817.7","0.5","173","2","173","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C12 H22 N2 -","- C12 H22 N2 -","- C192 H352 N32 -","16","1","","Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose","The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent","New Journal of Chemistry","2001","25","6","819","","10.1039/b101733k","","","0.71073","MoKα","","0.1141","0.0609","","","0.1123","0.1388","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051117","12.7395","0.0004","28.0431","0.0007","12.2071","0.0003","90","","98.0824","0.0019","90","","4317.7","0.2","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C10 H18 N2 -","- C10 H18 N2 -","- C160 H288 N32 -","16","2","","Trofimenko, Swiatoslaw; Rheingold, Arnold L.; Liable-Sands, Louise M.; María Claramunt, Rosa; López, Concepción; Dolores Santa María, María; Elguero, Jose","The molecular structure of 4-tert-butylpyrazoles in the solid state and in solution: an X-ray, NMR and calorimetric study of the buttressing effect of a 4-tert-butyl substituent","New Journal of Chemistry","2001","25","6","819","","10.1039/b101733k","","","0.71073","MoKα","","0.1077","0.0685","","","0.1308","0.1522","","","","","","1.185","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051118","15.049","0.002","15.049","0.002","18.794","0.004","90","","90","","120","","3686.1","1","293","2","293","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C48 H126 Cr2 N30 Ni3 O24 -","- C48 H106.02 Cr2 N30 Ni3 O14 -","- C96 H212.04 Cr4 N60 Ni6 O28 -","2","0.166667","","Xiang, Hua; Gao, Song; Lu, Tong-Bu; Luck, Rudy L.; Mao, Zong-Wan; Chen, Xiao-Ming; Ji, Liang-Nian","[NiL1]3[Cr(CN)6]2·18H2O [L1=3,10-bis(2-hydroxyethyl)- 1,3,5,8,10,12-hexaazacyclotetradecane]: a two-dimensional bimetallic assembly exhibiting antiferromagnetic ordering and metamagnetic behavior","New Journal of Chemistry","2001","25","6","875","","10.1039/b101778k","","","0.71073","MoKα","","0.0748","0.0324","","","0.0859","0.1007","","","","","","1.004","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051119","15.004","0.004","10.412","0.004","16.228","0.002","90","","112.69","0.01","90","","2339","1.1","296","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H33 Cl3 Cu2 N4 O3 Zn -","- C12 H33 Cl3 Cu2 N4 O3 Zn -","- C48 H132 Cl12 Cu8 N16 O12 Zn4 -","4","1","","Elena A. Vinogradova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Philip J. Squattrito; Jan Reedijk; Gerard A. Van Albada; Wolfgang Linert; Satish K. Tiwary; Paul R. Raithby","Symmetric and asymmetric trinuclear cores in novel μ-alkoxo-bridged mixed-metal CuII2ZnII complexes: synthesis from zerovalent copper and zinc oxide, structure and magnetism","New J. Chem.","2001","25","7","949","953","10.1039/b101883n","","","0.7107","MoKα","","","0.032","","","","0.031","","","","","","1.68","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051120","15.214","0.003","10.478","0.002","16.526","0.003","90","","113.69","0.03","90","","2412.4","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H33 Br3 Cu2 N4 O3 Zn -","- C12 H33 Br3 Cu2 N4 O3 Zn -","- C48 H132 Br12 Cu8 N16 O12 Zn4 -","4","1","","Elena A. Vinogradova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Philip J. Squattrito; Jan Reedijk; Gerard A. Van Albada; Wolfgang Linert; Satish K. Tiwary; Paul R. Raithby","Symmetric and asymmetric trinuclear cores in novel μ-alkoxo-bridged mixed-metal CuII2ZnII complexes: synthesis from zerovalent copper and zinc oxide, structure and magnetism","New J. Chem.","2001","25","7","949","953","10.1039/b101883n","","","0.71073","MoKα","","0.1024","0.0679","","0.1966","0.1665","","","","1.013","1.07","1.07","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051121","14.288","0.003","19.827","0.004","10.079","0.002","90","","90","","90","","2855.3","1","180","2","180","2","","","","","","","","7","C m c 21","C 2c -2","36","","","","- C17 H33 Cu2 N7 O3 S3 Zn -","- C17 H33 Cu2 N7 O3 S3 Zn -","- C68 H132 Cu8 N28 O12 S12 Zn4 -","4","0.5","","Elena A. Vinogradova; Olga Yu. Vassilyeva; Volodymyr N. Kokozay; Philip J. Squattrito; Jan Reedijk; Gerard A. Van Albada; Wolfgang Linert; Satish K. Tiwary; Paul R. Raithby","Symmetric and asymmetric trinuclear cores in novel μ-alkoxo-bridged mixed-metal CuII2ZnII complexes: synthesis from zerovalent copper and zinc oxide, structure and magnetism","New J. Chem.","2001","25","7","949","953","10.1039/b101883n","","","0.71073","MoKα","","0.1166","0.0635","","","0.1096","0.1311","","","","","","1.005","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051122","7.1504","0.0001","13.5269","0.0002","13.5587","0.0002","63.756","0.001","80.888","0.001","81.243","0.001","1156.39","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","Trimesic acid. phloroglucinol","","","- C24 H18 O15 -","- C24 H18 O15 -","- C48 H36 O30 -","2","1","","Liu, Rong; Mok, Kum-Fun; Valiyaveettil, Suresh","Solid-state self-assembly of a complex from 1,3,5-benzenetricarboxylic acid and 1,3,5-trihydroxybenzene: influence of strong O‒H···O and C‒H···O hydrogen bonds","New Journal of Chemistry","2001","25","7","890","","10.1039/b102098f","","","0.71073","MoKα","","0.0447","0.0368","","","0.1069","0.1112","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051123","16.203","0.003","13.122","0.003","10.438","0.002","90","","90","","90","","2219","1","110","","110","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C16 H8 Fe2 N16 O -","- C14 H7 Fe2 N15 O0.5 -","- C56 H28 Fe8 N60 O2 -","4","0.5","","Triki, Smail; Thetiot, Franck; Galan-Mascaros, Jose-Ramon; Sala Pala, Jean; Dunbar, R. Kim","New Compounds with Bridging Dicyanamide and Bis-Chelating 2,2'-Bipyrimidine Ligands: Syntheses, Structural Characterization and Magnetic Properties of Two-Dimensional Materials [Fe2(dca)4(bpym)].H2O and [Fe2(dca)4(bpym)(H2O)2].","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","277870","2022-09-15","11:09:05",""
"7051124","8.384","0.002","9.223","0.002","13.983","0.003","90","","90.95","0.03","90","","1081.1","0.7","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H10 Fe2 N16 O2 -","- C16 H10 Fe2 N16 O2 -","- C32 H20 Fe4 N32 O4 -","2","0.5","","Triki, Smail; Thetiot, Franck; Galan-Mascaros, Jose-Ramon; Sala Pala, Jean; Dunbar, R. Kim","New Compounds with Bridging Dicyanamide and Bis-Chelating 2,2'-Bipyrimidine Ligands: Syntheses, Structural Characterization and Magnetic Properties of Two-Dimensional Materials [Fe2(dca)4(bpym)].H2O and [Fe2(dca)4(bpym)(H2O)2].","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051125","9.501","0.003","16.156","0.003","11.009","0.003","90","","112.91","0.02","90","","1556.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C18 H16 N O P -","- C18 H16 N O P -","- C72 H64 N4 O4 P4 -","4","1","","Andrews, C. D.; Burrows, A. D.; Lynam, J. M.; Mahon, M.; Palmer, M. T.","","New Journal of Chemistry","2001","","","","","10.1039/b102193l","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051126","9.762","0.003","10.383","0.004","14.411","0.005","110.5","0.03","93.69","0.03","100.85","0.03","1330.2","0.8","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","","","- C25.5 H22 Cl2 Mo N O3 P -","- C25.5 H21 Cl2 Mo N O3 P -","- C51 H42 Cl4 Mo2 N2 O6 P2 -","2","1","","Andrews, C. D.; Burrows, A. D.; Lynam, J. M.; Mahon, M.; Palmer, M. T.","","New Journal of Chemistry","2001","","","","","10.1039/b102193l","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051127","29.1337","0.0002","29.1337","0.0002","19.7246","0.0002","90","","90","","90","","16741.7","0.2","293","2","293","2","","","","","","","","8","I 41/a :2","-I 4ad","88","","","","- C32 H41 Cu2 Mo N2 O P2 S5 -","- C32 H41 Cu2 Mo N2 O P2 S5 -","- C512 H656 Cu32 Mo16 N32 O16 P32 S80 -","16","1","","Fun, Hoong-Kun; Li, Feng; Niu, Yunyin; Song, Yinglin; Xin, Xinquan; Zheng, Hegen","","New Journal of Chemistry","2001","","","","","10.1039/b102238p","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051128","12.374","0.002","10.334","0.002","9.428","0.002","90","","92.83","0.03","90","","1204.1","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","C6 H17 N O6 P2, H2 O","N-n-pentylaminomethane-1.1-diphosphonic acid","","- C6 H19 N O7 P2 -","- C6 H19 N O7 P2 -","- C24 H76 N4 O28 P8 -","4","1","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0731","0.0363","","","0.0596","0.0678","","","","","","0.885","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051129","7.167","0.001","7.535","0.001","10.052","0.002","98.14","0.01","99.1","0.01","99.59","0.01","520.6","0.15","100","2","100","2","","","","","","","","5","P -1","-P 1","2","C5 H13 N O6 P2, H2 O","N-pyrrolidinemethane-1,1-diphosphonic acid","","- C5 H15 N O7 P2 -","- C5 H15 N O7 P2 -","- C10 H30 N2 O14 P4 -","2","1","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0374","0.0341","","","0.0909","0.0928","","","","","","1.082","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051130","11.128","0.002","8.248","0.002","13.527","0.003","90","","101.97","0.03","90","","1214.6","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-(3-carboxy-2-pyridyl)aminomethane-1,1-diphosphonic acid","","- C7 H12 N2 O9 P2 -","- C7 H12 N2 O9 P2 -","- C28 H48 N8 O36 P8 -","4","1","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0685","0.0438","","","0.0925","0.0983","","","","","","1.082","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051131","7.313","0.001","15.94","0.003","9.421","0.002","90","","97.49","0.03","90","","1088.8","0.4","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","N-(5-methyl-2-pyridyl)aminomethane-1,1-diphosphonic acid","","- C7 H12 N2 O6 P2 -","- C7 H12 N2 O6 P2 -","- C28 H48 N8 O24 P8 -","4","2","","Ewa Matczak-Jon; Wanda Sawka-Dobrowolska; Paweł Kafarski; Veneta Videnova-Adrabińska","Molecular organization and solution properties of N-substituted aminomethane-1,1-diphosphonic acids","New J. Chem.","2001","25","11","1447","1457","10.1039/b102282m","","","0.71073","MoKα","","0.0909","0.089","","","0.2504","0.25","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051132","15.798","0.005","15.798","0.005","15.674","0.007","90","","90","","90","","3912","2","295","","295","","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C27 H24 Co N6 O S2 -","- C25 H20 Co0.25 N5 S -","- C100 H80 Co N20 S4 -","4","0.25","","De Munno, Giovanni; Francesca Cipriani; Donatella Armentano; Miguel Julve; Jose Antonio Real","Polycatenane systems from Co(II) and trans-1,2-bis(4-pyridyl)ethene [bpe]. Synthesis and structure of [Co(bpe)2(NCS)2].CH3OH, [Co(bpe)2(H2O)2](ClO4)2.2CH3OH and [Co(bpe)2(H2O)2(CH3OH)2](ClO4)2.bpe.H2O","New Journal of Chemistry","2001","","","","","","","","","","","","8.48","","","13.17","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051133","19.49","0.005","19.49","0.005","16.508","0.007","90","","90","","90","","6271","3","295","","295","","","","","","","","","6","I 41 c d","I 4bw -2c","110","","","","- C26 H32 Cl2 Co N4 O12 -","- C26 H32 Cl2 Co0.5 N4 O11 -","- C208 H256 Cl16 Co4 N32 O88 -","8","0.5","","De Munno, Giovanni; Francesca Cipriani; Donatella Armentano; Miguel Julve; Jose Antonio Real","Polycatenane systems from Co(II) and trans-1,2-bis(4-pyridyl)ethene [bpe]. Synthesis and structure of [Co(bpe)2(NCS)2].CH3OH, [Co(bpe)2(H2O)2](ClO4)2.2CH3OH and [Co(bpe)2(H2O)2(CH3OH)2](ClO4)2.bpe.H2O","New Journal of Chemistry","2001","","","","","","","","","","","","7.18","","","7.66","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051134","8.958","0.004","11.093","0.007","12.994","0.005","105.73","0.05","94.55","0.03","113.6","","1112.8","0.9","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H44 Cl2 Co N6 O13 -","- C40 H42 Co0.5 N6 O14 -","- C40 H42 Co0.5 N6 O14 -","1","0.5","","De Munno, Giovanni; Francesca Cipriani; Donatella Armentano; Miguel Julve; Jose Antonio Real","Polycatenane systems from Co(II) and trans-1,2-bis(4-pyridyl)ethene [bpe]. Synthesis and structure of [Co(bpe)2(NCS)2].CH3OH, [Co(bpe)2(H2O)2](ClO4)2.2CH3OH and [Co(bpe)2(H2O)2(CH3OH)2](ClO4)2.bpe.H2O","New Journal of Chemistry","2001","","","","","","","","","","","","7.22","","","11.98","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051135","7.729","0.008","10.712","0.002","13.985","0.004","90","","101.65","0.04","90","","1134","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H9 Cl N4 O Pd -","- C9 H9 Cl N4 O Pd -","- C36 H36 Cl4 N16 O4 Pd4 -","4","1","","José Elguero; Ana Guerrero; Felipe Gómez de la Torre; Antonio de la Hoz; Félix A. Jalón; Blanca R. Manzano; Ana Rodríguez","New complexes with pyrazole-containing ligands and different metallic centres. Comparative study of their fluxional behaviour involving M‒N bond rupture","New J. Chem.","2001","25","8","1050","1060","10.1039/b102318g","","","0.71073","MoKα","","0.0819","0.0435","","","0.1026","0.1199","","","","","","0.883","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051136","7.623","0.004","10.1347","0.0008","11.927","0.001","66.511","0.008","79.73","0.02","81.53","0.02","828.6","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H11 F3 N4 O3 Pd S -","- C12 H11 F3 N4 O3 Pd S -","- C24 H22 F6 N8 O6 Pd2 S2 -","2","1","","José Elguero; Ana Guerrero; Felipe Gómez de la Torre; Antonio de la Hoz; Félix A. Jalón; Blanca R. Manzano; Ana Rodríguez","New complexes with pyrazole-containing ligands and different metallic centres. Comparative study of their fluxional behaviour involving M‒N bond rupture","New J. Chem.","2001","25","8","1050","1060","10.1039/b102318g","","","0.7107","MoKα","","0.0768","0.0595","","","0.1762","0.2064","","","","","","1.011","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051137","10.075","0.001","9.034","0.002","22.973","0.007","90","","92.7","0.02","90","","2088.6","0.8","296","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H9 Co Mo O10 Ru S -","- C16 H9 Co Mo O10 Ru S -","- C64 H36 Co4 Mo4 O40 Ru4 S4 -","4","1","","Zhang Yu-hua; Yuan Jian-chao; Yin Yuan-qi; Zhou Zhong-yuan; Albert S. C. Chan","Synthesis and reactions of chiral clusters containing an SRuCoMo core","New J. Chem.","2001","25","7","939","944","10.1039/b102368n","","","0.71073","MoKα","","","0.03","","","0.042","","","","","1.23","1.23","","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7051138","7.67","0.003","22.001","0.01","13.392","0.006","90","","92.23","0.009","90","","2258.2","1.7","294","2","294","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H11 Co Mo O11 Ru S -","- C18 H11 Co Mo O11 Ru S -","- C72 H44 Co4 Mo4 O44 Ru4 S4 -","4","1","","Zhang Yu-hua; Yuan Jian-chao; Yin Yuan-qi; Zhou Zhong-yuan; Albert S. C. Chan","Synthesis and reactions of chiral clusters containing an SRuCoMo core","New J. Chem.","2001","25","7","939","944","10.1039/b102368n","","","0.71073","MoKα","","0.088","0.0594","","","0.1462","0.1659","","","","","","0.955","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051139","7.43","0.003","14.002","0.005","15.206","0.006","114.78","0.02","80.67","0.03","98.49","0.03","1411.7","1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H27 B Cu F4 N4 O P -","- C30 H27 B Cu F4 N4 O P -","- C60 H54 B2 Cu2 F8 N8 O2 P2 -","2","1","","Douce, Laurent; Charbonnière, Loïc; Cesario, Michèle; Ziessel, Raymond","Phosphine oxide functionalised with two bipyridine subunits: a novel ligand for the engineering of sterically hindered complexes","New Journal of Chemistry","2001","25","8","1024","","10.1039/b102520c","","","0.7107","MoKα","","0.1109","0.0683","","0.1953","","0.1668","","","1.033","","","1.112","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051140","10.3346","0.0003","10.5105","0.0003","17.3351","0.0004","90","","90","","90","","1882.97","0.09","173","0.1","173","0.1","","","","","","","","3","P n c a","-P 2a 2n","60","","","","- C23 H22 S2 -","- C23 H22 S2 -","- C92 H88 S8 -","4","0.5","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0434","0.0374","","","0.0979","0.1026","","","","","","1.057","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051141","10.9684","0.0007","10.2645","0.0006","16.6081","0.001","90","","91.0448","0.0031","90","","1869.5","0.2","173","0.1","173","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 S2 -","- C23 H22 S2 -","- C92 H88 S8 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0869","0.0633","","","0.1246","0.1311","","","","","","1.228","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051142","10.2631","0.0008","10.4883","0.0005","15.9213","0.0012","90","","90","","90","","1713.8","0.2","173","0.1","173","0.1","","","","","","","","2","P 21 n b","P -2bc 2a","33","","","","- C23 H22 -","- C23 H22 -","- C92 H88 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0494","0.0371","","","0.0657","0.0688","","","","","","1.085","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051143","9.669","0.0006","9.669","0.0006","18.4244","0.0009","90","","90","","90","","1722.49","0.17","173","0.1","173","0.1","","","","","","","","2","P 41","P 4w","76","","","","- C23 H22 -","- C23 H22 -","- C92 H88 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0486","0.0386","","","0.0785","0.0818","","","","","","1.08","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051144","11.7142","0.0006","13.7436","0.0005","13.8602","0.0006","90","","90","","90","","2231.43","0.17","173","0.1","173","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 Ag F3 O3 S -","- C24 H22 Ag F3 O3 S -","- C96 H88 Ag4 F12 O12 S4 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0588","0.0435","","","0.0633","0.0658","","","","","","1.095","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051145","10.8557","0.0003","55.1676","0.0018","15.8584","0.0004","90","","90.312","0.0012","90","","9497.2","0.5","173","0.1","173","0.1","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C99 H88 Ag4 F12 O13 S4 -","- C99 H88 Ag4 F12 O13 S4 -","- C396 H352 Ag16 F48 O52 S16 -","4","1","","Lahtinen, Tanja; Wegelius, Elina; Rissanen, Kari","Synthesis and X-ray structures of new concave π-prismand hydrocarbon [2.2.1]m,p,p- and [2.2.1]p,p,p-cyclophanes","New Journal of Chemistry","2001","25","7","905","","10.1039/b102725p","","","0.71073","MoKα","","0.0691","0.0618","","","0.1559","0.1617","","","","","","1.027","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051146","8.6112","0.0003","8.8243","0.0003","9.2589","0.0003","75.17","0.002","71.033","0.003","63.78","0.002","591.64","0.04","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H11 N S Se -","- C13 H11 N S Se -","- C26 H22 N2 S2 Se2 -","2","1","","Boryczka, Stanisław; Rozenberg, Mark S.; Schreurs, Antoine M. M.; Kroon, Jan; Starikov, Evgeni B.; Steiner, Thomas","A short C‒H···N hydrogen bond with a very strong IR spectroscopic effect","New Journal of Chemistry","2001","25","9","1111","","10.1039/b102727c","","","0.71073","MoKα","","0.0471","0.0407","","","0.1047","0.1089","","","","","","1.029","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051147","13.9348","0.0001","25.2744","0.0003","27.6186","0.0004","98.36","0.001","94.318","0.001","92.105","0.001","9585.21","0.19","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C90 H136 Fe7 Mo24 N18 O140 P16 -","- C90 H73 Fe7 Mo24 N18 O140 P16 -","- C180 H146 Fe14 Mo48 N36 O280 P32 -","2","1","","Chantapromma, S.; Fun, H. F.; Ibrahim, A. R.; You, X.; Zhang, Lijuan; Zhou, Y.","Synthesis and structure of two one-dimensional mixed-valence iron molybdophosphate matrices [Fe2(II)Fe2(III)Mo24(V)(H2PO4)8(HPO4)4(PO4)4O48(OH)12(H2O)4]6-(1) and [Fe(II)Fe(III)Mo12(V)(H2PO4)2(H2-XPO4)(H1+xPO4)(HPO4)2 (PO4)2O24(OH)6(H2O)2= ] (x == 0 ~1)]4- (2) in the presence of Fe(II)(2,2=A1=AF-bipyridine)3","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051148","13.5955","0.0002","19.1463","0.0001","21.4573","0.0003","95.668","0.001","91.353","0.001","99.809","0.001","5472.19","0.11","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H85 Fe4 Mo12 N12 O73 P8 -","- C60 H48 Fe4 Mo12 N12 O73 P8 -","- C120 H96 Fe8 Mo24 N24 O146 P16 -","2","1","","Chantapromma, S.; Fun, H. F.; Ibrahim, A. R.; You, X.; Zhang, Lijuan; Zhou, Y.","Synthesis and structure of two one-dimensional mixed-valence iron molybdophosphate matrices [Fe2(II)Fe2(III)Mo24(V)(H2PO4)8(HPO4)4(PO4)4O48(OH)12(H2O)4]6-(1) and [Fe(II)Fe(III)Mo12(V)(H2PO4)2(H2-XPO4)(H1+xPO4)(HPO4)2 (PO4)2O24(OH)6(H2O)2= ] (x == 0 ~1)]4- (2) in the presence of Fe(II)(2,2=A1=AF-bipyridine)3","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051149","14.5678","0.0004","21.2602","0.0001","7.8893","0.0002","90","","90","","90","","2443.43","0.09","293","2","293","2","","","","","","","","6","F m m 2","F 2 -2","42","","","","- Cd Cl0.75 H2.5 Na0.75 O6 P1.5 -","- Cd Cl0.75 H2.5 Na0.75 O6 P1.5 -","- Cd16 Cl12 H40 Na12 O96 P24 -","16","1","","Jayaraman, Krishnamoorthy; Choudhury, Amitava; Vaidhyanathan, Ramanathan; Rao, C. N. R.","A layered chlorophosphate, Na3[Cd4Cl3(HPO4)2(H2PO4)4], containing Na+ ions in the interlamellar space","New Journal of Chemistry","2001","25","9","1199","","10.1039/b103278j","","","0.71073","MoKα","","0.0216","0.0199","","0.045","0.0444","","","","1.027","1.037","1.037","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051150","9.417","0.003","11.007","0.003","12.204","0.002","90","","98.31","0.02","90","","1251","1","20","","20","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C24 H26 Ag F3 N2 O5 S -","- C48 H52 Ag2 F6 N4 O10 S2 -","- C48 H52 Ag2 F6 N4 O10 S2 -","","","","Ma, Shuang-Cheng; Wu, Shuang-Ding","Synthesis & Structure of Infinite Single Stranded Coordination Polymers of Optically Active Bis(oxazoline) Ligands With Ag Trifluoromethanesulfonate","New Journal of Chemistry","2001","","","","","","","","","","","","0.054","","","0.069","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051151","14.684","0.004","10.869","0.003","16.467","0.006","90","","109.14","0.02","90","","2483","1","20","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C46 H44 Ag2 F6 N4 O11 S2 -","- C88 H84 Ag4 F12 N8 O22 S4 -","- C88 H84 Ag4 F12 N8 O22 S4 -","","","","Ma, Shuang-Cheng; Wu, Shuang-Ding","Synthesis & Structure of Infinite Single Stranded Coordination Polymers of Optically Active Bis(oxazoline) Ligands With Ag Trifluoromethanesulfonate","New Journal of Chemistry","2001","","","","","","","","","","","","0.057","","","0.069","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051152","8.2101","0.0008","9.9396","0.001","10.6382","0.001","90","","90","","90","","868.13","0.15","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C2 H2 Br N3 -","- C2 H2 Br N3 -","- C16 H16 Br8 N24 -","8","1","","Claramunt, Rosa M.; Lopez, Concepcion; Garcia, M. Angeles; Otero, M. Dolores; Torres, M. Rosario; Pinilla, Elena; Alarcon, Sergio H.; AlKorta, Ibon; Elguero, Jose","The structure of halogeno-1,2,4-triazoles in the solid state and in solution.","New Journal of Chemistry","2001","","","","","10.1039/b103405g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051153","10.849","0.002","3.7618","0.0009","9.863","0.002","90","","90","","90","","402.5","0.16","296","2","296","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C2 H2 Cl N3 -","- C2 H2 Cl N3 -","- C8 H8 Cl4 N12 -","4","1","","Claramunt, Rosa M.; Lopez, Concepcion; Garcia, M. Angeles; Otero, M. Dolores; Torres, M. Rosario; Pinilla, Elena; Alarcon, Sergio H.; AlKorta, Ibon; Elguero, Jose","The structure of halogeno-1,2,4-triazoles in the solid state and in solution.","New Journal of Chemistry","2001","","","","","10.1039/b103405g","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051154","9.738","0.001","18.582","0.002","12.564","0.001","90","","98.84","0.02","90","","2246.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N O3 P2 S -","- C24 H21 N O3 P2 S -","- C96 H84 N4 O12 P8 S4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0933","0.0475","","","0.0907","0.1173","","","","","","1.235","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051155","9.745","0.002","18.799","0.004","12.423","0.002","90","","98.21","0.03","90","","2252.5","0.8","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 N O3 P2 Se -","- C24 H21 N O3 P2 Se -","- C96 H84 N4 O12 P8 Se4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.112","0.0571","","","0.1239","0.1714","","","","","","1.111","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051156","18.491","0.004","23.2","0.005","9.642","0.002","90","","98.59","0.03","90","","4089.9","1.5","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H25 N O3 P2 Se -","- C18 H25 N O3 P2 Se -","- C144 H200 N8 O24 P16 Se8 -","8","2","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0472","0.034","","","0.0857","0.0895","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051157","23.236","0.005","9.654","0.002","22.026","0.004","90","","108.97","0.03","90","","4672.5","1.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 N O2 P2 S Se -","- C24 H21 N O2 P2 S Se -","- C192 H168 N8 O16 P16 S8 Se8 -","8","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0492","0.0342","","","0.0939","0.1014","","","","","","1.015","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051158","23.166","0.005","9.633","0.002","22.06","0.004","90","","109.23","0.03","90","","4648.2","1.8","130","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H21 N O2 P2 S2 -","- C24 H21 N O2 P2 S2 -","- C192 H168 N8 O16 P16 S16 -","8","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.043","0.0332","","","0.0936","0.0993","","","","","","1.066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051159","8.494","0.002","9.173","0.002","13.751","0.003","97.97","0.03","104.38","0.03","92.35","0.03","1024.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H25 N O2 P2 S2 -","- C18 H25 N O2 P2 S2 -","- C36 H50 N2 O4 P4 S4 -","2","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.1081","0.0771","","","0.1908","0.2127","","","","","","1.089","","","","has coordinates,has disorder","180065","2020-10-21","18:00:00",""
"7051160","10.154","0.002","17.574","0.004","22.213","0.004","90","","90","","90","","3963.8","1.4","150","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H25 N P2 S2 -","- C18 H25 N P2 S2 -","- C144 H200 N8 P16 S16 -","8","2","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0324","0.0275","","","0.0737","0.0763","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051161","9.974","0.002","13.675","0.003","15.078","0.003","76.93","0.03","70.93","0.03","68.82","0.03","1798.7","0.8","120","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H16 N O3 P S -","- C19 H16 N O3 P S -","- C76 H64 N4 O12 P4 S4 -","4","2","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0523","0.0334","","","0.078","0.0817","","","","","","0.963","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051162","10.678","0.002","9.294","0.002","23.112","0.005","90","","99.24","0.03","90","","2263.9","0.8","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 N O3 P2 Pd0.5 S -","- C24 H20 N O3 P2 Pd0.5 S -","- C96 H80 N4 O12 P8 Pd2 S4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0315","0.0249","","","0.0638","0.065","","","","","","1.065","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051163","11.605","0.002","12.181","0.002","15.93","0.003","110.77","0.03","91.19","0.03","106.59","0.03","1999.1","0.9","130","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H48 N2 O6 P4 Pd S2 -","- C36 H48 N2 O6 P4 Pd S2 -","- C72 H96 N4 O12 P8 Pd2 S4 -","2","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.1212","0.0422","","","0.103","0.122","","","","","","0.982","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051164","10.698","0.002","10.89","0.002","11.22","0.002","108.78","0.03","105.07","0.03","95.4","0.03","1172.2","0.5","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H20 N O2 P2 Pd0.5 S2 -","- C24 H20 N O2 P2 Pd0.5 S2 -","- C48 H40 N2 O4 P4 Pd S4 -","2","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0641","0.0448","","","0.1172","0.1255","","","","","","1.012","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051165","10.829","0.002","22.4","0.004","10.007","0.002","90","","98.22","0.03","90","","2402.5","0.8","130","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C24 H21 N O5 P2 S -","- C24 H21 N O5 P2 S -","- C96 H84 N4 O20 P8 S4 -","4","1","","Marek Necas; Mark R. St J. Foreman; Jaromír Marek; J. Derek Woollins; Josef Novosad","New mixed-donor unsymmetrical P‒N‒P ligands and their palladium(II) complexes","New J. Chem.","2001","25","10","1256","1263","10.1039/b103501k","","","0.71073","MoKα","","0.0441","0.0332","","","0.0853","0.089","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051166","8.776","0.011","10.233","0.016","18.853","0.024","90","","90","","90","","1693","4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","13-isopropyl-7-oxo-podocarpe-5,8,11,13-tetraen-4,6-carbolactone 12","","- C20 H22 O3 -","- C20 H22 O3 -","- C80 H88 O12 -","4","1","","Silvia M. C. S. Monteiro; Armando J. D. Silvestre; Artur M. S. Silva; José A. S. Cavaleiro; Vitor Félix; Michael G. B. Drew","Synthesis and structural characterisation of ring B oxidised derivatives of dehydroabietic acid","New J. Chem.","2001","25","8","1091","1097","10.1039/b103737b","","","0.71073","MoKα","","0.1163","0.0828","","","0.2126","0.2296","","","","","","1.155","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051167","7.3831","0.0007","8.2193","0.0008","9.7902","0.0009","90","","100.292","0.002","90","","584.55","0.1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 N2 -","- C12 H16 N2 -","- C24 H32 N4 -","2","0.5","","Yu-Lin Lam; Ming Wah Wong; Hsing Hua Huang; Eping Liang","Conformational Analysis of Meso- and (±)- 2,3-Dicyano-2,3-Dicyclopropylbutane and 1,2-Dicyanotetracyclopropylethane","New Journal of Chemistry","2001","","","","","10.1039/b103740b","","","","","","","0.0599","","","0.1817","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051168","7.0406","0.0003","14.7756","0.0004","6.9714","0.0003","90","","104.185","0.001","90","","703.12","0.05","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 N2 -","- C16 H20 N2 -","- C32 H40 N4 -","2","0.5","","Yu-Lin Lam; Ming Wah Wong; Hsing Hua Huang; Eping Liang","Conformational Analysis of Meso- and (±)- 2,3-Dicyano-2,3-Dicyclopropylbutane and 1,2-Dicyanotetracyclopropylethane","New Journal of Chemistry","2001","","","","","10.1039/b103740b","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051169","11.197","0.005","12.256","0.005","16.462","0.005","83.37","0.005","80.06","0.005","67.75","0.005","2056.4","1.4","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C51 H53 Fe P Si2 -","- C45 H41 Fe P Si2 -","- C90 H82 Fe2 P2 Si4 -","2","1","","Welfele Sebastien; Mezailles Nicolas; Maigrot Nicole; Ricard Louis; Mathey Francois; Le Floch Pascla","Synthesis, reactivity and X-Ray crystal structure of a free 1-phospha- barrelene: application to the synthesis of 1,1'-Bis(dimethylsilyl- phosphinine)ferrocene.","New Journal of Chemistry","2001","","","","","10.1039/b103779j","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051170","8.774","0.0005","9.479","0.0005","10.851","0.0007","80.211","0.002","82.197","0.002","67.03","0.003","816.41","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C15 H29 N4 -","- C15 H29 N4 -","- C30 H58 N8 -","2","1","","Chuburu, F.; Handel, H.; Le Baccon, M.","Bis-aminals: efficient tools for bis-macrocycles synthesis","New Journal of Chemistry","2001","","","","","10.1039/b103995b","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051171","8.162","0.001","14.249","0.001","13.862","0.001","90","","94.77","0.02","90","","1606.6","0.3","295","1","295","1","","","","","","","ethanolic synthesis","5","C 1 2/c 1","-C 2yc","15","","bis(pyridinium) tetrabromocuprate(II)","","- C10 H12 Br4 Cu N2 -","- C10 H12 Br4 Cu N2 -","- C40 H48 Br16 Cu4 N8 -","4","0.5","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.071","0.043","","0.097","","0.05","","","1.43","","","1.19","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051172","18.789","0.003","8.744","0.002","15.518","0.003","90","","135.15","0.03","90","","1798","1.1","295","1","295","1","","","","","","","ethanolic synthesis","5","C 1 2/c 1","-C 2yc","15","","bis(2-methylpyridinium) tetrabromocuprate(II)","","- C12 H16 Br4 Cu N2 -","- C12 H16 Br4 Cu N2 -","- C48 H64 Br16 Cu4 N8 -","4","0.5","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.071","0.042","","0.101","","0.045","","","1.48","","","1.11","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051173","9.165","0.001","13.592","0.002","14.404","0.003","90","","102.41","0.02","90","","1752.4","0.5","295","1","295","1","","","","","","","ethanolic synthesis","5","P 1 21/n 1","-P 2yn","14","","bis(3-methylpyridinium) tetrabromocuprate(II)","","- C12 H16 Br4 Cu N2 -","- C12 H16 Br4 Cu N2 -","- C48 H64 Br16 Cu4 N8 -","4","1","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.081","0.04","","0.077","","0.04","","","1.43","","","1.16","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051174","8.483","0.002","9.399","0.002","13.227","0.002","96.29","0.03","91.29","0.03","116.41","0.02","935.8","0.4","295","1","295","1","","","","","","","ethanolic synthesis","5","P -1","-P 1","2","","bis(4-methylpyridinium) tetrabromocuprate(II)","","- C12 H16 Br4 Cu N2 -","- C12 H16 Br4 Cu N2 -","- C24 H32 Br8 Cu2 N4 -","2","1","","Luque, Antonio; Sertucha, Jon; Castillo, Oscar; Román, Pascual","Crystal packing and physical properties of pyridinium tetrabromocuprate(II) complexes assembled via hydrogen bonds and aromatic stacking interactions","New Journal of Chemistry","2001","25","9","1208","","10.1039/b104085p","","","0.71069","MoKα","","0.087","0.045","","0.101","","0.045","","","1.54","","","1.2","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051175","13.0469","0.0014","14.126","0.0016","14.2105","0.0016","90","","91.11","0.002","90","","2618.5","0.5","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C12 H42 Co10 N8 O43 P10 -","- C12 H48 Co10 N8 O43 P10 -","- C24 H96 Co20 N16 O86 P20 -","2","1","","Yanxiong Ke; Gaofei He; Jianmin Li; Yugen Zhang; Sheming Lu","A new mixed divalent metal phosphate with zeolite thomsonite framework topology","New J. Chem.","2001","25","12","1627","1630","10.1039/b104331p","","","0.71073","MoKα","","0.0496","0.043","","","0.1017","0.1038","","","","","","1","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051176","9.2002","0.0011","13.4712","0.0016","13.7964","0.0016","90","","97.574","0.003","90","","1695","0.3","566","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H29 Cr N3 O8 P -","- C38 H29 Cr N3 O8 P -","- C76 H58 Cr2 N6 O16 P2 -","2","1","","R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano","","New Journal of Chemistry","2001","","","","","10.1039/b104469a","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051177","9.2221","0.0005","13.471","0.003","13.8725","0.0017","90","","97.418","0.007","90","","1709","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C38 H29 As Cr N3 O8 -","- C38 H29 As Cr N3 O8 -","- C76 H58 As2 Cr2 N6 O16 -","2","1","","R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano","","New Journal of Chemistry","2001","","","","","10.1039/b104469a","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051178","9.2942","0.0016","11.38","0.003","14.292","0.003","93.78","0.02","95.838","0.014","111.39","0.02","1391.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H27 Cr N6 O12 -","- C24 H18 Cr N6 O12 -","- C48 H36 Cr2 N12 O24 -","2","1","","R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano","","New Journal of Chemistry","2001","","","","","10.1039/b104469a","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051179","21.999","0.008","16.248","0.004","17.111","0.004","90","","110.18","0.03","90","","5741","3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H30 Cr N6 O11 -","- C27 H30 Cr N6 O11 -","- C216 H240 Cr8 N48 O88 -","8","1","","R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano","","New Journal of Chemistry","2001","","","","","10.1039/b104469a","","","","","","","","","","","","","","","","","","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051180","9.4572","0.0019","12.095","0.002","17.85","0.004","99.95","0.03","99.57","0.03","104.87","0.03","1895.5","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H34 Cr2 N6 O24 Sr -","- C28 Cr2 N6 O24 Sr -","- C56 Cr4 N12 O48 Sr2 -","2","1","","R. Lescouezec; G. Marinescu; M. C. Munoz; D. Luneau; M. Andruh; F. Lloret; J. Faus; M. Julve; J. A. Mata; R. Llusar; J. Cano","","New Journal of Chemistry","2001","","","","","10.1039/b104469a","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051181","9.497","0.006","9.41","0.002","18.232","0.008","90","","100.01","0.03","90","","1604.5","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H21 Cu N5 O4 -","- C13 H21 Cu N5 O4 -","- C52 H84 Cu4 N20 O16 -","4","1","","Sarathi Mukherjee, Partha; Dalai, Sudipta; Mostafa, Golam; Lu, Tian-Huey; Rentschler, Eva; Ray Chaudhuri, Nirmalendu","Synthesis, crystal structure, and magnetic properties of two new Cu(II) complexes with end-to-end azido bridging ligands","New Journal of Chemistry","2001","25","9","1203","","10.1039/b104596m","","","0.71069","MoKα","","0.1381","0.0422","","","0.1128","0.1857","","","","","","1.009","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051182","9.0852","0.001","16.2398","0.0018","10.8913","0.0012","90","","96.881","0.002","90","","1595.3","0.3","294","2","294","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H17 Cl Cu N6 O4 -","- C11 H17 Cl Cu N6 O4 -","- C44 H68 Cl4 Cu4 N24 O16 -","4","1","","Sarathi Mukherjee, Partha; Dalai, Sudipta; Mostafa, Golam; Lu, Tian-Huey; Rentschler, Eva; Ray Chaudhuri, Nirmalendu","Synthesis, crystal structure, and magnetic properties of two new Cu(II) complexes with end-to-end azido bridging ligands","New Journal of Chemistry","2001","25","9","1203","","10.1039/b104596m","","","0.71073","MoKα","","0.0666","0.0434","","","0.1089","0.1161","","","","","","1.068","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051183","6.9395","0.0014","7.6083","0.0015","12.502","0.003","104.45","0.03","93.03","0.03","95.46","0.03","634.3","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","(CN)EDT-TTF","4-cyano-4',5'-ethylendithio-tetrathiafulvalene","","- C9 H5 N S6 -","- C9 H5 N S6 -","- C18 H10 N2 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0828","0.0559","","","0.1283","0.134","","","","","","1.274","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051184","7.9359","0.0016","9.4229","0.0019","11.957","0.002","99.04","0.03","94.56","0.03","103.7","0.03","851.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTF-CN), (I3)","Bis (3-cyano -3',4'-ethylenedithiotetrathiafulvalene, triiodide)","","- C9 H5 I3 N S6 -","- C9 H5 I3 N S6 -","- C18 H10 I6 N2 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0538","0.0254","","","0.045","0.0505","","","","","","0.718","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051185","8.0545","0.0016","8.0611","0.0016","23.587","0.005","86.78","0.03","86.82","0.03","76.11","0.03","1482.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(EDT-TTF-CN)2, (I3)","Bis(3-cyano -3',4'-ethylenedithiotetrathiafulvalene), triiodide","","- C18 H10 I3 N2 S12 -","- C18 I3 N2 S12 -","- C36 I6 N4 S24 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0814","0.0359","","","0.1058","0.1326","","","","","","0.697","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051186","6.399","0.0013","28.687","0.006","11.222","0.002","90","","106.13","0.03","90","","1978.9","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(EDT-TTF-CN), InBr4","3-cyano -3',4'-ethylenedithiotetrathiafulvalene, tetrabromoindate (III)","","- C9 H5 Br4 In N S6 -","- C9 H5 Br4 In N S6 -","- C36 H20 Br16 In4 N4 S24 -","4","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0508","0.0276","","","0.0577","0.0611","","","","","","0.771","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051187","6.293","0.0013","28.506","0.006","11.126","0.002","90","","106.52","0.03","90","","1913.5","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","EDT-TTF-CN, FeBr4","3-cyano -3',4'-ethylenedithiotetrathiafulvalene, tetrabromoferrate (III)","","- C9 H5 Br4 Fe N S6 -","- C9 H5 Br4 Fe N S6 -","- C36 H20 Br16 Fe4 N4 S24 -","4","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.1397","0.0486","","","0.0938","0.1043","","","","","","1.637","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051188","7.7596","0.0016","8.325","0.0017","16.245","0.003","93.98","0.03","93.63","0.03","114.98","0.03","944","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","EDT-TTF-CN, AuBr4","3-cyano -3',4'-ethylenedithiotetrathiafulvalene, tetrabromoaurate (III)","","- C9 H5 Au Br4 N S6 -","- C9 H Au Br4 N S6 -","- C18 H2 Au2 Br8 N2 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0648","0.0445","","","0.1089","0.1139","","","","","","0.931","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051189","10.191","0.002","11.443","0.002","13.372","0.003","102.05","0.03","103.82","0.03","93.63","0.03","1470.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(EDT-TTF-CN)2, Mo6Br14, (CH3CN)4","Bis (3-cyano -3',4'-ethylenedithiotetrathiafulvalene), hexabromo-octa-mu3-bromohexamolybdate (II), acetonitrile solvate","","- C26 H22 Br14 Mo6 N6 S12 -","- C26 H14 Br14 Mo6 N6 S12 -","- C26 H14 Br14 Mo6 N6 S12 -","1","0.5","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.0655","0.0273","","","0.0453","0.0511","","","","","","0.709","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051190","9.9799","0.001","11.3713","0.001","13.3427","0.001","101.938","0.01","104.094","0.01","93.366","0.01","1427.3","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","(EDT-TTF-CN)2, Mo6Cl8Br6, (CH3CN)4","Bis (3-cyano -3',4'-ethylenedithiotetrathiafulvalene), hexabromo-octa-mu3-chlorohexamolybdate (II), acetonitrile solvate","","- C13 H11 Br3 Cl4 Mo3 N3 S6 -","- C13 H7 Br3 Cl4 Mo3 N3 S6 -","- C26 H14 Br6 Cl8 Mo6 N6 S12 -","2","1","","Thomas Devic; Josep N. Bertran; Benoît Domercq; Enric Canadell; Narcis Avarvari; Pascale Auban-Senzier; Marc Fourmigué","Cation radical salts of cyano(ethylenedithio)tetrathiafulvalene with halogenated anions: annihilation of the CN···Hal interaction and stabilisation of conducting, antiferromagnetic square or chain-type salts","New J. Chem.","2001","25","11","1418","1424","10.1039/b104640n","","","0.71073","MoKα","","0.1705","0.0622","","","0.1788","0.2044","","","","","","1.163","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051191","12.602","0.002","10.201","0.003","23.118","0.006","90","","94.37","0.02","90","","2963.3","1.1","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C18 H16 N2 O -","- C18 H16 N2 O -","- C144 H128 N16 O8 -","8","2","","Bagieu Beucher, M.; George, S.; Masse, R.; Muthuraman, M.; Nangia, A.; Nicoud, Jean-Francois","Crystal Engineering of Neutral N-Aryl Pyrimidinones and their HCl, HNO3 Adducts With C-H...O Supramolecular Synthon. Implications Towards Non-Linear Optics","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051192","22.273","0.0011","23.3463","0.0012","7.1583","0.0002","90","","93.96","0.003","90","","3713.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H64 Cu2 N24 O4 -","- C56 H64 Cu2 N24 O4.008 -","- C112 H128 Cu4 N48 O8.016 -","2","0.25","","Iwayan Dasna; Stéphane Golhen; Lahcène Ouahab; Nathalie Daro; Jean-Pascal Sutter","Synthesis, X-ray crystal structures and magnetic properties of CuII and MnII complexes containing imino nitroxide radicals and a dicyanamide anion","New J. Chem.","2001","25","12","1572","1576","10.1039/b104773f","","","0.71073","MoKα","","0.0805","0.0594","","","0.1931","0.2081","","","","","","1.056","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051193","7.1089","0.0002","9.9495","0.0003","13.2518","0.0006","69.3961","0.0014","88.9996","0.0014","71.461","0.002","827.1","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H36 Mn N12 O4 -","- C28 H32 Mn N12 O4.07 -","- C28 H32 Mn N12 O4.07 -","1","0.5","","Iwayan Dasna; Stéphane Golhen; Lahcène Ouahab; Nathalie Daro; Jean-Pascal Sutter","Synthesis, X-ray crystal structures and magnetic properties of CuII and MnII complexes containing imino nitroxide radicals and a dicyanamide anion","New J. Chem.","2001","25","12","1572","1576","10.1039/b104773f","","","0.71073","MoKα","","0.0672","0.0462","","","0.1201","0.1378","","","","","","1.029","","","","has coordinates","180065","2020-10-21","18:00:00",""
"7051194","10.724","0.001","11.0215","0.0006","12.758","0.001","73.832","0.005","73.892","0.004","71.608","0.004","1344.24","0.18","296","1","296","1","","","","","","","","9","P -1","-P 1","2","","","","- C50 H40 Cl6 Fe2 N2 Ni O4 P2 S2 -","- C50 H40 Cl6 Fe2 N2 Ni O4 P2 S2 -","- C50 H40 Cl6 Fe2 N2 Ni O4 P2 S2 -","1","0.5","","Pinkas, Jiří; Bastl, Zdeněk; Šlouf, Miroslav; Podlaha, Jaroslav; Štěpnička, Petr","Preparation and solid-state characterization of nickel(II) complexes with 1'-(diphenylphosphino)ferrocenecarboxylic acid","New Journal of Chemistry","2001","25","9","1215","","10.1039/b104780a","","","0.71073","MoKα","","0.1196","0.0679","","","0.1645","0.192","","","","","","1.05","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7051195","13.272","0.003","15.701","0.003","16.934","0.003","107","0.03","110.32","0.03","98.76","0.03","3035.2","1.6","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C63 H86 Cl F6 O4 P3 Ru -","- C63 H86 Cl F6 O4 P3 Ru -","- C126 H172 Cl2 F12 O8 P6 Ru2 -","2","1","","Jung, Stefan; Brandt, Carsten D.; Werner, Helmut","A cationic allenylideneruthenium(II) complex with two bulky hemilabile phosphine ligands","New Journal of Chemistry","2001","25","9","1101","","10.1039/b104787f","","","0.71073","MoKα","","0.091","0.0484","","","0.1093","0.1248","","","","","","0.87","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7051196","8.669","0.0002","15.7588","0.0003","11.4462","0.0002","90","","102.089","0.0011","90","","1529.02","0.05","200","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C17 H25 N O -","- C17 H25 N O -","- C68 H100 N4 O4 -","4","1","","Banwell, M.; Bray, Andrew W.; Edwards, Alison J.; Wong, David J.","Total synthesis of the putative structure of the marine alkaloid haliclorensin","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051197","13.1254","0.0002","48.0683","0.0007","12.8677","0.0002","90","","90","","90","","8118.4","0.2","110","2","110","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C82 H74 Cl5 Cu3 N9 O21 -","- C82 H74 Cl5 Cu3 N9 O21 -","- C328 H296 Cl20 Cu12 N36 O84 -","4","1","","Patra, Goutam K.; Goldberg, Israel; Chowdhury, Sanjoy K.; Maiti, Bikas C.; Sarkar, Amitabha; Bangal, Prakriti R.; Chakravorti, Sankar; Chattopadhyay, Nitin; Tocher, Derek A.; Drew, Michael G. B.; Mostafa, Golam; Chowdhury, Shubhamoy; Datta, Dipankar","A new photoluminescent CuI2N6 chromophore","New Journal of Chemistry","2001","25","11","1371","","10.1039/b105442m","","","0.7107","MoKα","","0.0878","0.0514","","","0.1123","0.1283","","","","","","1.022","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051198","16.6277","0.0016","8.2069","0.0007","15.1464","0.0016","90","","116.113","0.011","90","","1855.9","0.4","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 N2 O2 -","- C23 H22 N2 O2 -","- C92 H88 N8 O8 -","4","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.059","0.0403","","","0.0932","0.1023","","","","","","1.01","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051199","27.659","0.003","8.4635","0.0011","16.5591","0.0017","90","","100.371","0.012","90","","3813","0.8","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H22 N2 O2 -","- C23 H22 N2 O2 -","- C184 H176 N16 O16 -","8","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.1192","0.0471","","","0.1156","0.1527","","","","","","0.94","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051200","13.45","0.003","20.456","0.004","7.667","0.002","90","","96.61","0.03","90","","2095.4","0.8","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 N2 O2 -","- C27 H24 N2 O2 -","- C108 H96 N8 O8 -","4","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.1302","0.0603","","","0.1441","0.1799","","","","","","0.902","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051201","10.3622","0.0009","15.331","0.0015","13.5407","0.0012","90","","103.856","0.01","90","","2088.5","0.3","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H23 N3 O4 -","- C24 H23 N3 O4 -","- C96 H92 N12 O16 -","4","1","","Uznanski, Pawel; Amiens, Catherine; Donnadieu, Bruno; Coppel, Yannick; Chaudret, Bruno","Oxidation of photochromic spirooxazines by coinage metal cations. Part I. Reaction with AgNO3: formation and characterisation of silver particles","New Journal of Chemistry","2001","25","12","1486","1494","10.1039/b105446p","","","0.71073","MoKα","","0.0523","0.0399","","","0.1011","0.1088","","","","","","1.018","","","","has coordinates","275230","2022-05-08","23:08:07",""
"7051202","12.5891","0.0016","13.6746","0.0015","14.2577","0.0018","114.178","0.013","97.965","0.015","98.965","0.014","2155.3","0.6","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H18 Au Cl3 N O -","- C22 H18 Au Cl3 N2 O -","- C88 H72 Au4 Cl12 N8 O4 -","4","2","","Pawel Uznanski; Catherine Amiens; Manuel Bardaji; Bruno Donnadieu; Yannick Coppel; Bruno Chaudret; Antonio Laguna","Oxidation of photochromic spirooxazines by coinage metal cations. Part II. Oxidation by gold(III) compounds and synthesis of gold colloids","New J. Chem.","2001","25","12","1495","1499","10.1039/b105447n","","","0.71073","MoKα","","0.0777","0.0364","","","0.0648","0.0737","","","","","","0.873","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051203","6.81","0.001","18.326","0.001","7.39","0.001","90","","100.35","0.01","90","","907.27","0.19","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","perfluoronaphthalene anthracene complex (1:1)","","- C24 H10 F8 -","- C24 H10 F8 -","- C48 H20 F16 -","2","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","0.0953","0.0401","","","0.0741","0.086","","","","","","0.932","","","","has coordinates","219075","2020-10-21","18:00:00",""
"7051204","6.776","0.002","18.18","0.006","7.666","0.003","90","","102.45","0.01","90","","922.1","0.5","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","perfluoronaphthalene phenanthrene complex (1:1)","","- C24 H10 F8 -","- C24 H10 F8 -","- C48 H20 F16 -","2","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","0.1003","0.0492","","","0.1095","0.1302","","","","","","1.011","","","","has coordinates","219075","2020-10-21","18:00:00",""
"7051205","6.725","0.001","8.864","0.001","9.488","0.001","107.51","0.01","105.23","0.01","106.82","0.01","476.9","0.12","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","perfluoronaphthalene pyrene complex (1:1)","","- C26 H10 F8 -","- C26 H10 F8 -","- C26 H10 F8 -","1","0.5","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","0.0771","0.0442","","","0.1017","0.1153","","","","","","1.014","","","","has coordinates","219075","2020-10-21","18:00:00",""
"7051206","7.132","0.004","10.122","0.002","14.614","0.005","90","","102.22","0.02","90","","1031.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H14 N8 Ni -","- C5 H14 N8 Ni -","- C20 H56 N32 Ni4 -","4","1","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia","Synthesis of N3−/SCN− bridged polynuclear complexes of nickel(II) using N,N,N'-trimethylethane-1,2-diamine as a blocking ligand: low temperature magnetic study and single crystal structure of [Ni(μ1,1-N3)(μ1,3-N3)(N,N,N'-Me3en)]n","New J. Chem.","2001","25","12","1577","1582","10.1039/b105770g","","","0.71069","MoKα","","0.1373","0.0504","","0.1395","0.1008","","","","1.005","1.07","1.07","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051207","12.698","0.002","10.1097","0.0014","15.698","0.005","90","","90","","90","","2015.2","0.8","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C10 H28 F6 N5 Ni O2 P -","- C10 H28 F6 N5 Ni O2 P -","- C40 H112 F24 N20 Ni4 O8 P4 -","4","1","","Montserrat Monfort; Inmaculada Resino; Joan Ribas; Xavier Solans; Mercé Font-Bardia","Synthesis of N3−/SCN− bridged polynuclear complexes of nickel(II) using N,N,N'-trimethylethane-1,2-diamine as a blocking ligand: low temperature magnetic study and single crystal structure of [Ni(μ1,1-N3)(μ1,3-N3)(N,N,N'-Me3en)]n","New J. Chem.","2001","25","12","1577","1582","10.1039/b105770g","","","0.71069","MoKα","","0.0434","0.0372","","0.1184","0.0945","","","","1.057","1.078","1.078","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051208","12.8728","0.0011","15.8948","0.0012","18.2031","0.0014","90","","90","","90","","3724.5","0.5","153","2","153","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H54 Cu F6 N2 O3 P -","- C36 H54 Cu F6 N2 O3 P -","- C144 H216 Cu4 F24 N8 O12 P4 -","4","1","","Fraysse, Sandrine; von Zelewsky, Alex; Stoeckli-Evans, Helen","A stable chiral diolefin complex of CuI with predetermined configuration at the metal centre","New Journal of Chemistry","2001","25","11","1374","","10.1039/b105870n","","","0.71073","MoKα","","0.1819","0.0567","","","0.0816","0.1123","","","","","","0.65","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051209","8.213","0.0004","9.912","0.0004","11.531","0.0005","98.303","0.002","94.06","0.003","96.414","0.002","919.44","0.07","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,3,7-Triphenylcyclopenta[c]pyran","","- C26 H18 O -","- C26 H18 O -","- C52 H36 O2 -","2","1","","Banciu, Mircea D.; Castellano, Eduardo E.; Ellena, Javier; Haiduc, Ionel; Draghici, Constantin; Balaban, Alexandru T.","Serendipitous, one-pot formation of 2,3,7-triphenylcyclopenta[c]pyran from 1,2-diphenylethanedione (“benzil”) and cyclopentadiene","New Journal of Chemistry","2001","25","11","1472","","10.1039/b105878a","","x-ray","0.7107","MoKα","","0.0671","0.0471","","","0.125","0.1548","","","","","","1.113","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051210","20.72","0.02","19.67","0.03","12.796","0.015","90","","101.478","0.01","90","","5111","11","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C91 H118 Cl6 O16 S8 -","- C91 H104 Cl6 O16 S8 -","- C182 H208 Cl12 O32 S16 -","2","0.25","","Matthews, Susan E.; Felix, Vitor; Drew, Michael G. B.; Beer, Paul D.","Thiacalix[4]tube: synthesis, X-ray crystal structure and preliminary binding studies Electronic supplementary information (ESI) available: full experimental details, including synthesis and characterisation of 4 and 5, and the crystallographic study of 6. See http://www.rsc.org/suppdata/nj/b1/b106094p/","New Journal of Chemistry","2001","25","11","1355","","10.1039/b106094p","","","0.71073","MoKα","","0.2254","0.1054","","","0.2868","0.3628","","","","","","0.921","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051211","10.145","0.004","10.82","0.004","16.051","0.009","90","","96.949","0.005","90","","1749","1.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H25 N4 -","- C19 H25 N4 -","- C76 H100 N16 -","4","1","","Olivier Maury; Jean-Paul Guégan; Thierry Renouard; Adam Hilton; Philippe Dupau; Nicolas Sandon; Loïc Toupet; Hubert Le Bozec","Design and synthesis of 4,4'-π-conjugated[2,2']-bipyridines: a versatile class of tunable chromophores and fluorophores","New J. Chem.","2001","25","12","1553","1566","10.1039/b106096c","","","0.71069","MoKα","","0.1568","0.0521","","","0.1378","0.1732","","","","","","0.946","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051212","11.915","0.003","12.05","0.004","13.544","0.002","105.67","0.02","99.141","0.01","93.4","0.02","1837.8","0.8","293","2","293","2","","","","","","","","3","P 1","P 1","1","","","","- C84 H108 N8 -","- C83 H106 N8 -","- C83 H106 N8 -","1","1","","Olivier Maury; Jean-Paul Guégan; Thierry Renouard; Adam Hilton; Philippe Dupau; Nicolas Sandon; Loïc Toupet; Hubert Le Bozec","Design and synthesis of 4,4'-π-conjugated[2,2']-bipyridines: a versatile class of tunable chromophores and fluorophores","New J. Chem.","2001","25","12","1553","1566","10.1039/b106096c","","","0.71069","MoKα","","0.2044","0.0776","","","0.2287","0.3179","","","","","","0.928","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051213","7.309","0.003","7.698","0.005","25.101","0.007","90","","92.13","0.02","90","","1411.3","1.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N3 -","- C16 H18 N3 -","- C64 H72 N12 -","4","1","","Olivier Maury; Jean-Paul Guégan; Thierry Renouard; Adam Hilton; Philippe Dupau; Nicolas Sandon; Loïc Toupet; Hubert Le Bozec","Design and synthesis of 4,4'-π-conjugated[2,2']-bipyridines: a versatile class of tunable chromophores and fluorophores","New J. Chem.","2001","25","12","1553","1566","10.1039/b106096c","","","0.71069","MoKα","","0.2724","0.0633","","","0.1429","0.2056","","","","","","0.896","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051214","7.2313","0.0012","8.9917","0.0015","9.4175","0.0016","84.667","0.003","81.705","0.003","73.315","0.003","579.57","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 Br Cu N2 -","- C12 H8 Br Cu N2 -","- C24 H16 Br2 Cu2 N4 -","2","1","","Bosch, Eric; Barnes, Charles L.","Crystal structure of kinetic and thermodynamic coordination networks formed between 3,3′-dipyridylethyne and copper bromide","New Journal of Chemistry","2001","25","11","1376","","10.1039/b106221m","","","0.71073","MoKα","","0.0566","0.0462","","","0.1178","0.1246","","","","","","1.032","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051215","8.582","0.0007","17.6497","0.0013","7.3216","0.0006","90","","91.72","0.002","90","","1108.5","0.15","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Br Cu N2 -","- C12 H8 Br Cu N2 -","- C48 H32 Br4 Cu4 N8 -","4","1","","Bosch, Eric; Barnes, Charles L.","Crystal structure of kinetic and thermodynamic coordination networks formed between 3,3′-dipyridylethyne and copper bromide","New Journal of Chemistry","2001","25","11","1376","","10.1039/b106221m","","","0.71073","MoKα","","0.0527","0.0342","","","0.0785","0.085","","","","","","1.056","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7051216","8.157","0.004","19.586","0.011","7.404","0.002","90","","92.8","0.03","90","","1181.5","0.9","298","2","298","2","","","","","","","see Experimental","5","P 1 21/c 1","-P 2ybc","14","Silver Assembly","","","- C12 H8.5 Ag1.5 N2 O4 -","- C12 H8.5 Ag1.5 N2 O4 -","- C48 H34 Ag6 N8 O16 -","4","1","","Briccyle Cova; Alexander Briceño; Reinaldo Atencio","An unusual harmonisation of metal-based assemblies to achieve a mesoporous solid. Synthesis and crystal structure of a new silver(I) isonicotinate array","New J. Chem.","2001","25","12","1516","1519","10.1039/b106297m","","","0.71069","MoKα","","0.0215","0.0203","","0.0527","0.052","","","","1.184","1.195","1.195","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051217","8.9097","0.0006","16.3759","0.0011","16.7141","0.0011","90","","94.071","0.001","90","","2432.5","0.3","110","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,6-bis(pyridine)-1,6-diethyl-2,5,7,10-tetramesityl -1,6-diala-2,5,7,10-tetraaza-cylodecane","","","- C54 H72 Al2 N6 -","- C54 H72 Al2 N6 -","- C108 H144 Al4 N12 -","2","0.5","","Gabbai, François; Gardinier, James R.","Reaction of N,N'-bis(mesityl)ethylenediamine with triethylaluminum. Formation of ten-membered aluminum amide heterocycles","New Journal of Chemistry","2001","","","","","10.1039/b106488f","","","","","","","","","","","","","","","","","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051218","8.5899","0.0005","17.0806","0.0009","16.3606","0.0009","90","","95.131","0.001","90","","2390.8","0.2","110","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1,6-bis(tetrahydrofuran)-1,6-diethyl-2,5,7,10- tetramesityl-1,6-diala-2,5,7,10-tetraaza-cylodecane","","","- C52 H78 Al2 N4 O2 -","- C52 H78 Al2 N4 O2 -","- C104 H156 Al4 N8 O4 -","2","0.5","","Gabbai, François; Gardinier, James R.","Reaction of N,N'-bis(mesityl)ethylenediamine with triethylaluminum. Formation of ten-membered aluminum amide heterocycles","New Journal of Chemistry","2001","","","","","10.1039/b106488f","","","","","","","","","","","","","","","","","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051219","13.0362","0.0006","8.7731","0.0004","16.834","0.0006","90","","107.289","0.002","90","","1838.28","0.14","200","","200","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Cd(L2)2(MeOH)2](ClO4)2","","- C32 H40 Cd Cl2 N8 O10 -","- C32 H40 Cd Cl2 N8 O10 -","- C64 H80 Cd2 Cl4 N16 O20 -","2","0.5","","Sui, Bin; Fan, Jian; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu","Anion exchange properties of a two-dimensional coordination framework of cadmium(II) with 1,3-bis(imidazol-1-ylmethyl)-5-methylbenzene","New Journal of Chemistry","2001","25","11","1379","1381","10.1039/b106750h","","","0.71069","MoKα","","0.0484","0.0355","","","0.0886","0.0918","","","","","","1.008","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051220","17.405","0.004","11.06","0.002","8.286","0.0017","90","","101.83","0.03","90","","1561.2","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H20 N4 O2 -","- C15 H20 N4 O2 -","- C60 H80 N16 O8 -","4","0.5","","Sui, Bin; Fan, Jian; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu","Anion exchange properties of a two-dimensional coordination framework of cadmium(II) with 1,3-bis(imidazol-1-ylmethyl)-5-methylbenzene","New Journal of Chemistry","2001","25","11","1379","1381","10.1039/b106750h","","","0.71073","MoKα","","0.0685","0.0441","","","0.1177","0.1322","","","","","","1.011","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051221","18.112","0.01","10.86","0.005","23.781","0.01","90","","90","","90","","4678","4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C14 H27 Ag2 Cl2 N9 O8 -","- C14 H27 Ag2 Cl2 N9 O8 -","- C112 H216 Ag16 Cl16 N72 O64 -","8","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.0946","0.0492","","","0.108","0.1289","","","","","","1.035","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051222","11.488","0.003","10.395","0.003","19.527","0.007","90","","90","","90","","2331.9","1.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C9 H15 Ag N4 O4 -","- C9 H15 Ag N4 O4 -","- C72 H120 Ag8 N32 O32 -","8","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.0738","0.0527","","","0.1384","0.154","","","","","","1.011","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051223","11.717","0.004","11.741","0.006","10.478","0.007","90","","90","","90","","1441.5","1.3","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C13 H19 Ag N4 O3 -","- C13 H19 Ag N4 O3 -","- C52 H76 Ag4 N16 O12 -","4","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.0612","0.0523","","","0.1319","0.1404","","","","","","1.03","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051224","11.62","0.006","10.807","0.005","23.145","0.012","90","","90","","90","","2906","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H19 Ag N4 O4 -","- C13 H19 Ag N4 O4 -","- C104 H152 Ag8 N32 O32 -","8","1","","Zheng, Shao-Liang; Tong, Ming-Liang; Zhu, Hai-Liang; Chen, Xiao-Ming","Four two-dimensional highly undulating silver(I)–hexamethylenetetramine co-ordination networks containing micropores","New Journal of Chemistry","2001","25","11","1425","","10.1039/b107193a","","","0.71073","MoKα","","0.1137","0.0566","","","0.1149","0.1362","","","","","","1.024","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051225","11.2163","0.0013","9.612","0.0012","12.786","0.002","90","","91.796","0.006","90","","1377.8","0.3","223","2","223","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Rhodizonic acid dihydrate","","","- C6 H6 O8 -","- C6 H6 O8 -","- C48 H48 O64 -","8","1","","Braga, Dario; Cojazzi, Gianna; Maini, Lucia; Grepioni, Fabrizia","Reversible solid-state interconversion of rhodizonic acid H2C6O6 into H6C6O8 and the solid-state structure of the rhodizonate dianion C6O62‒ (aromatic or non-aromatic?)","New Journal of Chemistry","2001","25","10","1221","","10.1039/b107317f","","","0.71073","MoKα","","0.1436","0.0592","","","0.1194","0.1462","","","","","","0.73","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051226","12.522","0.004","8.354","0.004","3.761","0.003","90","","96.93","0.05","90","","390.6","0.4","223","2","223","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","Rubidium rhodizonate","","","- C6 O6 Rb2 -","- C6 O6 Rb2 -","- C12 O12 Rb4 -","2","0.25","","Braga, Dario; Cojazzi, Gianna; Maini, Lucia; Grepioni, Fabrizia","Reversible solid-state interconversion of rhodizonic acid H2C6O6 into H6C6O8 and the solid-state structure of the rhodizonate dianion C6O62‒ (aromatic or non-aromatic?)","New Journal of Chemistry","2001","25","10","1221","","10.1039/b107317f","","","0.71073","MoKα","","0.0545","0.0374","","","0.1006","0.1061","","","","","","1.003","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051227","22.9235","0.0007","9.9309","0.0005","12.8363","0.0007","90","0.01","101.078","0.003","90","0.01","2867.8","0.4","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H38 N4 O2 -","- C33 H38 N4 O2 -","- C132 H152 N16 O8 -","4","1","","Baouid, A.; Compain, P.; Huet, Francois; Lavergne, J. P.","Highly peri-, regio- and diasteroselective 1,3-dipolar cycloaddition of mesitontrile oxide to 1,4-diazepines: unexpected one-step formation of a new triheterocyclic framework.","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051228","15.246","0.003","22.372","0.004","21.359","0.004","90","","100.2","0.03","90","","7170","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 Cl2 Cu N6 O11 -","- C36 H30 Cl2 Cu N6 O11 -","- C288 H240 Cl16 Cu8 N48 O88 -","8","2","","Tong, Ming-Liang; Wu, Ying-Miao; Zheng, Shao-Liang; Chen, Xiao-Ming; Yuen, Tan; Lin, Chuan-Long; Huang, Xiaoying; Li, Jing","A three-dimensional honeycomb-like network constructed with novel one-dimensional S-shaped chains via hydrogen bonding and π‒π interactions","New Journal of Chemistry","2001","25","12","1482","1485","10.1039/b107655h","","","0.71073","MoKα","","0.1111","0.0487","","","0.1278","0.1584","","","","","","0.968","","","","has coordinates","180544","2020-10-21","18:00:00",""
"7051229","7.9346","0.0004","18.6728","0.0009","13.9672","0.0007","90","","104.485","0.003","90","","2003.62","0.17","80","2","80","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H27 Au Cl4 O8 -","- C10 H27 Au Cl4 O8 -","- C40 H108 Au4 Cl16 O32 -","4","1","","Maria Calleja; Sax A. Mason; Paul D. Prince; Jonathan W. Steed; Clive Wilkinson","Single Crystal Neutron and X-ray Diffraction Studies of (H7O3)[AuCl4]·15-crown-5.","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051230","7.9441","0.0007","18.6964","0.0016","13.9886","0.001","90","","104.347","0.003","90","","2012.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H27 Au Cl4 O8 -","- C10 H27 Au Cl4 O8 -","- C40 H108 Au4 Cl16 O32 -","4","1","","Maria Calleja; Sax A. Mason; Paul D. Prince; Jonathan W. Steed; Clive Wilkinson","Single Crystal Neutron and X-ray Diffraction Studies of (H7O3)[AuCl4]·15-crown-5.","New Journal of Chemistry","2001","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051231","11.064","0.003","18.385","0.006","11.155","0.003","90","","110.465","0.015","90","","2125.8","1.1","105","","105","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C42 H70 B K N4 O3 -","- C42 H50 B K N4 O3 -","- C84 H100 B2 K2 N8 O6 -","2","1","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","0.71069","MoKα","","","0.094","","","","0.0904","","","","","","1.6176","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051232","19.4597","0.0019","21.273","0.002","10.8452","0.0011","90","","90","","90","","4489.6","0.8","107","","107.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C46 H80 B K N4 O4 -","- C46 H80 B K N4 O4 -","- C184 H320 B4 K4 N16 O16 -","4","1","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051233","12.445","0.005","17.492","0.007","11.194","0.004","93.05","0.02","115.304","0.019","69.3","0.02","2046.9","1.5","103","","103","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H68 B K N4 O3 -","- C42 H68 B K N4 O3 -","- C84 H136 B2 K2 N8 O6 -","2","1","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051234","13.662","0.002","33.992","0.005","13.985","0.002","90","","119.107","0.007","90","","5674.1","1.6","109","","109","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H44 B N4 Tl -","- C30 H44 B N4 Tl -","- C240 H352 B8 N32 Tl8 -","8","4","","Chisholm, Malcolm H.; Iyer, Suri S.; Streib, William E.","Chiral C2 and C1 symmetric (cyclooctane-1,5-diyl)bis(2-pyrazolyl)borate complexes of potassium and thallium. Preparation, structures and solution behavior","New Journal of Chemistry","2000","24","6","393","398","10.1039/a906582b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210743","2020-10-21","18:00:00",""
"7051235","17.7939","0.0009","14.3421","0.0009","11.9338","0.0005","90","","129.008","0.002","90","","2366.6","0.2","173","0.2","173","0.2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C22 H28 Cl N3 O10 -","- C22 H28 Cl N3 O10 -","- C88 H112 Cl4 N12 O40 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7051236","17.84","0.001","14.251","0.001","12.3267","0.0006","90","","129.535","0.003","90","","2417","0.2","173","0.2","173","0.2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C23 H28 Cl N O10 S -","- C23 H28 Cl N O10 S -","- C92 H112 Cl4 N4 O40 S4 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210947","2020-10-21","18:00:00",""
"7051237","9.799","0.0002","37.641","0.001","12.3724","0.0003","90","","93.016","0.001","90","","4557.17","0.19","173","0.2","173","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H29 Cl N2 O10 -","- C19 H29 Cl N2 O10 -","- C152 H232 Cl8 N16 O80 -","8","2","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7051238","15.8297","0.0003","10.8577","0.0003","16.0071","0.0005","90","","93.859","0.002","90","","2744.97","0.13","173","0.2","173","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H34 Cl2 N4 O14 -","- C18 H34 Cl2 N4 O14 -","- C72 H136 Cl8 N16 O56 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7051239","8.392","0.001","12.611","0.002","25.993","0.005","90","","90","","90","","2750.9","0.8","173","0.2","173","0.2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H33 Cl N2 O11 -","- C25 H33 Cl N2 O11 -","- C100 H132 Cl4 N8 O44 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210947","2020-10-21","18:00:00",""
"7051240","22.0361","0.0001","22.0361","0.0001","17.0005","0.0002","90","","90","","90","","8255.27","0.11","293","2","293","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C85.5 H126.5 Cl N4.5 O12 -","- C85.526 H124 Cl0.948 N4.526 O12 -","- C342.104 H496 Cl3.792 N18.104 O48 -","4","0.25","","Schmidt, Christian; Paulus, Erich F.; Böhmer, Volker; Vogt, Walter","Selective derivatisation of resorcarenes. Part 5. Acylation of tetrabenzoxazine derivatives","New Journal of Chemistry","2000","24","3","123","","10.1039/a907622k","","","0.71073","MoKα","","0.0931","0.0787","","","0.2197","0.2349","","","","","","1.049","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051241","7.9985","0.001","8.9047","0.0011","16.614","0.002","90","","92.18","0.01","90","","1182.5","0.3","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H43 Cl N2 P2 Ru -","- C18 H42 Cl N2 P2 Ru -","- C36 H84 Cl2 N4 P4 Ru2 -","2","0.5","","Coalter, III, Joseph N.; Bollinger, John C.; Huffman, John C.; Werner‒Zwanziger, Ulrike; Caulton, Kenneth G.; Davidson, Ernest R.; Gérard, Hélène; Clot, Eric; Eisenstein, Odile","Coordinated carbenes from electron-rich olefins on RuHCl(PPr3i)2","New Journal of Chemistry","2000","24","1","9","26","10.1039/a907624g","","","0.71073","MoKα","","0.0625","0.0346","","0.0778","0.0675","","","","0.918","0.955","0.955","","","","","has coordinates,has disorder","210948","2020-10-21","18:00:00",""
"7051242","16.124","0.006","11.289","0.004","16.313","0.006","90","","100.297","0.019","90","","2921.6","1.8","102","","102","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C24 H52 Cl N O P2 Ru -","- C24 H52 Cl N O P2 Ru -","- C96 H208 Cl4 N4 O4 P8 Ru4 -","4","1","","Coalter, III, Joseph N.; Bollinger, John C.; Huffman, John C.; Werner‒Zwanziger, Ulrike; Caulton, Kenneth G.; Davidson, Ernest R.; Gérard, Hélène; Clot, Eric; Eisenstein, Odile","Coordinated carbenes from electron-rich olefins on RuHCl(PPr3i)2","New Journal of Chemistry","2000","24","1","9","26","10.1039/a907624g","","","0.71069","MoKα","","","0.046","","","","0.0349","","","","","","1.229","","","","has coordinates,has disorder","210948","2020-10-21","18:00:00",""
"7051243","27.512","0.004","27.5123","","25.092","0.003","90","","90","","120","","16448","3","296.2","","296.2","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C38 H33.5 N6 Ni O4.75 S2 -","- C38 H32 N6 Ni O4.5695 S2 -","- C684 H576 N108 Ni18 O82.251 S36 -","18","1","","Bermejo, Manuel R.; Sousa, Antonio; Fondo, Matilde; Helliwell, Madeleine","Rearrangement and co-ordination of 1-[(4-methylphenyl)- sulfonamido]-2-[1-(2-pyridylmethylidene)amino]benzene","New Journal of Chemistry","2000","24","1","33","","10.1039/a907731f","","","1.5418","CuKα","","0.1707","0.0699","","0.0559","0.0489","","","","1.619","2.012","2.012","","","","","has coordinates","209482","2020-10-21","18:00:00",""
"7051244","9.9076","0.0001","14.6999","0.0002","19.0506","0.0002","90","","101.7","","90","","2716.9","0.05","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C27 H26 Cl2 N2 O P2 Pd -","- C27 H26 Cl2 N2 O P2 Pd -","- C108 H104 Cl8 N8 O4 P8 Pd4 -","4","1","","Slawin, Alexandra M. Z.; Wainwright, Matthew; Derek Woollins, J.","Phosphino-urea chemistry: preparation and structure of chelate and P‒N bond cleavage complexes","New Journal of Chemistry","2000","24","2","69","","10.1039/a908153d","","","0.71073","MoKα","","0.039","0.0263","","0.069","0.0576","","","","0.964","0.985","0.985","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051245","11.4044","0.0005","11.5628","0.0005","11.9275","0.0005","69.23","","71.929","0.001","74.871","0.001","1377.76","0.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C18 H23 Cl5 N2 O P Pt S2 -","- C18 H23 Cl5 N2 O P Pt S2 -","- C36 H46 Cl10 N4 O2 P2 Pt2 S4 -","2","1","","Slawin, Alexandra M. Z.; Wainwright, Matthew; Derek Woollins, J.","Phosphino-urea chemistry: preparation and structure of chelate and P‒N bond cleavage complexes","New Journal of Chemistry","2000","24","2","69","","10.1039/a908153d","","","0.71073","MoKα","","0.1161","0.0503","","0.3141","0.1149","","","","0.622","0.654","0.654","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051246","11.6946","0.0003","15.4866","0.0004","18.5407","0.0003","76.184","0.001","71.834","0.001","72.806","0.001","3007.91","0.12","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H58 Cl4 N4 O5 P4 Pd2 -","- C56 H58 Cl4 N4 O5 P4 Pd2 -","- C112 H116 Cl8 N8 O10 P8 Pd4 -","2","1","","Slawin, Alexandra M. Z.; Wainwright, Matthew; Derek Woollins, J.","Phosphino-urea chemistry: preparation and structure of chelate and P‒N bond cleavage complexes","New Journal of Chemistry","2000","24","2","69","","10.1039/a908153d","","","0.71073","MoKα","","0.0666","0.043","","0.1503","0.113","","","","1.022","1.072","1.072","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051247","8.8316","0.0002","5.9003","0.0001","15.6123","0.0004","90","","90","","90","","813.54","0.03","150","","150","","","","","","","","","3","P b c a","-P 2ac 2ab","61","trans-1,4-Diethynyl-1,4-dihydroxy-2,5-cyclohexadiene","trans-1,4-Diethynyl-1,4-dihydroxy-2,5-cyclohexadiene","","- C10 H8 O2 -","- C10 H8 O2 -","- C40 H32 O8 -","4","0.5","","Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R.","Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family","New Journal of Chemistry","2000","24","1","1","","10.1039/a908233f","","","0.71073","MoKα","","0.041","0.0358","","","0.088","0.0947","","","","","","1.097","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051248","8.7684","0.0018","8.9558","0.0018","10.315","0.002","113.78","0.03","102.06","0.03","102.59","0.03","682.3","0.4","150","","150","","","","","","","","","3","P -1","-P 1","2","trans-9,10-Diethynyl-9,10-dihydroxy-9,10-dihydroanthracene","trans-9,10-Diethynyl-9,10-dihydroxy-9,10-dihydroanthracene","","- C18 H12 O2 -","- C18 H12 O2 -","- C36 H24 O4 -","2","1","","Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R.","Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family","New Journal of Chemistry","2000","24","1","1","","10.1039/a908233f","","","0.71073","MoKα","","0.0973","0.054","","","0.1084","0.133","","","","","","1.05","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051249","10.8247","0.0003","22.6384","0.0008","10.4783","0.0003","90","","118.185","0.001","90","","2263.28","0.12","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","trans-1,4-Diethynyl-1,4-dihydroxy-1,4-dihydronaphthalene","trans-1,4-Diethynyl-1,4-dihydroxy-1,4-dihydronaphthalene","","- C14 H10 O2 -","- C14 H10 O2 -","- C112 H80 O16 -","8","2","","Laxmi Madhavi, N. N.; Bilton, Clair; Howard, Judith A. K.; Allen, Frank H.; Nangia, Ashwini; Desiraju, Gautam R.","Seeking structural repetitivity in systems with interaction interference: crystal engineering in the gem-alkynol family","New Journal of Chemistry","2000","24","1","1","","10.1039/a908233f","","","0.71073","MoKα","","0.1083","0.0596","","","0.1401","0.1597","","","","","","0.983","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051250","16.5","0.001","28.983","0.003","17.292","0.002","90","","109.52","0.01","90","","7794.1","1.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C86 H105 B Na O13 -","- C86 H102.346 B Na O13 -","- C344 H409.384 B4 Na4 O52 -","4","1","","Wickens, Joanna; Dryfe, Robert A. W.; Mair, Francis S.; Pritchard, Robin G.; Hayes, Roy; Arrigan, Damien W. M.","Calixarene-facilitated transfer of alkali metal ions across the polarised liquid‒liquid interface","New Journal of Chemistry","2000","24","3","149","","10.1039/a908257c","","","0.71073","MoKα","","0.202","0.0799","","","0.1277","0.1631","","","","","","0.935","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051251","14.274","0.0008","14.214","0.0006","15.104","0.0006","90","","90","","90","","3064.5","0.2","293","2","293","2","","","","","","","","4","P 4/m n c","-P 4 2n","128","","","","- Cl8 Gd6 H72 O73 -","- Cl8 Gd6 O73 -","- Cl16 Gd12 O146 -","2","0.125","","Zhang, Da-Shun; Ma, Bao-Qing; Jin, Tian-Zhu; Gao, Song; Yan, Chun-Hua; Mak, Thomas C. W.","Oxo-centered regular octahedral lanthanide clusters","New Journal of Chemistry","2000","24","2","61","","10.1039/a908471a","","","0.71073","MoKα","","0.0793","0.0702","","","0.1726","0.1746","","","","","","1.194","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051252","14.5147","0.0007","14.5079","0.0007","15.2546","0.0008","90","","90","","90","","3212.3","0.3","293","2","293","2","","","","","","","","4","P 4/m n c","-P 4 2n","128","","","","- Cl8 H72 Nd6 O73 -","- Cl8 Nd6 O73 -","- Cl16 Nd12 O146 -","2","0.125","","Zhang, Da-Shun; Ma, Bao-Qing; Jin, Tian-Zhu; Gao, Song; Yan, Chun-Hua; Mak, Thomas C. W.","Oxo-centered regular octahedral lanthanide clusters","New Journal of Chemistry","2000","24","2","61","","10.1039/a908471a","","","0.71073","MoKα","","0.0445","0.0322","","","0.0827","0.0889","","","","","","0.977","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051253","18.628","0.019","11.548","0.013","19.43","0.02","90","","93.1","0.01","90","","4174","8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C43 H35 Cl4 N O3 P2 Pd -","- C43 H35 Cl4 N O3 P2 Pd -","- C172 H140 Cl16 N4 O12 P8 Pd4 -","4","1","","Susana M. O. Quintal; Helena I. S. Nogueira; Vitor Félix; Michael G. B. Drew","Coordination modes of 3-hydroxypicolinic acid: synthesis and crystal structures of palladium(II), platinum(II) and rhenium(V) complexes","New J. Chem.","2000","24","7","511","517","10.1039/a908560b","","","0.71073","MoKα","","0.0887","0.0588","","","0.1554","0.1834","","","","","","0.836","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051254","11.002","0.014","12.641","0.014","16.825","0.018","112.24","0.01","93.52","0.01","104.51","0.01","2065","4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H35 Cl4 N O3 P2 Pt -","- C43 H35 Cl4 N O3 P2 Pt -","- C86 H70 Cl8 N2 O6 P4 Pt2 -","2","1","","Susana M. O. Quintal; Helena I. S. Nogueira; Vitor Félix; Michael G. B. Drew","Coordination modes of 3-hydroxypicolinic acid: synthesis and crystal structures of palladium(II), platinum(II) and rhenium(V) complexes","New J. Chem.","2000","24","7","511","517","10.1039/a908560b","","","0.71073","MoKα","","0.0631","0.0438","","","0.0986","0.106","","","","","","1.08","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051255","8.116","0.009","15.241","0.017","21.061","0.024","90","","100.17","0.01","90","","2564","5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H19 I2 N O4 P Re -","- C24 H19 I2 N O4 P Re -","- C96 H76 I8 N4 O16 P4 Re4 -","4","1","","Susana M. O. Quintal; Helena I. S. Nogueira; Vitor Félix; Michael G. B. Drew","Coordination modes of 3-hydroxypicolinic acid: synthesis and crystal structures of palladium(II), platinum(II) and rhenium(V) complexes","New J. Chem.","2000","24","7","511","517","10.1039/a908560b","","","0.71073","MoKα","","0.0625","0.0431","","","0.1139","0.125","","","","","","1.088","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051256","10.7727","0.0014","7.5924","0.0009","21.775","0.003","90","","90","","90","","1781","0.4","123","2","123","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","5,10-Dihydrophenazine","","","- C12 H10 N2 -","- C12 H10 N2 -","- C96 H80 N16 -","8","1","","Thalladi, Venkat R.; Smolka, Tanja; Gehrke, Annette; Boese, Roland; Sustmann, Reiner","Role of weak hydrogen bonds in the crystal structures of phenazine, 5,10-dihydrophenazine and their 1:1 and 3:1 molecular complexes","New Journal of Chemistry","2000","24","3","143","","10.1039/a908744c","","","0.71073","MoKα","","0.0441","0.0349","","","0.0953","0.1017","","","","","","1.004","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051257","11.6466","0.0003","6.2335","0.0002","12.5573","0.0005","90","","97.612","0.002","90","","903.61","0.05","300","2","300","2","","","","","","","","3","I 1 2/a 1","-I 2ya","15","1:1 molecular complex of phenazine and 5,10-dihydrophenazine","","","- C24 H18 N4 -","- C24 H18 N4 -","- C48 H36 N8 -","2","0.25","","Thalladi, Venkat R.; Smolka, Tanja; Gehrke, Annette; Boese, Roland; Sustmann, Reiner","Role of weak hydrogen bonds in the crystal structures of phenazine, 5,10-dihydrophenazine and their 1:1 and 3:1 molecular complexes","New Journal of Chemistry","2000","24","3","143","","10.1039/a908744c","","","0.71073","MoKα","","0.062","0.0564","","","0.1517","0.1579","","","","","","1.104","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051258","9.0262","0.0015","9.6761","0.0015","11.2416","0.0018","72.522","0.002","80.196","0.003","77.597","0.003","908.7","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","3:1 molecular complex of phenazine and 5,10-dihydrophenazine","","","- C48 H34 N8 -","- C48 H34 N8 -","- C48 H34 N8 -","1","0.5","","Thalladi, Venkat R.; Smolka, Tanja; Gehrke, Annette; Boese, Roland; Sustmann, Reiner","Role of weak hydrogen bonds in the crystal structures of phenazine, 5,10-dihydrophenazine and their 1:1 and 3:1 molecular complexes","New Journal of Chemistry","2000","24","3","143","","10.1039/a908744c","","","0.71073","MoKα","","0.1112","0.0629","","","0.1579","0.2075","","","","","","1.013","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051259","10.8328","0.0012","24.56","0.002","17.0067","0.0015","90","","101.074","0.012","90","","4440.4","0.7","297","2","297","2","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H40 F6 N P3 Ru -","- C44 H40 F6 N P3 Ru -","- C176 H160 F24 N4 P12 Ru4 -","4","1","","H. Brunner; C. Valério; M. Zabel","Optically active transition metal complexes. Part 123: new chiral half-sandwich ruthenium complexes, in which the arene ligand is tethered to a PN ligand","New J. Chem.","2000","24","5","275","279","10.1039/a909262e","","","0.71073","MoKα","","0.1849","0.0573","","","0.1154","0.1536","","","","","","0.843","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051260","10.9743","0.0011","12.4718","0.0014","21.493","0.003","92.052","0.014","94.429","0.014","91.384","0.013","2930","0.6","297","2","297","2","","","","","","","see text","7","P -1","-P 1","2","","","","- C58 H55 F6 N O P4 Ru -","- C58 H55 F6 N O P4 Ru -","- C116 H110 F12 N2 O2 P8 Ru2 -","2","1","","H. Brunner; C. Valério; M. Zabel","Optically active transition metal complexes. Part 123: new chiral half-sandwich ruthenium complexes, in which the arene ligand is tethered to a PN ligand","New J. Chem.","2000","24","5","275","279","10.1039/a909262e","","","0.71073","MoKα","","0.16","0.0847","","","0.1836","0.2124","","","","","","0.846","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051261","11.931","0.007","11.105","0.011","8.929","0.005","90","","90.96","0.04","90","","1182.9","1.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H8 B N O -","- C5 H8 B N O -","- C40 H64 B8 N8 O8 -","8","1","","Gerald Lesley, M. J.; Norman, Nicholas C.; Guy Orpen, A.; Starbuck, Jonathan","Synthetic routes to cyclic and unsymmetric diborane(4) compounds","New Journal of Chemistry","2000","24","3","115","","10.1039/a909645k","","","0.71073","MoKα","","0.0659","0.0402","","","0.092","0.1063","","","","","","1.001","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051262","13.3492","0.0007","25.9398","0.0013","13.5326","0.0008","90","","118.966","0.0015","90","","4099.8","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H99 Cl5 Gd4 N6 O52 -","- C30 H47 Cl5 Gd4 N6 O52 -","- C60 H94 Cl10 Gd8 N12 O104 -","2","1","","Ma, Bao-Qing; Zhang, Da-Shun; Gao, Song; Jin, Tian-Zhu; Yan, Chun-Hua","The formation of Gd4O4 cubane cluster controlled by L-valine","New Journal of Chemistry","2000","24","5","251","","10.1039/a910181k","","","0.71073","MoKα","","0.1156","0.0769","","","0.1873","0.2174","","","","","","1.065","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051263","12.8116","0.0002","12.1494","0.0002","18.2432","0.0002","90","","107.197","0.001","90","","2712.67","0.07","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H21 N3 O10 S -","- C29 H21 N3 O10 S -","- C116 H84 N12 O40 S4 -","4","1","","Christopher Pigge, F.; Zheng, Zhanmiao; Rath, Nigam P.","1,3,5-Triaroylbenzenes as versatile inclusion hosts via C‒H···O hydrogen bonding","New Journal of Chemistry","2000","24","4","183","","10.1039/a910190j","","","0.71073","MoKα","","0.0629","0.038","","","0.0845","0.0929","","","","","","1.025","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051264","9.7093","0.0001","10.3943","0.0002","14.4467","0.0002","83.177","0.001","84.037","0.001","73.265","0.001","1382.62","0.04","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H17 Cl2 N3 O9 -","- C28 H17 Cl2 N3 O9 -","- C56 H34 Cl4 N6 O18 -","2","1","","Christopher Pigge, F.; Zheng, Zhanmiao; Rath, Nigam P.","1,3,5-Triaroylbenzenes as versatile inclusion hosts via C‒H···O hydrogen bonding","New Journal of Chemistry","2000","24","4","183","","10.1039/a910190j","","","0.71073","MoKα","","0.103","0.0665","","","0.1956","0.2276","","","","","","1.024","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051265","17.788","0.004","10.706","0.002","18.56","0.004","90","","113.37","0.03","90","","3244.6","1.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C6 H0 Cl4 Eu2 N2 O34 P2 -","- C6 Cl4 Eu2 N2 O34 P2 -","- C24 Cl16 Eu8 N8 O136 P8 -","4","1","","Gałdecka, Ewa; Gałdecki, Zdzislaw; Gawryszewska, Paula; Legendziewicz, Janina","Structure of a novel polynuclear europium compound with N-phosphonomethylglycine: heptaaquaperchloratodi-μ4-N-phosphonomethylglycine-dieuropium(III) triperchlorate monohydrate, [Eu2(HO3PCH2NH2CH2CO2)2(H2O)7(ClO4)]·3ClO4·H2O","New Journal of Chemistry","2000","24","6","387","","10.1039/b000230p","","","0.71073","MoKα","","0.1239","0.0656","","","0.1614","0.2104","","","","","","0.959","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051266","6.6655","0.0002","16.4067","0.0005","12.7938","0.0001","90","","94.307","0.002","90","","1395.16","0.06","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 N2 O3 -","- C15 H14 N2 O3 -","- C60 H56 N8 O12 -","4","1","","Bermejo, Manuel R.; González, Ana M.; Fondo, Matilde; García-Deibe, Ana; Maneiro, Marcelino; Sanmartín, Jesús; Hoyos, Olga L.; Watkinson, Michael","A direct route to obtain manganese(III) complexes with a new class of asymmetrical Schiff base ligands","New Journal of Chemistry","2000","24","4","235","","10.1039/b000235f","","","0.71073","MoKα","","0.1253","0.0584","","0.159","0.1288","","","","0.959","1.114","1.114","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051267","14.056","0.005","17.494","0.003","14.397","0.004","90","","109.49","0.02","90","","3337.3","1.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Cu(Ph-protach)(SO4)(0.5CH3OH)], (1)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane copper sulfate, (1) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C34.5 H39 Cu N3 O5.5 S -","- C34.5 H39 Cu N3 O5.5 S -","- C138 H156 Cu4 N12 O22 S4 -","4","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.71069","MoKα","","0.1043","0.0493","","","0.1207","0.1487","","","","","","1.023","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051268","15.579","0.003","16.549","0.003","19.916","0.002","90","","109.335","0.01","90","","4845.1","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Ni(Ph-protach)(Cl)]BPh4, (2)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane nickel(II) chloride tetraphenylborate, (2) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C57 H53 B Cl N3 Ni -","- C57 H53 B Cl N3 Ni -","- C228 H212 B4 Cl4 N12 Ni4 -","4","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.71069","MoKα","","0.1229","0.0504","","","0.1328","0.1934","","","","","","1.026","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051269","15.222","0.01","19.097","0.009","10.784","0.01","99.61","0.06","103.87","0.07","76.73","0.04","2941","4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Zn(Ph-protach)(Cl)]BPh4, (3)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane zinc(II) chloride tetraphenylborate, (3) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C60 H59 B Cl7 N3 Zn -","- C60 H59 B Cl7 N3 Zn -","- C120 H118 B2 Cl14 N6 Zn2 -","2","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.71069","MoKα","","0.1414","0.0733","","","0.1853","0.2276","","","","","","0.986","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051270","15.642","0.003","17.746","0.004","10.348","0.003","99.861","0.019","105.154","0.017","76.486","0.015","2677.1","1.1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","[Cd(Ph-protach)(NO3)(CH3OH)]BPh4, (4)","cis,cis-1,3,5-(E,E)-tri(phenyl-propenylideneamino)cyclohexane cadmium(II) nitrate tetraphenylborate, (4) {tri(phenyl-propenylideneamino)cyclohexane = (Ph-protach)}","","- C59 H61 B Cd N4 O5 -","- C59 H61 B Cd N4 O5 -","- C118 H122 B2 Cd2 N8 O10 -","2","1","","Greener, Bryan; Foxon, Simon P.; Walton, Paul H.","Syntheses and structures of a range of metal complexes with the ligand cis,cis-1,3,5-(E,E)-tris(phenylpropenylideneamino)cyclohexane","New Journal of Chemistry","2000","24","5","269","","10.1039/b000441n","","x-ray","0.7107","MoKα","","0.0533","0.0323","","","0.0806","0.0965","","","","","","1.079","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051271","15.835","0.002","17.762","0.002","14.503","0.002","113.53","0.01","103.169","0.01","88.58","0.01","3631.6","0.9","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C83 H105 N4 O P Zn -","- C83 H105 N4 O P Zn -","- C166 H210 N8 O2 P2 Zn2 -","2","1","","Darling, Scott L.; Stulz, Eugen; Feeder, Neil; Bampos, Nick; Sanders, Jeremy K. M.","Phosphine-substituted porphyrins as supramolecular building blocks","New Journal of Chemistry","2000","24","5","261","","10.1039/b000482k","","","0.71073","MoKα","","0.1553","0.104","","","0.2676","0.3015","","","","","","1.082","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051272","7.4376","0.0003","8.9729","0.0004","11.9365","0.0005","73.754","0.002","83.435","0.002","66.728","0.002","702.56","0.05","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 B Fe P -","- C16 H16 B Fe P -","- C32 H32 B2 Fe2 P2 -","2","1","","Evans, Chris E. B.; Lough, Alan J.; Grondey, Hiltrud; Manners, Ian","Synthesis, structure and polymerization behaviour of borane adducts of a phosphorus-bridged [1]ferrocenophane, [(η-C5H4)2FePPh]","New Journal of Chemistry","2000","24","6","447","","10.1039/b000935k","","","0.71073","MoKα","","0.0328","0.0282","","","0.0731","0.0764","","","","","","1.1","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051273","21.7419","0.0003","16.3501","0.0004","24.7136","0.0005","90","","90","","90","","8785.2","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C36 H90 P4 Ru2 -","- C36 H90 P4 Ru2 -","- C288 H720 P32 Ru16 -","8","1","","Evans, Chris E. B.; Lough, Alan J.; Grondey, Hiltrud; Manners, Ian","Synthesis, structure and polymerization behaviour of borane adducts of a phosphorus-bridged [1]ferrocenophane, [(η-C5H4)2FePPh]","New Journal of Chemistry","2000","24","6","447","","10.1039/b000935k","","","0.71073","MoKα","","0.0736","0.0391","","","0.085","0.0936","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051274","10.778","0.002","11.882","0.002","13.83","0.002","81.079","0.013","89.136","0.014","64.835","0.014","1581.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H28 N4 Ni O2 S4 -","- C32 H28 N4 Ni O2 S4 -","- C64 H56 N8 Ni2 O4 S8 -","2","1","","Zhu, Xu-Hui; Chen, Xiao-Feng; Zhang, Yong; You, Xiao-Zeng; Tan, Wei-Lian; Ji, Wei; Vittal, Jaganese J.; Tan, Goek-Kheng; Kennard, Colin H. L.","Crystal structures, molecular packing and picosecond optical limiting properties of quadridentate Schiff base divalent metal complexes derived from S-benzyl dithiocarbazate","New Journal of Chemistry","2000","24","6","419","","10.1039/b000960l","","","0.71073","MoKα","","0.0639","0.052","","0.1596","0.1477","","","","1.071","1.101","1.101","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051275","10.7838","0.0006","11.1477","0.0006","14.6503","0.0008","81.72","0.001","84.405","0.001","66.35","0.001","1594.91","0.15","293","2","293","2","","","","","","","see text","6","P -1","-P 1","2","","","","- C32 H28 N4 O2 Pd S4 -","- C32 H28 N4 O2 Pd S4 -","- C64 H56 N8 O4 Pd2 S8 -","2","1","","Zhu, Xu-Hui; Chen, Xiao-Feng; Zhang, Yong; You, Xiao-Zeng; Tan, Wei-Lian; Ji, Wei; Vittal, Jaganese J.; Tan, Goek-Kheng; Kennard, Colin H. L.","Crystal structures, molecular packing and picosecond optical limiting properties of quadridentate Schiff base divalent metal complexes derived from S-benzyl dithiocarbazate","New Journal of Chemistry","2000","24","6","419","","10.1039/b000960l","","","0.71073","MoKα","","0.0458","0.0354","","0.0861","0.0806","","","","1.037","1.059","1.059","","","","","has coordinates,has disorder","180066","2020-10-21","18:00:00",""
"7051276","12.054","0.003","24.13","0.003","12.213","0.003","90","","92.25","0.02","90","","3549.6","1.3","294","","294","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H34 I O2 P2 Rh -","- C40 H34 I O2 P2 Rh -","- C160 H136 I4 O8 P8 Rh4 -","4","1","","Pierre Braunstein; Yves Chauvin; Jean Fischer; Hélène Olivier; Carsten Strohmann; Dawn V. Toronto","Oxidative addition of iodine, iodomethane and iodobenzene to the rhodium phosphino enolate complex[Rh{Ph2PCHC(O)Ph}(CO)(PPh3)] and carbon monoxide insertion into the resulting Rh‒carbon bond of [Rh{Ph2PCHC(O)Ph}Me(I)(CO)(PPh3)]","New J. Chem.","2000","24","6","437","445","10.1039/b000961j","","","0.71073","Mo-Kα","","0.091","0.039","","0.149","","0.055","","","2.97","","","1.088","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051277","17.887","0.005","18.538","0.005","11.515","0.003","90","","90","","90","","3818.2","1.8","294","","294","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C45 H36 I O2 P2 Rh -","- C45 H36 I O2 P2 Rh -","- C180 H144 I4 O8 P8 Rh4 -","4","1","","Pierre Braunstein; Yves Chauvin; Jean Fischer; Hélène Olivier; Carsten Strohmann; Dawn V. Toronto","Oxidative addition of iodine, iodomethane and iodobenzene to the rhodium phosphino enolate complex[Rh{Ph2PCHC(O)Ph}(CO)(PPh3)] and carbon monoxide insertion into the resulting Rh‒carbon bond of [Rh{Ph2PCHC(O)Ph}Me(I)(CO)(PPh3)]","New J. Chem.","2000","24","6","437","445","10.1039/b000961j","","","0.71073","Mo-Kα","","0.038","0.022","","0.037","","0.027","","","1.408","","","1.065","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051278","13.864","0.003","8.859","0.002","29.696","0.006","90","","101.27","0.03","90","","3577","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H36 O2.5 P2 Rh -","- C41 H36 O2.5 P2 Rh -","- C164 H144 O10 P8 Rh4 -","4","1","","Pierre Braunstein; Yves Chauvin; Jean Fischer; Hélène Olivier; Carsten Strohmann; Dawn V. Toronto","Oxidative addition of iodine, iodomethane and iodobenzene to the rhodium phosphino enolate complex[Rh{Ph2PCHC(O)Ph}(CO)(PPh3)] and carbon monoxide insertion into the resulting Rh‒carbon bond of [Rh{Ph2PCHC(O)Ph}Me(I)(CO)(PPh3)]","New J. Chem.","2000","24","6","437","445","10.1039/b000961j","","","0.71073","MoKα","","0.0453","0.0365","","0.1066","0.0916","","","","1.053","1.077","1.077","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051279","15.197","0.001","5.808","0.002","19.5635","0.0009","90","","95.321","0.005","90","","1719.3","0.6","296.2","","296.2","","","","","","","","preparation","4","P 1 21/c 1","-P 2ybc","14","4f","","","- C19 H17 N O5 -","- C20 H17 N O5 -","- C80 H68 N4 O20 -","4","1","","Itoh, Kuniaki; Kishimoto, Shigehisa","The reaction of β-nitrostyrenes with 2-methoxyfuran: a novel formation of isoxazoline N-oxide together with Michael adducts","New Journal of Chemistry","2000","24","6","347","","10.1039/b001049i","","","0.7107","MoKα","","","0.0553","","","0.0453","","","","","1.479","1.479","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051280","12.064","0.003","12.797","0.002","9.794","0.003","102.99","0.02","97.17","0.02","68.7","0.02","1371.1","0.6","20","","20","","","","","","","","","3","P -1","-P 1","2","","","","?","- C72 H60 N4 -","- C72 H60 N4 -","","","","Yao, Min-Liang; Deng, Min-Zhi","A practical approach to stereodefined cyclopropyl-substituted heteroarenes using a Suzuki-type reaction","New Journal of Chemistry","2000","24","6","425","","10.1039/b001051k","","","0.7107","MoKalpha","","","0.041","","","0.045","","","","","1.39","1.39","","","","","has coordinates","288156","2023-12-07","18:40:59",""
"7051281","7.994","0.001","21.67","0.003","14.741","0.003","90","","101.91","0.01","90","","2498.6","0.7","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-bis(3,5-dinitrophenyl)-3,6,9-trioxaundecanedicarboxamide","","- C20 H22 N6 O14 -","- C20 H22 N6 O14 -","- C80 H88 N24 O56 -","4","1","","Sylvie Meyer; Rémy Louis; Bernard Metz; Yvette Agnus; Alexandre Varnek; Maurice Gross","Unprecedented role of water in self-assembly of potential molecular tweezers","New J. Chem.","2000","24","6","371","376","10.1039/b001127o","","","1.54056","Cu-Kα","","0.094","0.049","","","","0.045","","","","","","0.947","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051282","11.318","0.002","24.444","0.005","11.069","0.001","96.17","0.01","101.24","0.01","77.23","0.02","2922.6","0.9","294","","294","","","","","","","","","4","P -1","-P 1","2","","N,N'-bis(3,5-dimethylisophtalate)-3,6,9-trioxaundecanedicarboxamide","","- C56 H66 N4 O27 -","- C56 H66 N4 O27 -","- C112 H132 N8 O54 -","2","1","","Sylvie Meyer; Rémy Louis; Bernard Metz; Yvette Agnus; Alexandre Varnek; Maurice Gross","Unprecedented role of water in self-assembly of potential molecular tweezers","New J. Chem.","2000","24","6","371","376","10.1039/b001127o","","","1.54056","Cu-Kα","","0.109","0.052","","","","0.059","","","","","","0.999","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051283","13.43","0.001","13.748","0.001","18.444","0.001","88.31","0.003","70.157","0.003","62.542","0.003","2809.3","0.3","20","2","20","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H31 O P -","- C37 H31 O P -","- C148 H124 O4 P4 -","4","2","","Matthew G. Davidson; Andrés E. Goeta; Judith A. K. Howard; Sarah Lamb; Sax A. Mason","The shortest C‒H···O hydrogen bonds yet determined by single crystal neutron diffraction: a structural study of two phosphonium aryloxides","New J. Chem.","2000","24","7","477","479","10.1039/b001433h","","neutron","1.3137","neutron","","0.0486","0.044","","0.1319","0.1264","","","","1.133","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051284","18.57","0.001","17.22","0.001","19.03","0.001","90","","90","","90","","6085.3","0.6","20","2","20","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C35 H43 O P -","- C35 H43 O P -","- C280 H344 O8 P8 -","8","1","","Matthew G. Davidson; Andrés E. Goeta; Judith A. K. Howard; Sarah Lamb; Sax A. Mason","The shortest C‒H···O hydrogen bonds yet determined by single crystal neutron diffraction: a structural study of two phosphonium aryloxides","New J. Chem.","2000","24","7","477","479","10.1039/b001433h","","neutron","1.3137","neutron","","0.0443","0.0357","","0.0738","0.0713","","","","","","","1.171","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051285","15.7749","0.0003","18.8326","0.0003","19.4901","0.0004","90","","90","","90","","5790.17","0.19","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C31 H27 N O P2 Se2 -","- C31 H27 N O P2 Se2 -","- C248 H216 N8 O8 P16 Se16 -","8","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.0915","0.0336","","0.0786","0.0611","","","","0.83","0.951","0.951","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051286","11.8731","0.0003","14.3704","0.0003","21.5491","0.0005","90","","98.502","0.001","90","","3636.33","0.15","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H28.5 Cl4.5 N O P2 Pd -","- C32 H27.5 Cl4.5 N O P2 Pd -","- C128 H110 Cl18 N4 O4 P8 Pd4 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.1063","0.0559","","0.2341","0.1564","","","","0.849","0.84","0.84","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051287","15.0814","0.0006","9.2086","0.0004","25.0051","0.0009","90","","98.384","0.001","90","","3435.6","0.2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H27.5 Cl3.5 N O P2 Pt S -","- C31.5 H27.5 Cl3.5 N O P2 Pt S -","- C126 H110 Cl14 N4 O4 P8 Pt4 S4 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.0364","0.0261","","0.1131","0.0752","","","","0.787","0.806","0.806","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051288","9.0732","0.0001","18.9395","0.0002","19.2823","0.0001","90","","96.862","0.001","90","","3289.77","0.05","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H27 Mo N O5 P2 -","- C35 H27 Mo N O5 P2 -","- C140 H108 Mo4 N4 O20 P8 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.0289","0.0209","","0.0736","0.0563","","","","0.943","0.966","0.966","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7051289","11.15","0.0002","30.8735","0.0004","17.2571","0.0003","90","","94.393","0.001","90","","5923.12","0.17","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62 H54 Cu F6 N2 O2 P5 -","- C62 H54 Cu F6 N2 O2 P5 -","- C248 H216 Cu4 F24 N8 O8 P20 -","4","1","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.71073","MoKα","","0.1745","0.0578","","0.2015","0.1269","","","","0.963","1.01","1.01","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051290","9.535","0.002","12.52","0.003","17.012","0.003","71.89","0.03","81.55","0.03","68.9","0.03","1799.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H48 Ho N13 O15 -","- C21 H42 Ho N13 O15 -","- C42 H84 Ho2 N26 O30 -","2","1","","Mondry, Anna; Starynowicz, Przemysław","Structure and optical spectroscopy of holmium(III) triethylenetetraaminehexaacetate in single crystal and in solution","New Journal of Chemistry","2000","24","8","603","","10.1039/b001480j","","","0.71073","MoKα","","0.0388","0.0351","","","0.1021","0.1022","","","","","","5.609","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051291","11.818","0.002","23.435","0.005","21.975","0.004","90","","96.92","0.03","90","","6042","2","299","1","299","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H67 Cl Li4 N4 O10 Zn -","- C58 H67 Cl Li4 N4 O10 Zn -","- C232 H268 Cl4 Li16 N16 O40 Zn4 -","4","1","","Sobota, Piotr; Klimowicz, Maria; Utko, Józef; Jerzykiewicz, Lucjan B.","Syntheses and crystal structure of [Li4Zn(μ3,η2-ddbfo)2(μ,η2-ddbfo)3Cl(CH3CN)2]·2CH3CN, [Na4(μ,η2-ddbfo)4(CH3CN)4] and [Zn2(μ,η1-ddbfo)2Cl2(py)2] aggregates","New Journal of Chemistry","2000","24","7","523","","10.1039/b001832p","","","0.71073","MoKα","","0.0736","0.0387","","","0.1057","0.117","","","","","","1.084","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051292","9.988","0.002","18.643","0.004","28.848","0.006","84.29","0.03","84.32","0.03","76","0.03","5171","2","298","1","298","1","","","","","","","","5","P -1","-P 1","2","","","","- C96 H112 N8 Na8 O16 -","- C96 H112 N8 Na8 O16 -","- C192 H224 N16 Na16 O32 -","2","1","","Sobota, Piotr; Klimowicz, Maria; Utko, Józef; Jerzykiewicz, Lucjan B.","Syntheses and crystal structure of [Li4Zn(μ3,η2-ddbfo)2(μ,η2-ddbfo)3Cl(CH3CN)2]·2CH3CN, [Na4(μ,η2-ddbfo)4(CH3CN)4] and [Zn2(μ,η1-ddbfo)2Cl2(py)2] aggregates","New Journal of Chemistry","2000","24","7","523","","10.1039/b001832p","","","0.71073","MoKα","","0.0621","0.0395","","","0.1069","0.1183","","","","","","1.101","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051293","9.855","0.004","8.836","0.005","18.068","0.006","90","","99.99","0.04","90","","1549.5","1.2","299","1","299","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H16 Cl N O2 Zn -","- C15 H16 Cl N O2 Zn -","- C60 H64 Cl4 N4 O8 Zn4 -","4","1","","Sobota, Piotr; Klimowicz, Maria; Utko, Józef; Jerzykiewicz, Lucjan B.","Syntheses and crystal structure of [Li4Zn(μ3,η2-ddbfo)2(μ,η2-ddbfo)3Cl(CH3CN)2]·2CH3CN, [Na4(μ,η2-ddbfo)4(CH3CN)4] and [Zn2(μ,η1-ddbfo)2Cl2(py)2] aggregates","New Journal of Chemistry","2000","24","7","523","","10.1039/b001832p","","","0.71073","MoKα","","0.0472","0.0261","","","0.0755","0.0809","","","","","","1.064","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051294","11.494","0.003","25.328","0.003","6.1281","0.0005","90","","90","","90","","1784","0.5","288.2","","288.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H27 N2 O3 -","- C18 H27 N2 O3 -","- C72 H108 N8 O12 -","4","1","","Kumagai, Hitoshi; Hosokoshi, Yuko; Markosyan, Ashot S.; Inoue, Katsuya","Synthesis and magnetic properties of a new complex made up of Mn(hfac)2 and a radical with a triplet ground state","New Journal of Chemistry","2000","24","7","537","","10.1039/b001840f","","","0.7107","MoKα","","0.0764","0.0669","","0.0855","0.083","","","","2.047","1.986","1.986","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051295","14.081","0.001","15.94","0.0011","16.0751","0.001","90","","90","","90","","3608.1","0.4","298","","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C28 H29 F12 Mn N2 O7 -","- C28 H29 F12 Mn N2 O7 -","- C112 H116 F48 Mn4 N8 O28 -","4","1","","Kumagai, Hitoshi; Hosokoshi, Yuko; Markosyan, Ashot S.; Inoue, Katsuya","Synthesis and magnetic properties of a new complex made up of Mn(hfac)2 and a radical with a triplet ground state","New Journal of Chemistry","2000","24","7","537","","10.1039/b001840f","","","0.71073","MoKα","","0.1584","0.069","","","0.1692","0.21","","","","","","0.859","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051296","13.7248","0.0019","13.7248","0.0019","10.859","0.002","90","","90","","90","","2045.4","0.6","123","2","123","2","","","","","","","","3","I -4","I -4","82","Methylpyrazine","","","- C5 H6 N2 -","- C5 H6 N2 -","- C80 H96 N32 -","16","2","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051297","7.8108","0.0014","6.5509","0.0014","12.164","0.003","90","","108.613","0.014","90","","589.9","0.2","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,3-Dimethylpyrazine","","","- C6 H8 N2 -","- C6 H8 N2 -","- C24 H32 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051298","5.7021","0.001","5.048","0.002","10.664","0.0016","90","","104.549","0.015","90","","297.12","0.14","183","2","183","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,5-Dimethylpyrazine","","","- C6 H8 N2 -","- C6 H8 N2 -","- C12 H16 N4 -","2","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","180066","2020-10-21","18:00:00",""
"7051299","7.5568","0.0001","10.8552","0.0001","7.4451","0.0001","90","","90.525","0.001","90","","610.7","0.013","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,6-Dimethylpyrazine","","","- C6 H8 N2 -","- C6 H8 N2 -","- C24 H32 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051300","9.1439","0.0017","10.243","0.002","15.212","0.003","90","","95.546","0.014","90","","1418.1","0.4","183","2","183","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Trimethylpyrazine","","","- C7 H10 N2 -","- C7 H10 N2 -","- C56 H80 N16 -","8","2","","","","New Journal of Chemistry","2000","","","","","10.1039/b001843k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051301","7.696","0.0001","7.781","0.0004","25.554","0.001","90","","90.239","0.001","90","","1530.2","0.2","294","","294","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H34 Fe2 N4 O8 -","- C32 H32 Fe2 N4 O8 -","- C64 H64 Fe4 N8 O16 -","2","0.5","","Dupont Karl","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051302","17.345","0.0004","13.816","0.0003","10.513","0.0003","90","","90","","90","","2519.3","0.2","294","","294","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C24 H36 Fe N4 O6 -","- C24 H24 Fe0.5 N4 O6 -","- C96 H96 Fe2 N16 O24 -","4","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7051303","5.799","0.008","9.962","0.007","11.54","0.02","102.12","0.08","104","0.1","103.66","0.08","602.8","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H30 Fe N4 O7 -","- C22 H28 Fe N4 O7 -","- C22 H28 Fe N4 O7 -","1","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051304","11.91","0.01","10.623","0.005","13.516","0.009","90","","107.96","0.08","90","","1626.7","1.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H38 Fe2 N4 O8 -","- C34 H38 Fe2 N4 O8 -","- C68 H76 Fe4 N8 O16 -","2","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051305","5.768","0.0006","10.553","0.001","11.536","0.001","109.374","0.001","94.184","0.001","90.998","0.001","660","0.2","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H36 Fe N4 O10 -","- C22 H26 Fe0.5 N4 O10 -","- C22 H26 Fe0.5 N4 O10 -","1","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b002061n","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7051306","13.559","0.002","14.745","0.003","16.186","0.001","90","","111.93","0.02","90","","3001.9","0.9","293","2","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C33 H29 Mn N3 O8 -","- C33 H29 Mn N3 O8 -","- C132 H116 Mn4 N12 O32 -","4","1","","Liliana Strinna Erre; Giovanni Micera; Eugenio Garribba; Attila Cs. Bényei","Molecular structure and spectral properties of bis(2,6-dimethoxybenzoato)(2,2':6',2″-terpyridine)manganese(II): a five-coordinate Mn(II) complex","New J. Chem.","2000","24","9","725","728","10.1039/b002119i","","","0.71073","MoKα","","","0.0588","","","0.1085","0.1475","","","","1.112","1.112","1.015","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051307","31.169","0.0013","5.462","0.0002","19.627","0.0008","90","","102.81","","90","","3258.2","0.2","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","1,7,10,16-Tetraoxa-4,13-diazacyclo-octadecane 1,8-diiodoperfluorooctane","","- C20 H26 F16 I2 N2 O4 -","- C20 H26 F16 I2 N2 O4 -","- C80 H104 F64 I8 N8 O16 -","4","0.5","","Navarrini, Walter; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe","Crown ethers as pre-organised exo-receptors in the divergent recognition of α,ω-diiodoperfluoroalkanes","New Journal of Chemistry","2000","24","10","777","","10.1039/b002247k","","","0.71069","MoKα","","0.0572","0.0413","","","0.1153","0.1242","","","","","","1.06","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051308","11.972","0.002","11.775","0.001","13.022","0.002","90","","100.92","0.01","90","","1802.5","0.4","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Cu N4 O7 -","- C18 H14 Cu N4 O7 -","- C72 H56 Cu4 N16 O28 -","4","1","","Ezuhara, Takayoshi; Endo, Ken; Matsuda, Kenji; Aoyama, Yasuhiro","One-dimensional chains consisting of copper(II) ions and an orthogonal anthracene-pyrimidine derivative: hierarchical formation of high-dimensional networks and their magnetic properties","New Journal of Chemistry","2000","24","8","609","","10.1039/b002315i","","","0.7107","MoKα","","","0.043","","","","0.0567","","","","","","1.043","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051309","13.734","0.004","7.248","0.003","22.423","0.003","90","","95.75","0.02","90","","2220.8","1.2","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Cu N4 O8 -","- C22 H24 Cu N4 O8 -","- C88 H96 Cu4 N16 O32 -","4","1","","Ezuhara, Takayoshi; Endo, Ken; Matsuda, Kenji; Aoyama, Yasuhiro","One-dimensional chains consisting of copper(II) ions and an orthogonal anthracene-pyrimidine derivative: hierarchical formation of high-dimensional networks and their magnetic properties","New Journal of Chemistry","2000","24","8","609","","10.1039/b002315i","","","0.7107","MoKα","","","0.045","","","","0.0789","","","","","","1.514","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051310","13.1","0.2","25.4","0.2","12","0.2","90","","90","","90","","3993","10","296.2","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H18 Cu N4 O8 -","- C19 H18 Cu N4 O8 -","- C152 H144 Cu8 N32 O64 -","8","1","","Ezuhara, Takayoshi; Endo, Ken; Matsuda, Kenji; Aoyama, Yasuhiro","One-dimensional chains consisting of copper(II) ions and an orthogonal anthracene-pyrimidine derivative: hierarchical formation of high-dimensional networks and their magnetic properties","New Journal of Chemistry","2000","24","8","609","","10.1039/b002315i","","","0.7107","MoKα","","","0.046","","","","0.0685","","","","","","1.147","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051311","9.284","0.0006","19.097","0.002","12.781","0.0007","90","","99.091","0.004","90","","2237.6","0.3","170","","170","","","","","","","","H2L-1 + [Ti(NBu-t)Cl2(py(3] in benzene","8","P 1 21/n 1","-P 2yn","14","","[Ti{i-Pr2(CH2CH2CH2N)[9]aneN3}Cl(OTf)]","","- C16 H32 Cl F3 N4 O3 S Ti -","- C16 H32 Cl F3 N4 O3 S Ti -","- C64 H128 Cl4 F12 N16 O12 S4 Ti4 -","4","1","","Male, Nigel A. H.; Skinner, Michael E. G.; Wilson, Paul J.; Mountford, Philip; Schröder, Martin","ansa-Linked titanium macrocycle–imido complexes","New Journal of Chemistry","2000","24","8","575","","10.1039/b002341h","","","0.71069","MoKα","","","0.0526","","","0.0359","","","","","1.17","1.17","","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7051312","25.504","0.004","20.498","0.003","19.688","0.003","90","","118.61","0.01","90","","9036","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C49 H45 Ag N7 O5 P -","- C49 H43 Ag N7 O5 P -","- C392 H344 Ag8 N56 O40 P8 -","8","1","","Sun, Wei-Yin; Xie, Jin; Mei, Yu-Hua; Yu, Kai-Bei","Synthesis and crystal structure of three-coordinated silver(I) and copper(I) complexes with N2P binding set containing a novel tripodal ligand: 1,3,5-tris(benzimidazol-2-ylmethyl)benzene","New Journal of Chemistry","2000","24","7","519","","10.1039/b002450n","","","0.71073","MoKα","","0.0762","0.0409","","0.1022","0.0898","","","","0.859","1.038","1.038","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051313","29.293","0.004","29.293","0.004","18.476","0.004","90","","90","","120","","13730","4","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C28 H34.33 Fe2 N6 Ni O1.17 S2 -","- C28 H34.34 Fe2 N6 Ni O1.16667 S2 -","- C504 H618.12 Fe36 N108 Ni18 O21 S36 -","18","1","","Fang Chen-jie; Duan Chun-ying; He Cheng; Han Gang; Meng Qing-jin","A supramolecular analog of cyclohexane sustained by aromatic C‒H···π interactions between ferrocene moieties: molecular packing of ferrocene-containing thiosemicarbazato metal complexes","New J. Chem.","2000","24","9","697","701","10.1039/b002590i","","","0.71073","MoKα","","0.1224","0.0683","","","0.1676","0.1994","","","","","","1.009","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051314","29.171","0.003","29.171","0.003","19.702","0.003","90","","90","","120","","14519","3","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C28 H34 Fe2 N6 O S2 Zn -","- C28 H34 Fe2 N6 O S2 Zn -","- C504 H612 Fe36 N108 O18 S36 Zn18 -","18","0.5","","Fang Chen-jie; Duan Chun-ying; He Cheng; Han Gang; Meng Qing-jin","A supramolecular analog of cyclohexane sustained by aromatic C‒H···π interactions between ferrocene moieties: molecular packing of ferrocene-containing thiosemicarbazato metal complexes","New J. Chem.","2000","24","9","697","701","10.1039/b002590i","","","0.71073","MoKα","","0.1339","0.0707","","","0.1622","0.1933","","","","","","1.042","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051315","14.2714","0.0008","15.7335","0.0009","17.2879","0.0009","113.553","0.001","104.959","0.001","97.734","0.001","3311.7","0.3","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H48 B F24 O3 P -","- C72 H48 B F24 O3 P -","- C144 H96 B2 F48 O6 P2 -","2","1","","Fang, Xinggao; Scott, Brian L.; John, Kevin D.; Kubas, Gregory J.; Watkin, John G.","Triphenylmethyl tris(p-methoxyphenyl)phosphonium cation: a structurally characterized phosphonium analog of hexaphenylethane","New Journal of Chemistry","2000","24","10","831","","10.1039/b003233f","","","0.71073","MoKα","","0.0835","0.064","","","0.1693","0.1793","","","","","","1.54","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051316","14.1573","0.0007","25.79","0.002","17.873","0.001","90","","108.646","0.001","90","","6183.2","0.7","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C58 H40 B Cl4 F24 O3 P -","- C58 H38 B Cl4 F24 O3 P -","- C232 H152 B4 Cl16 F96 O12 P4 -","4","1","","Fang, Xinggao; Scott, Brian L.; John, Kevin D.; Kubas, Gregory J.; Watkin, John G.","Triphenylmethyl tris(p-methoxyphenyl)phosphonium cation: a structurally characterized phosphonium analog of hexaphenylethane","New Journal of Chemistry","2000","24","10","831","","10.1039/b003233f","","","0.71073","MoKα","","0.0854","0.0685","","","0.2022","0.2149","","","","","","1.513","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051317","14.13","0.01","28.39","0.01","13.816","0.005","90","","116","3","90.08","","4981","13","294","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H43 B2 Cu2 F8 N8 O4 -","- C50 H40 B2 Cu2 F10 N9 O4 -","- C200 H160 B8 Cu8 F40 N36 O16 -","4","1","","Raymond Ziessel; Anthony Harriman; Abdelkrim El-ghayoury; Laurent Douce; Emmanuelle Leize; Hélène Nierengarten; Alain Van Dorsselaer","First assembly of copper(I) naphthyridine-based helicates","New J. Chem.","2000","24","10","729","732","10.1039/b003342l","","","0.71073","Mo-Kα","","","0.106","","","0.111","","","","","7.175","7.175","","","","","has coordinates","288182","2023-12-08","13:20:12",""
"7051318","8.14","0.001","16.191","0.001","14.008","0.002","90","","105.9","0.02","90","","1775.5","0.4","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 Au2 N8 Ni -","- C10 H18 Au2 N8 Ni -","- C40 H72 Au8 N32 Ni4 -","4","1","","Chu, Ivan K.; Shek, Iris P. Y.; Michael Siu, K. W.; Wong, Wing-Tak; Zuo, Jing-Lin; Lau, Tai-Chu","Synthesis, crystal structure and electrospray ionisation mass spectrometry of a novel one-dimensional cyano-bridged Ni(II)‒Au(I) polymer","New Journal of Chemistry","2000","24","10","765","","10.1039/b003673k","","","0.7107","MoKalpha","","","0.0569","","","0.0666","","","","","2.315","2.315","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051319","8.992","0.002","13.718","0.001","14.13","0.003","90","","103.87","0.02","90","","1692.1","0.6","293","2","293","2","","","","","","","aqueous synthesis","5","P 1 21/c 1","-P 2ybc","14","","catena-[(mu!2$-pyridin-3-onato-N,0)-{aqua-(pyridin-3-onato) (3-hydroxypyridine)-copper(II)}-water(1/2)]","","- C15 H19 Cu N3 O6 -","- C15 H19 Cu N3 O6 -","- C60 H76 Cu4 N12 O24 -","4","1","","Castillo, Oscar; Luque, Antonio; Iglesias, Sonia; Vitoria, Pablo; Román, Pascual","Synthesis, crystal structure, thermal behaviour and magnetic properties of a novel one-dimensional copper(II) complex containing neutral and deprotonated 3-hydroxypyridine ligands","New Journal of Chemistry","2000","24","10","771","","10.1039/b004072j","","","0.71069","MoKα","","0.0716","0.0373","","","0.0909","0.0972","","","","","","1.007","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051320","7.3724","0.001","14.696","0.003","15.93","0.002","90","","92.334","0.008","90","","1724.5","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H9 N3 O6 -","- C18 H9 N3 O6 -","- C72 H36 N12 O24 -","4","1","","Robinson, James M. A.; Philp, Douglas; Harris, Kenneth D. M.; Kariuki, Benson M.","Weak interactions in crystal engineering—understanding the recognition properties of the nitro group","New Journal of Chemistry","2000","24","10","799","","10.1039/b004086j","","","1.5406","","","0.0673","0.0599","","0.1695","0.1602","","","","1.106","1.109","1.109","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051321","9.646","0.002","6.904","0.002","16.131","0.004","90","","124.43","0.02","90","","886.1","0.4","50","1","50","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0743","0.0743","","","0.1823","0.1823","","","","","","1.097","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051322","9.725","0.002","6.938","0.002","16.147","0.004","90","","124.4","0.02","90","","898.9","0.4","150","1","150","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0736","0.0736","","","0.1793","0.1793","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051323","9.773","0.002","6.955","0.002","16.158","0.005","90","","124.36","0.02","90","","906.6","0.5","200","1","200","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0766","0.0766","","","0.1885","0.1885","","","","","","1.132","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051324","9.678","0.002","6.917","0.002","16.141","0.004","90","","124.39","0.02","90","","891.7","0.4","100","1","100","1","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1,8-dimethylnaphthalene","1,8-dimethylnaphthalene","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","1","","Wilson, Chick C.; Nowell, Harriott","Methyl group librations in sterically hindered dimethylnaphthalene molecules: neutron diffraction studies of 1,8-dimethylnaphthalene between 50 and 200 K","New Journal of Chemistry","2000","24","12","1063","","10.1039/b004123h","","neutron","","neutron","","0.0933","0.0933","","","0.2226","0.2226","","","","","","1.19","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051325","6.3087","0.0011","11.7069","0.0019","13.559","0.002","103.736","0.019","100.89","0.02","104.556","0.019","908","0.3","140","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H18 N3 O9 Tb -","- C15 H18 N3 O9 Tb -","- C30 H36 N6 O18 Tb2 -","2","1","","Christine Tedeschi; Claude Picard; Joëlle Azéma; Bruno Donnadieu; Pierre Tisnès","First crystal structure of a Tb3+ complex derived from an aromatic hydroxamate ligand: sensitized luminescence properties","New J. Chem.","2000","24","10","735","737","10.1039/b004288i","","","","MoK","","0.0251","0.0225","","","0.0518","0.0525","","","","","","1.065","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051326","8.833","0.0002","11.5202","0.0003","16.055","0.0004","103.698","","99.4508","0.0012","98.8901","0.0012","1533.49","0.07","113","","113","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H58 N2 O Os P2 -","- C26 H58 N2 O Os P2 -","- C52 H116 N4 O2 Os2 P4 -","2","1","","Yandulov, Dmitry V.; Huffman, John C.; Caulton, Kenneth G.","An osmium hydrido methyl species via an unconventional methyl transfer","New Journal of Chemistry","2000","24","9","649","650","10.1039/b004484i","","","0.71073","MoKα","","","0.0159","","","","0.0134","","","","","","0.5487","","","","has coordinates,has disorder","210967","2020-10-21","18:00:00",""
"7051327","7.307","0.003","9.337","0.002","14.654","0.004","101.79","0.02","97.75","0.02","103.75","0.03","932.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","[Cu(CH3COO)2(NITpPy)]2","","","- C16 H22 Cu N3 O6 -","- C16 H22 Cu N3 O6 -","- C32 H44 Cu2 N6 O12 -","2","1","","Iwayan Dasna; Stéphane Golhen; Lahcène Ouahab; Octavio Peña; Nathalie Daro","A dimeric Cu(II) acetate complex containing axially coordinated p-pyridyl nitronyl nitroxide radicals: [CuII(CH3COO)2(NITpPy)]2","New J. Chem.","2000","24","11","903","906","10.1039/b004491l","","","0.71073","MoKα","","0.0787","0.0369","","","0.0835","0.0962","","","","","","0.989","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051328","11.809","0.002","11.809","0.002","13.108","0.002","90","","90","","90","","1827.9","0.5","293","2","293","2","","","","","","","","6","I 4 2 2","I 4 2","97","Fe2[Mo(CN)8].8H20","","","- C8 H16 Fe2 Mo N8 O8 -","- C8 Fe2 Mo N8 O8 -","- C32 Fe8 Mo4 N32 O32 -","4","0.25","","Amandeep K. Sra; Guillaume Rombaut; Frédéric Lahitête; Stéphane Golhen; Lahcène Ouahab; Corine Mathonière; J. V. Yakhmi; (the late) Olivier Kahn","Hepta/octa cyanomolybdates with Fe2+: influence of the valence state of Mo on the magnetic behavior","New J. Chem.","2000","24","11","871","876","10.1039/b004566g","","","0.71073","MoKα","","0.0782","0.0555","","","0.1414","0.1482","","","","","","1.288","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051329","8.6698","0.0004","8.6698","0.0004","5.2977","0.0003","90","","90","","90","","398.2","0.03","100","2","100","2","","","","","","","","4","P -4 21 m","P -4 2ab","113","","","","- C4 H14 Br N3 -","- C4 H14 Br N3 -","- C8 H28 Br2 N6 -","2","0.25","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051330","8.6597","0.0006","8.7948","0.0004","11.9359","0.0008","90","","90","","90","","909.04","0.1","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C4 H15 Cl2 N3 -","- C4 H15 Cl2 N3 -","- C16 H60 Cl8 N12 -","4","0.5","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051331","11.6664","0.001","9.1552","0.0005","17.5536","0.0018","90","","90","","90","","1874.9","0.3","100","2","100","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C4 H15 Br2 N3 -","- C4 H15 Br2 N3 -","- C32 H120 Br16 N24 -","8","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051332","12.035","0.002","9.7006","0.0019","18.374","0.004","90","","90","","90","","2145.1","0.7","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C4 H15 I2 N3 -","- C4 H15 I2 N3 -","- C32 H120 I16 N24 -","8","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051333","5.1016","0.0007","21.343","0.003","4.744","0.0005","90","","90","","90","","516.54","0.12","100","2","100","2","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","","","- C4 H16 Cl3 N3 -","- C4 H16 Cl3 N3 -","- C8 H32 Cl6 N6 -","2","0.25","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051334","6.2094","0.0012","19.674","0.004","9.0026","0.0018","90","","93.39","0.03","90","","1097.9","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H16 Br3 N3 -","- C4 H16 Br3 N3 -","- C16 H64 Br12 N12 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051335","4.8037","0.001","11.005","0.002","10.871","0.002","90","","95.63","0.03","90","","571.9","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C5 H19 Br2 N3 O -","- C5 H18 Br2 N3 O -","- C10 H36 Br4 N6 O2 -","2","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051336","4.7197","0.0009","10.658","0.002","13.046","0.003","90","","93.25","0.03","90","","655.2","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 Cl N2 O -","- C3 H12 Cl N2 O -","- C12 H48 Cl4 N8 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051337","4.7413","0.0009","10.935","0.002","13.315","0.003","90","","91.77","0.03","90","","690","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 Br N2 O -","- C3 H12 Br N2 O -","- C12 H48 Br4 N8 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051338","4.8139","0.001","11.418","0.002","13.689","0.003","90","","90.48","0.03","90","","752.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 I N2 O -","- C3 H12 I N2 O -","- C12 H48 I4 N8 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051339","14.286","0.003","16.187","0.003","14.162","0.003","90","","90","","90","","3274.9","1.1","100","2","100","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C6 H24 Br4 N4 O -","- C6 H23 Br4 N4 O -","- C48 H184 Br32 N32 O8 -","8","","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051340","15.091","0.003","16.774","0.003","15.06","0.003","90","","90","","90","","3812.2","1.3","100","2","100","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C6 H24 I4 N4 O -","- C6 H23 I4 N4 O -","- C48 H184 I32 N32 O8 -","8","","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051341","5.5047","0.0011","11.895","0.002","10.41","0.002","90","","90.67","0.03","90","","681.6","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Cl N2 -","- C4 H12 Cl N2 -","- C16 H48 Cl4 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051342","5.9645","0.0012","12.573","0.003","9.4371","0.0019","90","","100.24","0.03","90","","696.4","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H12 Br N2 -","- C4 H12 Br N2 -","- C16 H48 Br4 N8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051343","8.6143","0.0017","8.7903","0.0018","13.772","0.003","90","","95.5","0.03","90","","1038.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H19 Br N4 -","- C6 H19 Br N4 -","- C24 H76 Br4 N16 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051344","8.5019","0.0017","9.6112","0.0019","14.84","0.003","90","","91.08","0.03","90","","1212.4","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H21 I N4 O -","- C6 H21 I N4 O -","- C24 H84 I4 N16 O4 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051345","10.875","0.0013","10.875","0.0013","10.875","0.0013","90","","90","","90","","1286.1","0.3","100","2","100","2","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","","","- C6 H21 Cl3 N4 -","- C6 H21 Cl3 N4 -","- C24 H84 Cl12 N16 -","4","0.333333","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051346","16.501","0.002","16.501","0.002","9.5919","0.0019","90","","90","","120","","2261.8","0.6","100","2","100","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","","","- C6 H21 I3 N4 -","- C6 H21 I3 N4 -","- C36 H126 I18 N24 -","6","0.333333","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051347","14.889","0.003","10.685","0.002","20.754","0.004","90","","105.92","0.03","90","","3175.2","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H46 Br8 N8 O2 -","- C12 H46 Br8 N8 O2 -","- C48 H184 Br32 N32 O8 -","4","1","","","","New Journal of Chemistry","2000","","","","","10.1039/b004641h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051348","15.29","0.003","9.609","0.002","16.956","0.003","90","","97.93","0.03","90","","2467.4","0.8","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C18 H28 Co0.5 N5 O8 -","- C18 H18 Co0.5 N5 O8 -","- C72 H72 Co2 N20 O32 -","4","1","","Ma, Jian-Fang; Liu, Jing-Fu; Liu, Ying-Chun; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua","Two new coordination polymers of Co(II) with 1,1'-(1,4-butanediyl)bis(benzimidazole)","New Journal of Chemistry","2000","24","10","759","","10.1039/b004787m","","","0.71073","MoKα","","0.1428","0.0637","","0.2438","","0.1458","","","0.85","","","1.096","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051349","9.603","0.002","15.914","0.003","15.723","0.003","90","","97.17","0.03","90","","2384","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Co N4 O7 -","- C22 H24 Co N4 O7 -","- C88 H96 Co4 N16 O28 -","4","1","","Ma, Jian-Fang; Liu, Jing-Fu; Liu, Ying-Chun; Xing, Yan; Jia, Heng-Qing; Lin, Yong-Hua","Two new coordination polymers of Co(II) with 1,1'-(1,4-butanediyl)bis(benzimidazole)","New Journal of Chemistry","2000","24","10","759","","10.1039/b004787m","","","0.71073","MoKα","","0.0745","0.0488","","0.1452","0.1374","","","","0.999","1.164","1.164","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051350","10.469","0.002","15.8692","0.0009","17.2811","0.0014","90","","90","","90","","2871","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H23 F3 O4 P2 Pd -","- C32 H23 F3 O4 P2 Pd -","- C128 H92 F12 O16 P8 Pd4 -","4","1","","Bedford, Robin B.; Draper, Sylvia M.; Noelle Scully, P.; Welch, Samantha L.","Palladium bis(phosphinite) 'PCP'-pincer complexes and their application as catalysts in the Suzuki reaction","New Journal of Chemistry","2000","24","10","745","","10.1039/b004793g","","","0.71073","MoKα","","0.1203","0.0863","","","0.2743","0.3108","","","","","","1.199","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051351","10.696","0.004","10.696","0.004","19.748","0.006","90","","90","","120","","1956.6","1.2","291","2","291","2","","","","","","","","6","P 32 1 2","P 32 2 (0 0 2)","153","","bis(4,5-diazafluorene thiosemicarbazato)nickel trihydrate","","- C24 H22 N10 Ni O3 S2 -","- C24 H22 N10 Ni O3 S2 -","- C72 H66 N30 Ni3 O9 S6 -","3","0.5","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.0413","0.037","","","0.088","0.0912","","","","","","1.109","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051352","12.2943","0.0014","14.67","0.002","15.508","0.002","91.439","0.014","99.301","0.012","106.954","0.012","2632.5","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","bis(fluorene-9-one thiosemicarbazato)nickel monohydrate","","- C28 H22 N6 Ni O S2 -","- C28 H22 N6 Ni O S2 -","- C112 H88 N24 Ni4 O4 S8 -","4","2","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.0552","0.042","","0.1225","0.1108","","","","1.007","1.027","1.027","","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051353","8.9236","0.0011","21.696","0.003","18.933","0.002","90","","100.772","0.012","90","","3601","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(fluorene-9-one S-phenyl-dithiocarbazato)nickel","","- C42 H30 N4 Ni S4 -","- C42 H28 N4 Ni S4 -","- C168 H112 N16 Ni4 S16 -","4","1","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.0858","0.049","","0.1571","0.1103","","","","1.074","1.083","1.083","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051354","10.594","0.003","8.5","0.004","38.598","0.007","90","","96.79","0.02","90","","3451","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(4,5-diazafluorene-9-one S-phenyl-dithiocarbazato)nickel","","- C38 H26 N8 Ni S4 -","- C38 H26 N8 Ni S4 -","- C152 H104 N32 Ni4 S16 -","4","1","","Liu Ze-hua; Duan Chun-ying; Li Ji-hui; Liu Yong-jiang; Mei Yu-hua; You Xiao-zeng","Structural dependence of π‒π interactions in dithiocarbazato and thiosemicarbazato nickel complexes","New J. Chem.","2000","24","12","1057","1062","10.1039/b004846l","","","0.71073","MoKα","","0.1588","0.0714","","","0.1519","0.183","","","","","","1.01","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051355","15.9302","0.001","10.8486","0.0007","11.3797","0.0007","90","","90","","90","","1966.6","0.2","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C12 H18 Ag2 N8 Ni O -","- C12 H16 Ag2 N8 Ni O -","- C48 H64 Ag8 N32 Ni4 O4 -","4","1","","Shek, Iris P. Y.; Wong, Wai-Yeung; Lau, Tai-Chu","A novel heterobimetallic Ni(II)‒Ag(I) cyano-bridged coordination polymer incorporating Ag···Ag interactions: {[Ni(cyclen)][Ag(CN)2]}[Ag(CN)2]","New Journal of Chemistry","2000","24","10","733","","10.1039/b004939p","","","0.71073","MoKα","","0.0233","0.0228","","","0.0637","0.0641","","","","","","1.035","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051356","13.683","0.003","22.229","0.005","10.367","0.004","90","","90.485","0.014","90","","3153.1","1.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H36 B22 Cl2 N2 S4 -","- C8 H36 B22 Cl2 N2 S4 -","- C32 H144 B88 Cl8 N8 S16 -","4","1","","Norman, Nicholas C.; Guy Orpen, A.; Quayle, Michael J.; Rice, Craig R.","Diborane(4) compounds incorporating thio- and seleno-carboranyl groups","New Journal of Chemistry","2000","24","11","837","","10.1039/b004942p","","","0.71073","MoKα","","0.1481","0.079","","0.2195","0.1895","","","","0.875","1.097","1.097","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051357","11.209","0.004","8.974","0.004","19.784","0.009","90","","94.14","0.04","90","","1984.9","1.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H29 B10 N3 S2 -","- C8 H29 B10 N3 S2 -","- C32 H116 B40 N12 S8 -","4","1","","Norman, Nicholas C.; Guy Orpen, A.; Quayle, Michael J.; Rice, Craig R.","Diborane(4) compounds incorporating thio- and seleno-carboranyl groups","New Journal of Chemistry","2000","24","11","837","","10.1039/b004942p","","","0.71073","MoKα","","0.2283","0.0931","","0.1908","0.1406","","","","1.009","1.146","1.146","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051358","19.521","0.006","21.945","0.005","11.965","0.002","90","","103.803","0.014","90","","4978","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H62 B32 Cl2 N4 Se6 -","- C14 H62 B32 Cl2 N4 Se6 -","- C56 H248 B128 Cl8 N16 Se24 -","4","1","","Norman, Nicholas C.; Guy Orpen, A.; Quayle, Michael J.; Rice, Craig R.","Diborane(4) compounds incorporating thio- and seleno-carboranyl groups","New Journal of Chemistry","2000","24","11","837","","10.1039/b004942p","","","0.71073","MoKα","","0.1433","0.0674","","0.1829","0.144","","","","1.019","1.135","1.135","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051359","7.559","0.002","4.997","0.002","10.293","0.002","116.96","0.03","91.55","0.03","100.31","0.03","338.3","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H24 N4 O4 -","- C10 H22 N4 O4 -","- C10 H22 N4 O4 -","1","0.5","","Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith","Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms","New J. Chem.","2000","24","12","959","966","10.1039/b005052k","","","0.71073","MoKα","","0.0362","0.0328","","","0.0924","0.0956","","","","","","1.087","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051360","5.2851","0.0002","8.0718","0.0004","9.5424","0.0005","109.126","0.003","104.189","0.003","97.989","0.003","362.03","0.03","112","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H22 Br2 N4 O2 -","- C10 H22 Br2 N4 O2 -","- C10 H22 Br2 N4 O2 -","1","0.5","","Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith","Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms","New J. Chem.","2000","24","12","959","966","10.1039/b005052k","","","0.71073","MoKα","","0.0271","0.0255","","","0.067","0.0682","","","","","","1.114","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051361","10.27","0.0002","16.169","0.0004","10.8995","0.0002","90","","106.9","0.001","90","","1731.76","0.06","112","2","112","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C10 H22 Cl2 N4 O10 -","- C10 H22 Cl2 N4 O10 -","- C40 H88 Cl8 N16 O40 -","4","1","","Laurent Frémond; Enrique Espinosa; Michel Meyer; Franck Denat; Roger Guilard; Volker Huch; Michael Veith","Synthesis, characterization and X-ray crystal structures of cyclam derivatives. Part IV. 1,4,8,11-Tetraazacyclotetradecane-5,12-dione and its diprotonated forms","New J. Chem.","2000","24","12","959","966","10.1039/b005052k","","","0.71073","MoKα","","0.0352","0.0316","","","0.0812","0.0835","","","","","","1.054","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051362","9.791","0.001","11.806","0.001","10.532","0.001","90","","112.779","0.007","90","","1122.4","0.2","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Cl2 Ru2 S2 -","- C20 H30 Cl2 Ru2 S2 -","- C40 H60 Cl4 Ru4 S4 -","2","0.5","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051363","9.9109","0.0007","11.9264","0.0008","10.5135","0.0005","90","","112.183","0.004","90","","1150.7","0.1","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 Cl2 Ru2 Se2 -","- C20 H30 Cl2 Ru2 Se2 -","- C40 H60 Cl4 Ru4 Se4 -","2","0.5","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051364","18.022","0.001","16.351","0.001","18.111","0.002","90","","118.101","0.005","90","","4708","0.7","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C47 H64 Ru4 S4 -","- C47 H56 Ru4 S4 -","- C188 H224 Ru16 S16 -","4","1","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051365","18.001","0.003","16.653","0.003","18.315","0.003","90","","118.661","0.01","90","","4817","1","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C47 H64 Ru4 Se4 -","- C47 H56 Ru4 Se4 -","- C188 H224 Ru16 Se16 -","4","1","","Seino, Hidetake; Mizobe, Yasushi; Hidai, Masanobu","Preparation of hydrosulfido- and hydroselenido-bridged diruthenium complexes with π-arene co-ligands and their conversion into new cubane-type sulfido or selenido clusters","New Journal of Chemistry","2000","24","11","907","911","10.1039/b005454m","","","","","","","","","","","","","","","","","","","","","has coordinates","218967","2020-10-21","18:00:00",""
"7051366","23.808","0.009","14.984","0.006","18.715","0.007","90","","94.265","0.005","90","","6658","4","163","2","163","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C60 H84 Cu4 I4 N6 -","- C60 H84 Cu4 I4 N6 -","- C240 H336 Cu16 I16 N24 -","4","1","","Fitchett, Christopher M.; Steel, Peter J.","Chiral heterocyclic ligands. Part 9. Homoconfigurational coordination polymers based on a C2-symmetric, linear-bridging ligand","New Journal of Chemistry","2000","24","12","945","","10.1039/b005881p","","","0.71073","MoKα","","0.0439","0.0414","","","0.1043","0.1057","","","","","","1.041","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051367","13.614","0.005","28.871","0.01","11.523","0.005","90","","90","","90","","4529","3","163","2","163","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C20.75 H32 Ag N3 O4.25 -","- C20.75 H32 Ag N3 O4.25 -","- C166 H256 Ag8 N24 O34 -","8","2","","Fitchett, Christopher M.; Steel, Peter J.","Chiral heterocyclic ligands. Part 9. Homoconfigurational coordination polymers based on a C2-symmetric, linear-bridging ligand","New Journal of Chemistry","2000","24","12","945","","10.1039/b005881p","","","0.71073","MoKα","","0.0674","0.036","","","0.0714","0.0771","","","","","","0.89","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051368","10.752","0.006","11.359","0.006","7.382","0.004","90","","90","","90","","901.6","0.8","163","2","163","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C20 H28 N2 -","- C20 H28 N2 -","- C40 H56 N4 -","2","0.5","","Fitchett, Christopher M.; Steel, Peter J.","Chiral heterocyclic ligands. Part 9. Homoconfigurational coordination polymers based on a C2-symmetric, linear-bridging ligand","New Journal of Chemistry","2000","24","12","945","","10.1039/b005881p","","","0.71073","MoKα","","0.0589","0.0439","","","0.1085","0.1148","","","","","","1.053","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051369","10.404","0.014","18.94","0.02","11.673","0.014","90","","105.8","0.01","90","","2213","5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N6 -","- C26 H20 N6 -","- C104 H80 N24 -","4","1","","Pal, Pankaj K.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","Metal-assisted electrocyclic reaction in a CN‒NC‒CN system","New Journal of Chemistry","2000","24","12","931","","10.1039/b006547l","","","0.71073","MoKα","","0.1218","0.0695","","","0.1867","0.2214","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051370","13.785","0.015","16.86","0.019","20.91","0.02","90","","102.037","0.01","90","","4753","9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H32 F12 N8 O P2 Ru -","- C44 H30 F12 N8 O P2 Ru -","- C176 H120 F48 N32 O4 P8 Ru4 -","4","1","","Pal, Pankaj K.; Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar","Metal-assisted electrocyclic reaction in a CN‒NC‒CN system","New Journal of Chemistry","2000","24","12","931","","10.1039/b006547l","","","0.71073","MoKα","","0.2252","0.1137","","","0.2809","0.3301","","","","","","1.073","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051371","16.9221","0.0007","11.4251","0.0004","8.6147","0.0003","90","","90","","90","","1665.54","0.11","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C14 H8 Co N8 -","- C14 H8 Co N8 -","- C56 H32 Co4 N32 -","4","0.5","","Sun, Bai-Wang; Gao, Song; Ma, Bao-Qing; Wang, Zhe-Ming","A two-fold interpenetrated three-dimensional cobalt(II) complex with dual dicyanamide and 4,4'-bipyridine bridges","New Journal of Chemistry","2000","24","12","953","","10.1039/b006602h","","","0.71073","MoKα","","0.097","0.0772","","","0.2543","0.2644","","","","","","1.179","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051372","33.672","0.002","12.308","0.0011","16.5","0.0013","90","","111.932","0.004","90","","6343.3","0.9","110","2","110","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C34 H58 Sm -","- C34 H58 Sm -","- C272 H464 Sm8 -","8","1","","Visseaux, Marc; Barbier-Baudry, Denise; Blacque, Olivier; Hafid, Abderrafia; Richard, Philippe; Weber, Frank","New base-free metallocenes of samarium and neodymium, an approach of the stereoelectronic control in organolanthanide chemistry","New Journal of Chemistry","2000","24","12","939","942","10.1039/B006834I","","","","","","","","","","","","","","","","","","","","","has coordinates","187703","2020-10-21","18:00:00",""
"7051373","8.498","0.002","28.893","0.005","10.265","0.001","90","","112.641","0.01","90","","2326.2","0.7","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C25 H37 Sm -","- C25 H37 Sm -","- C100 H148 Sm4 -","4","1","","Visseaux, Marc; Barbier-Baudry, Denise; Blacque, Olivier; Hafid, Abderrafia; Richard, Philippe; Weber, Frank","New base-free metallocenes of samarium and neodymium, an approach of the stereoelectronic control in organolanthanide chemistry","New Journal of Chemistry","2000","24","12","939","942","10.1039/B006834I","","","","","","","","","","","","","","","","","","","","","has coordinates","187703","2020-10-21","18:00:00",""
"7051374","19.021","0.003","8.377","0.003","29.023","0.003","90","","91.718","0.012","90","","4622.4","1.9","293","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","compound3","","","- C25 H37 Nd -","- C25 H37 Nd -","- C200 H296 Nd8 -","8","2","","Visseaux, Marc; Barbier-Baudry, Denise; Blacque, Olivier; Hafid, Abderrafia; Richard, Philippe; Weber, Frank","New base-free metallocenes of samarium and neodymium, an approach of the stereoelectronic control in organolanthanide chemistry","New Journal of Chemistry","2000","24","12","939","942","10.1039/B006834I","","","","","","","","","","","","","","","","","","","","","has coordinates","187703","2020-10-21","18:00:00",""
"7051375","8.884","0.003","11.352","0.004","16.041","0.006","93.353","0.008","92.003","0.008","97.681","0.011","1599","1","111","2","111","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H52 O P2 Ru -","- C31 H52 O P2 Ru -","- C62 H104 O2 P4 Ru2 -","2","1","","Coalter, Joseph N.; Bollinger, John C.; Eisenstein, Odile; Caulton, Kenneth G.","R-Group reversal of isomer stability for RuH(X)L2(CCHR) vs. Ru(X)L2(CCH2R): access to four-coordinate ruthenium carbenes and carbynes","New Journal of Chemistry","2000","24","12","925","","10.1039/b006971j","","","0.71073","MoKα","","0.0912","0.0553","","","0.1326","0.1401","","","","","","0.911","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051376","10.993","0.001","10.993","0.001","21.554","0.002","90","","90","","120","","2255.8","0.4","298.2","","298.2","","","","","","","","","5","P 3 c 1","P 3 -2""c","158","","","","- C35 H45 N8 Nd O18 -","- C35 H42 N8 Nd O18 -","- C70 H84 N16 Nd2 O36 -","2","0.333333","","Po-Wan Lai, Winnie; Wong, Wing-Tak","Trinitrato[N,N',N″-tris(2,3-dimethoxybenzamido)triethylamine]- neodymium(III). Synthesis, crystal structure and luminescence of a Nd complex containing tripodal amide ligands","New Journal of Chemistry","2000","24","12","943","","10.1039/b006976k","","","0.7107","MoKalpha","","","0.0422","","","0.0435","","","","","1.242","1.242","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051377","11.45","0.002","14.76","0.001","17.806","0.003","90","","96.54","0.02","90","","2989.7","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 Co2 N5 O8 -","- C30 H34 Co2 N5 O8 -","- C120 H136 Co8 N20 O32 -","4","1","","Hemmert, Catherine; Gornitzka, Heinz; Meunier, Bernard","Unprecedented amido-bridged dinuclear mixed-valence cobalt complexes: first structure of a dinuclear μ-OMe Co(II)/Co(III) complex","New Journal of Chemistry","2000","24","12","949","","10.1039/b007907n","","","0.71073","MoKα","","0.0618","0.0418","","","0.096","0.1039","","","","","","1.016","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051378","9.808","0.001","16.784","0.002","17.036","0.002","90","","102.02","0.01","90","","2742.9","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H29 Cl3 Co2 N5 O2 -","- C26 H29 Cl3 Co2 N5 O2 -","- C104 H116 Cl12 Co8 N20 O8 -","4","1","","Hemmert, Catherine; Gornitzka, Heinz; Meunier, Bernard","Unprecedented amido-bridged dinuclear mixed-valence cobalt complexes: first structure of a dinuclear μ-OMe Co(II)/Co(III) complex","New Journal of Chemistry","2000","24","12","949","","10.1039/b007907n","","","0.71073","MoKα","","0.0432","0.0312","","","0.0699","0.0742","","","","","","1.033","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051379","11.427","0.003","12.785","0.003","12.989","0.003","66.8","0.03","89.43","0.03","70.24","0.03","1624.7","0.9","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H40 Co N5 O10 -","- C30 H40 Co N5 O10 -","- C60 H80 Co2 N10 O20 -","2","1","","Hemmert, Catherine; Gornitzka, Heinz; Meunier, Bernard","Unprecedented amido-bridged dinuclear mixed-valence cobalt complexes: first structure of a dinuclear μ-OMe Co(II)/Co(III) complex","New Journal of Chemistry","2000","24","12","949","","10.1039/b007907n","","","0.71073","MoKα","","0.0939","0.0622","","","0.162","0.1817","","","","","","0.97","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051380","25.101","0.006","14.916","0.003","17.108","0.004","90","","107.11","0.02","90","","6122","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H61 Cl13 N6 Ti2 -","- C46 H61 Cl13 N6 Ti2 -","- C184 H244 Cl52 N24 Ti8 -","4","0.5","","Carmalt, Claire J.; Mileham, John D.; White, Andrew J. P.; Williams, David J.","Synthesis and characterisation of a bridging nitrido complex of titanium","New Journal of Chemistry","2000","24","12","929","","10.1039/b008211m","","","1.54178","CuKα","","0.0827","0.0664","","0.1897","0.1702","","","","1.048","1.084","1.084","","","","","has coordinates,has disorder","180067","2020-10-21","18:00:00",""
"7051381","28.534","0.008","15.244","0.008","12.982","0.008","90","","90","","90","","5646.8","4.8","213","2","213","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C64 H62 Co4 O16 -","- C64 H54 Co4 O16 -","- C256 H216 Co16 O64 -","4","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a806501b","","","","","","","0.0844","","","0.2333","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051382","7.952","0.002","11.592","0.003","13.97","0.01","67.77","0.04","88.13","0.04","84.3","0.02","1186.1","1","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H23 Cr O8 -","- C28 H23 Cr O8 -","- C56 H46 Cr2 O16 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a806501b","","","","","","","0.0404","","","0.0977","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051383","8.937","0.006","14.084","0.008","23.76","0.01","99.27","0.04","100.71","0.05","90.21","0.05","2898","3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H36 Co2 O10 -","- C28 H30.5 Co2 O10 -","- C112 H122 Co8 O40 -","4","2","","","","New Journal of Chemistry","1999","","","","","10.1039/a806501b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051384","25.066","0.004","9.615","0.003","13.945","0.008","90","","112.69","0.03","90","","3101","2","223","2","223","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H40 Cr2 O10 -","- C32 H28 Cr2 O10 -","- C128 H112 Cr8 O40 -","4","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a806501b","","","","","","","","","","","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
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"7051394","21.795","0.006","12.828","0.004","20.754","0.007","90","","105.19","0.02","90","","5599.8","3","293","2","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C52 H84 Li4 N8 O8 -","- C52 H84 Li4 N8 O8 -","- C208 H336 Li16 N32 O32 -","4","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a808050j","","","","","","","0.0536","","","0.1177","","","","","","","","","","","has coordinates","180067","2020-10-21","18:00:00",""
"7051395","12.753","0.006","20.394","0.007","11.09","0.006","98.18","0.04","108","0.04","85.5","0.04","2713.7","2.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H21 Li N2 O2 -","- C13 H21 Li N2 O2 -","- C104 H168 Li8 N16 O16 -","8","4","","","","New Journal of Chemistry","1999","","","","","10.1039/a808050j","","","","","","","0.0571","","","0.1314","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051396","14.831","0.002","16.848","0.004","5.4962","0.0014","90","","90","","90","","1373.3","0.5","100","","100","","","","","","","","","3","P c a 21","P 2c -2ac","29","4-methylpyrazole","","","- C4 H6 N2 -","- C4 H6 N2 -","- C48 H72 N24 -","12","3","","Richard Goddard; Rosa M. Claramunt; Consuelo Escolástico; José Elguero","Structure of NH-Pyrazoles Bearing Only C-Methyl Substituents: 4-Methylpyrazole is a Hydrogen-Bonded Trimer in the Solid","New Journal of Chemistry","1999","","","","","10.1039/a808186g","","","","","","","0.0364","","","0.0964","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051397","14.665","0.0005","14.5373","0.0007","17.101","0.0006","90","","90","","90","","3645.8","0.3","193","","193","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H20 N2 O4 W -","- C16 H20 N2 O4 W -","- C128 H160 N16 O32 W8 -","8","1","","Herrmann W. A.; Fridgen J.; Lobmaier G. M.; Spiegler M.","First tungsten complexes with 2'-pyridylalcoholate ligands: synthesis, structure and application as novel epoxidation catalysts","New Journal of Chemistry","1999","","","","","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051398","7.977","0.001","11.053","0.001","12.455","0.001","107.37","0.01","95.23","0.01","90.33","0.01","1043.1","0.2","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C13.5 H20 Au2 Cl3 N O2 S3 -","- C13.5 H20 Au2 Cl3 N O2 S3 -","- C27 H40 Au4 Cl6 N2 O4 S6 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a808494g","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051399","12.458","0.003","6.37","0.002","12.557","0.003","90","","90","","90","","996.5","0.5","200","2","293","2","","","","","","","","4","A b a 2","A 2 -2ab","41","","","","- C8 H8 O4 W -","- C8 H8 O4 W -","- C32 H32 O16 W4 -","4","","","","","New Journal of Chemistry","1999","","","","","10.1039/a808621d","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051400","12.557","0.003","6.37","0.0013","12.458","0.003","90","","90","","90","","996.5","0.3","293","2","293","2","","","","","","","","4","C m c a","-C 2ac 2","64","","","","- C8 H8 O4 W -","- C8 H8 O4 W -","- C32 H32 O16 W4 -","4","","","","","New Journal of Chemistry","1999","","","","","10.1039/a808621d","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051401","7.0387","0.0015","12.447","0.003","6.376","0.003","90","","116.938","0.018","90","","498","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 O4 W -","- C8 H8 O4 W -","- C16 H16 O8 W2 -","2","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a808621d","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051402","19.629","0.001","12.494","0.001","22.413","0.002","90","","95.96","0.007","90","","5467","0.7","298","2","298","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","[RuH(dcpe)2]PF6","","","- C52 H97 F6 P5 Ru -","- C52 H96 F6 P5 Ru -","- C208 H384 F24 P20 Ru4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a808860h","","","","","","","0.0457","","","0.0993","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051403","27.07","0.002","5.2154","0.0004","17.9202","0.0015","90","","130.256","0.001","90","","1930.8","0.3","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C4 H14 N3 O16 P4 Zn5 -","- C4 H14 N3 O16 P4 Zn5 -","- C16 H56 N12 O64 P16 Zn20 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a809030k","","","","","","","0.0389","","","0.0901","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
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"7051406","11.851","0.005","18.442","0.005","7.695","0.005","101.71","0.04","109.06","0.04","78.18","0.04","1539","1.3","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H21 Mn0.5 N4 S -","- C13 H21 Mn0.5 N4 S -","- C52 H84 Mn2 N16 S4 -","4","2","","","","New Journal of Chemistry","1999","","","","","10.1039/a809066a","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
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"7051417","16.874","0.003","20.477","0.004","31.705","0.006","90","","104.62","0.03","90","","10600","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C54 H40 B2 Fe N6 O6 S6 -","- C54 H43 B2 Fe N6 O6 S6 -","- C432 H344 B16 Fe8 N48 O48 S48 -","8","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a809881f","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051418","12.465","0.014","15.211","0.017","15.227","0.013","92.99","0.07","107.62","0.07","114.08","0.07","2460.6","4.5","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C96 H138 Li6 N12 O13 -","- C96 H138 Li6 N12 O13 -","- C96 H138 Li6 N12 O13 -","1","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a809942a","","","","","","","0.0578","","","0.1394","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051419","12.367","0.01","15.022","0.011","15.256","0.011","108.09","0.05","112.31","0.06","101.34","0.06","2327.4","3","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C92 H142 Li6 N12 O6 -","- C92 H142 Li6 N12 O6 -","- C92 H142 Li6 N12 O6 -","1","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a809942a","","","","","","","0.1063","","","0.2279","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051420","8.658","0.001","10.04","0.001","19.371","0.002","92.86","0.01","93.18","0.01","103.22","0.01","1633.3","0.3","150","2","150","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H59 Ir O2 P2 Ru -","- C28 H59 Ir O2 P2 Ru -","- C56 H118 Ir2 O4 P4 Ru2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a809943j","","","","","","","0.0236","","","0.0604","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051421","8.568","0.002","14.463","0.003","18.562","0.004","90","","96.62","0.03","90","","2284.8","0.9","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H24 Co Cu N8 S4 -","- C14 H24 Co Cu N8 S4 -","- C56 H96 Co4 Cu4 N32 S16 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a900125e","","","","","","","0.0465","","","0.0996","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051422","19.417","0.002","22.545","0.002","33.326","0.003","84.93","0.01","73.73","0.01","65.4","0.01","12727","2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C270 H360 N18 O3 Ru3 -","- C270 H360 N18 O3 Ru3 -","- C540 H720 N36 O6 Ru6 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a900344d","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051423","27.173","0.003","15.28","0.002","17.026","0.002","90","","107.06","","90","","6758.1","1.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H31 Co F6 N4 O5.5 -","- C28.2 H26.5 Co F6 N4 O5.05 -","- C225.6 H212 Co8 F48 N32 O40.4 -","8","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a900562e","","","","","","","0.0784","","","0.1838","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051424","11.8538","0.0014","7.4146","0.0008","19.448","0.006","90","","90.06","0.02","90","","1709.3","0.6","296","2","296","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C19 H25 Co1.33 N2.67 O8.33 -","- C19.6667 H24 Co1.33333 N2.66667 O8 -","- C59 H72 Co4 N8 O24 -","3","0.75","","","","New Journal of Chemistry","1999","","","","","10.1039/a900562e","","","","","","","0.0671","","","0.1892","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051425","15.278","0.002","15.278","0.002","15.218","0.003","90","","90","","90","","3552.1","1","293","2","293","2","","","","","","","","5","I 41/a :1","I 4bw -1bw","88","lead(II)diaquo-3,6-dicarboxylatopyridazine","","","- C6 H6 N2 O6 Pb -","- C6 H6 N2 O6 Pb -","- C96 H96 N32 O96 Pb16 -","16","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a900679f","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051426","14.273","0.001","15.693","0.001","16.714","0.001","82.139","0.001","81.123","0.001","73.674","0.001","3532.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C77 H91 N6 O12 P S -","- C77 H94 N6 O12 P S -","- C154 H188 N12 O24 P2 S2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a900890j","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051427","20.802","0.009","11.124","0.004","20.806","0.009","90","","119.27","0.04","90","","4200","3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","{[Co2(4-apy)3(NO3)4]CH2Cl2}","","","- C15.5 H13 Cl Co N8 O6 -","- C15.5 H13 Cl Co N8 O6 -","- C124 H104 Cl8 Co8 N64 O48 -","8","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a900947g","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051428","21.197","0.005","11.166","0.012","21.389","0.004","90","","122.24","0.02","90","","4282","5","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Cd2(4-apy)3(NO3)4](CH2Cl2)(H2O)2","","","- C15.5 H15 Cd Cl N8 O7 -","- C15.5 H13 Cd Cl N8 O7 -","- C124 H104 Cd8 Cl8 N64 O56 -","8","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a900947g","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051429","7.853","0.001","15.937","0.001","9.993","0.001","90","","95.65","0.01","90","","1244.6","0.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H7 N O4 S Zn -","- C11 H7 N O4 S Zn -","- C44 H28 N4 O16 S4 Zn4 -","4","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.025","","","0.065","","","","","","","","","","","has coordinates","198588","2020-10-21","18:00:00",""
"7051430","8.595","0.003","9.491","0.003","12.748","0.006","69.31","0.03","85.99","0.03","67.59","0.02","896.9","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H15 N2 O6.5 S Zn -","- C16 H15 N2 O6.5 S Zn -","- C32 H30 N4 O13 S2 Zn2 -","2","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","","","","","","","","","","","","","","","has coordinates","198589","2020-10-21","18:00:00",""
"7051431","10.977","0.002","15.558","0.002","11.376","0.003","90","","116.36","0.03","90","","1740.7","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 N2 O5 S Zn -","- C18 H12 N2 O5 S Zn -","- C72 H48 N8 O20 S4 Zn4 -","4","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0235","","","0.0646","","","","","","","","","","","has coordinates","198588","2020-10-21","18:00:00",""
"7051432","10.917","0.002","15.711","0.002","11.33","0.002","90","","116.01","0.03","90","","1746.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 Co N2 O5 S -","- C18 H12 Co N2 O5 S -","- C72 H48 Co4 N8 O20 S4 -","4","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0419","","","0.0865","","","","","","","","","","","has coordinates","198589","2020-10-21","18:00:00",""
"7051433","8.031","0.002","18.113","0.006","21.755","0.006","90","","90","","90","","3165","2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H10 Mn N2 O4 S -","- C18 H10 Mn N2 O4 S -","- C144 H80 Mn8 N16 O32 S8 -","8","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0428","","","0.0874","","","","","","","","","","","has coordinates","198588","2020-10-21","18:00:00",""
"7051434","7.349","0.001","18.165","0.001","6.721","0.001","90","","90","","90","","897.3","0.1","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H6 Mn O6 S -","- C6 H6 Mn O6 S -","- C24 H24 Mn4 O24 S4 -","4","0.5","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0238","","","0.0602","","","","","","","","","","","has coordinates","198589","2020-10-21","18:00:00",""
"7051435","12.5133","0.0008","27.125","0.002","16.0006","0.001","90","","92.529","0.001","90","","5425.6","0.6","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C48 H48 Cl2 F12 Fe2 N8 O P2 -","- C48 H48 Cl2 F12 Fe2 N8 O P2 -","- C192 H192 Cl8 F48 Fe8 N32 O4 P8 -","4","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a901893j","","","","","","","0.0942","","","0.2014","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051436","17.0596","0.0002","11.1202","0.0002","28.8769","0.0004","90","","90","","90","","5478.13","0.14","193","2","193","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C24 H24 Cl2 F6 Fe N4 P -","- C24 H24 Cl2 F6 Fe N4 P -","- C192 H192 Cl16 F48 Fe8 N32 P8 -","8","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a901893j","","","","","","","0.0687","","","0.1923","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051437","7.161","0.002","8.296","0.003","11.377","0.003","77.42","0.03","82.78","0.03","68.75","0.03","614","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C30 H34 N2 O6 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a901896d","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051438","7.0349","0.0003","7.2332","0.0003","11.1518","0.0005","88.71","0.001","81.733","0.001","63.012","0.001","499.82","0.04","208","2","208","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H6 Cr O5 -","- C10 H6 Cr O5 -","- C20 H12 Cr2 O10 -","2","1","","","pi-Bonded organometallic building blocks for supramolecular chemistry.","New Journal of Chemistry","1999","","","","","10.1039/a901925a","","","","","","","0.0449","","","0.0981","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051439","11.6029","0.0003","13.0537","0.0002","15.2638","0.0002","87.472","0.001","75.734","0.001","86.752","0.001","2235.89","0.07","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H24 Cr O10 -","- C20 H24 Cr O10 -","- C80 H96 Cr4 O40 -","4","2","","","pi-Bonded organometallic building blocks for supramolecular chemistry.","New Journal of Chemistry","1999","","","","","10.1039/a901925a","","","","","","","0.1101","","","0.2674","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051440","14.646","0.002","8.597","0.002","10.128","0.002","90","","105.45","0.01","90","","1229.2","0.4","298.2","","298.2","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C22 H32 Cl2 N2 O2 Zn -","- C44 H64 Cl4 N4 O4 Zn -","- C88 H128 Cl8 N8 O8 Zn2 -","2","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a902177i","","","","","","","0.0505","","","0.0508","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051441","9.622","0.004","15.155","0.005","9.522","0.003","101.21","0.03","95.9","0.04","108.32","0.03","1272.9","0.9","153.2","","153.2","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H35 B N O -","- C30 H35 B N O -","- C60 H70 B2 N2 O2 -","2","1","","Toshihiro Murafuji","","New Journal of Chemistry","1999","","","","","10.1039/a902282a","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051442","9.491","0.004","11.884","0.003","12.912","0.003","90","","108.35","0.02","90","","1382.3","0.7","153.2","","153.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","4""-dimethylamino-1,3-diphenylpropen-1-one","","","- C17 H17 N O -","- C17 H17 N O -","- C68 H68 N4 O4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a902282a","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051443","13.281","0.001","13.328","0.001","19.818","0.001","105.4","0.01","92.78","0.01","113.24","0.01","3060.7","0.4","173","0.1","173","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C25 H17 Cl11 O4 -","- C25 H17 Cl11 O4 -","- C100 H68 Cl44 O16 -","4","2","","Kolehmainen, Erkki; Koivisto, Jari; Nissinen Maij; Laihia, Katri; Rissanen, Kari","","New Journal of Chemistry","1999","","","","","10.1039/a902627d","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051444","15.134","0.001","13.357","0.001","15.331","0.001","90","","118.89","0.01","90","","2713.4","0.3","173","0.1","173","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H16 Cl8 O4 -","- C24 H16 Cl8 O4 -","- C96 H64 Cl32 O16 -","4","1","","Kolehmainen, Erkki; Koivisto, Jari; Nissinen Maij; Laihia, Katri; Rissanen, Kari","","New Journal of Chemistry","1999","","","","","10.1039/a902627d","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051445","13.3168","0.0006","13.4648","0.0006","18.2628","0.0008","109.01","","96.129","0.001","113.859","0.001","2721.6","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C60.5 H53 N3 O1.5 P4 Pt Se -","- C60.5 H51 N3 O1.5 P4 Pt Se -","- C121 H102 N6 O3 P8 Pt2 Se2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a902738f","","","","","","","0.0359","","","0.0824","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051446","9.8531","0.0003","13.4561","0.0004","15.5289","0.0005","102.982","0.001","94.774","0.001","110.61","0.001","1847.89","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H35 N2 O P3 Pd S -","- C42 H35 N2 O P3 Pd S -","- C84 H70 N4 O2 P6 Pd2 S2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a902738f","","","","","","","0.049","","","0.1157","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051447","9.0446","0.0003","11.5989","0.0003","19.1145","0.0006","91.803","0.001","95.279","0.001","104.479","0.001","1930.24","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H36 Au N2 O P3 S -","- C42 H36 Au N2 O P3 S -","- C84 H72 Au2 N4 O2 P6 S2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a902738f","","","","","","","0.0413","","","0.1006","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051448","10.7499","0.0003","13.9705","0.0004","16.7686","0.0004","112.019","0.001","99.431","0.001","98.635","0.001","2240.61","0.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C43.25 H39.25 Cl0.75 N2 O P3 Pt S -","- C43.25 H39 Cl0.75 N2 O P3 Pt S -","- C86.5 H78 Cl1.5 N4 O2 P6 Pt2 S2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a902738f","","","","","","","0.0438","","","0.0994","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051449","6.865","0.001","10.751","0.002","24.7","0.004","90","","92.26","0.02","90","","1821.6","0.5","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 Cr Fe O8 -","- C16 H12 Cr Fe O8 -","- C64 H48 Cr4 Fe4 O32 -","4","1","","Behrendt, U.; Pfeifer, R.-M..; Wartchow, R.; Butenschön, H.","Some bimetallic half sandwich iron complexes with metal carbene substitution at the cyclopentadienyl ligand : Synthesis, characterization, structure, and cyclic voltammetry","New Journal of Chemistry","1999","","","","","10.1039/a902815c","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051450","11.257","0.002","8.671","0.001","14.644","0.002","90","","107.33","0.02","90","","1364.5","0.3","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 Cl3 Fe N3 -","- C11 H11 Cl3 Fe N3 -","- C44 H44 Cl12 Fe4 N12 -","4","1","","Michael Renz; Catherine Hemmert; Heinz Gornitzka; Bernard Meunier","Influence of the anion of FeIII salts on the product distribution in the oxidative degradation of a tetrapyridyl ligand","New Journal of Chemistry","1999","","","","","10.1039/a902907i","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051451","9.21","0.01","9.779","0.011","22.6","0.02","90","","90","","90","","2035","4","293","2","293","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C10 H22 Cl F6 O P Ru S5 -","- C10 H22 Cl F6 O P Ru S5 -","- C40 H88 Cl4 F24 O4 P4 Ru4 S20 -","4","0.5","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates","277928","2022-09-16","20:08:52",""
"7051452","10.391","0.011","20.94","0.02","11.488","0.013","90","","90.38","0.01","90","","2499","5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H22 F12 N2 P2 Ru S4 -","- C12 H22 F12 N2 P2 Ru S4 -","- C48 H88 F48 N8 P8 Ru4 S16 -","4","1","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051453","12.264","0.015","9.189","0.011","8.822","0.01","90","","96.02","0.01","90","","989","2","293","2","293","2","","","","","","","","8","C 1 m 1","C -2y","8","","","","- C10 H19 Cl F6 N P Ru S4 -","- C10 H19 Cl F6 N P Ru S4 -","- C20 H38 Cl2 F12 N2 P2 Ru2 S8 -","2","0.5","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051454","7.655","0.009","15.928","0.017","21.47","0.02","90","","90","","90","","2618","5","293","2","293","2","","","","","","","","8","P c 21 b","","","","","","- C17 H25 Cl F6 N3 P Ru S4 -","- C17 H25 Cl F6 N3 P Ru S4 -","- C68 H100 Cl4 F24 N12 P4 Ru4 S16 -","4","1","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051455","19.95","0.02","14.86","0.016","21.52","0.02","90","","90","","90","","6382","12","293","2","293","2","","","","","","","","7","P c a b","-P 2bc 2ac","61","","","","- C26 H28 F12 N2 P2 Ru S4 -","- C26 H28 F12 N2 P2 Ru S4 -","- C208 H224 F96 N16 P16 Ru8 S32 -","8","1","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates","277928","2022-09-16","20:08:55",""
"7051456","18.89","0.02","11.713","0.013","15.908","0.018","90","","104.06","0.01","90","","3415","7","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 F12 N4 O2 P2 Ru S4 -","- C24 H28 F12 N4 O2 P2 Ru S4 -","- C96 H112 F48 N16 O8 P8 Ru4 S16 -","4","0.5","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051457","10.207","0.001","14.45","0.001","17.827","0.001","81.979","0.001","85.967","0.001","88.873","0.001","2597","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H54 N4 O7 Zn -","- C64 H54 N4 O7 Zn -","- C128 H108 N8 O14 Zn2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051458","12.182","0.001","12.431","0.001","17.077","0.001","70.652","0.001","82.999","0.001","87.552","0.001","2421.8","0.3","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C59 H52 N4 O6 Zn -","- C59 H50 N4 O6 Zn -","- C118 H100 N8 O12 Zn2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051459","9.019","0.001","10.747","0.001","16.206","0.001","83.067","0.001","80.648","0.001","77.566","0.001","1507.6","0.2","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C64 H67 N4 Na O18 Zn -","- C64 H62 N4 Na O18 Zn -","- C64 H62 N4 Na O18 Zn -","1","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051460","12.448","0.001","15.412","0.001","16.307","0.001","100.549","0.01","90.827","0.01","100.268","0.01","3022.8","0.4","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C64 H67 K N4 O18 Zn -","- C64 H63 K N4 O18 Zn -","- C128 H126 K2 N8 O36 Zn2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051461","8.168","0.001","9.279","0.002","9.875","0.002","65.47","0.02","80.99","0.01","67.69","0.01","629.9","0.2","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","(±)-longamide B methyl ester","","","- C10 H10 Br2 N2 O3 -","- C10 H10 Br2 N2 O3 -","- C20 H20 Br4 N4 O6 -","2","1","","Banwell, Martin, G.; Bray, Andrew M.; Willis, Anthony C.; Wong, David J.","First Syntheses of the Pyrroloketopiperazine Marine Natural Products (±)-Longamide, (±)-Longamide B Methyl Ester and and (±)-Hanishin.","New Journal of Chemistry","1999","","","","","10.1039/a903330k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051462","12.047","0.002","14.647","0.003","21.254","0.004","80.68","0.02","83.04","0.03","76.34","0.03","3582.7","1.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C10 H75 Mn Mo12 N10 Na O69 P8 -","- C10 H50 Mn Mo12 N10 Na O69 P8 -","- C20 H100 Mn2 Mo24 N20 Na2 O138 P16 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a903589c","","","","","","","0.0502","","","0.1254","","","","","","","","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7051463","12.437","0.004","13.441","0.004","19.06","0.006","90","","102.05","0.03","90","","3116","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H41 Cl N P2 S Tc -","- C32 H41 Cl N P2 S Tc -","- C128 H164 Cl4 N4 P8 S4 Tc4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a903679b","","","","","","","0.0433","","","0.0993","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051464","10.528","0.009","11.731","0.009","24.25","0.01","90","","95.32","0.08","90","","2982","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H52 N P2 S2 Tc -","- C28 N P2 S2 Tc -","- C112 N4 P8 S8 Tc4 -","4","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a903679b","","","","","","","0.0779","","","0.2038","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051465","17.52","0.002","11.007","0.001","9.9","0.001","90","","93.9","0.01","90","","1904.7","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 O2 S2 -","- C21 H26 O2 S2 -","- C84 H104 O8 S8 -","4","1","","Thiemann, Thies; Ohira, Daisuke; Li, Yuanqiang; Sawada, Tsuyoshi; Taniguchi, Masahiko; Tashiro, Masashi; Mataka, Shuntaro","","New Journal of Chemistry","1999","","","","","10.1039/a903746b","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051466","7.803","0.001","9.474","0.001","17.819","0.004","90","","90","","90","","1317.3","0.4","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H14 N4 -","- C15 H14 N4 -","- C60 H56 N16 -","4","1","","","Crystal Structures of Amino substituted dicyanoquinodimethanes with Potential Nonlinear Optical Applications","New Journal of Chemistry","1999","","","","","10.1039/a903793d","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051467","10.114","0.001","14.412","0.002","12.142","0.002","90","","113.634","0.006","90","","1621.4","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 F4 N4 -","- C18 H16 F4 N4 -","- C72 H64 F16 N16 -","4","1","","","Crystal Structures of Amino substituted dicyanoquinodimethanes with Potential Nonlinear Optical Applications","New Journal of Chemistry","1999","","","","","10.1039/a903793d","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051468","18.136","0.004","11.396","0.002","19.734","0.004","90","","94.21","0.03","90","","4067.6","1.4","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 Cl F9 P -","- C19 H17 Cl F9 P -","- C152 H136 Cl8 F72 P8 -","8","2","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","","","","","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180068","2020-10-21","18:00:00",""
"7051469","13.136","0.004","13.253","0.003","17.247","0.004","88.8","0.01","68.28","0.01","75.47","0.01","2691.5","1.2","188","2","188","2","","","","","","","","5","P -1","-P 1","2","","","","- C46.5 H20 F36 Se4 Sn -","- C46.5 H20 F36 Se4 Sn -","- C93 H40 F72 Se8 Sn2 -","2","1","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","","","","","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051470","8.874","0.001","17.781","0.002","13.383","0.001","90","","97.22","0.01","90","","2094.9","0.4","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H4 F18 Te -","- C18 H4 F18 Te -","- C72 H16 F72 Te4 -","4","1","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","","","","","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180068","2020-10-21","18:00:00",""
"7051471","16.504","0.001","16.504","0.001","30.677","0.002","90","","90","","90","","8355.9","0.9","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C36 H8 Ag4 F36 -","- C36 H8 Ag4 F36 -","- C288 H64 Ag32 F288 -","8","0.5","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","","","","","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180068","2020-10-21","18:00:00",""
"7051472","16.085","0.005","14.361","0.005","19.564","0.005","90","0.005","94.39","0.005","90","0.005","4506","2","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C40 H40 Cl2 F12 N2 P4 Pd -","- C40 H38 Cl2 F12 N2 P4 Pd -","- C160 H152 Cl8 F48 N8 P16 Pd4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a903823j","","","","","","","0.088","","","0.2134","","","","","","","","","","","has coordinates,has disorder","180068","2020-10-21","18:00:00",""
"7051473","15.742","0.002","17.522","0.002","21.814","0.003","90","","91.08","0.01","90","","6015.9","1.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C68 H58 N4 O22 -","- C68 H58 N4 O22 -","- C272 H232 N16 O88 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a904174e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","180068","2020-10-21","18:00:00",""
"7051474","8.8547","0.0009","10.1535","0.001","17.8903","0.0019","90.192","0.011","94.987","0.011","106.811","0.011","1533.2","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H8 F24 N8 -","- C20 H8 F24 N8 -","- C40 H16 F48 N16 -","2","1","","Alkorta, Ibon; Elguero, Jose; Donnadieu, Bruno; Jaffart, Joëlle; Schagen, David; Limbach, Hans-Heinrich","The structure of 3,5-bis(trifluoromethyl)pyrazole in the gas phase and in the solid state","New Journal of Chemistry","1999","23","","1231","1237","10.1039/a904292j","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","133688","2020-10-21","18:00:00",""
"7051475","29.084","0.009","14.692","0.004","11.795","0.001","90","","90","","90","","5040","3","173","","173","","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C114 H102 Cu2 F12 N8 O14 P2 -","- C113 H101 Cu F12 N8 O14 P2 -","- C226 H202 Cu2 F24 N16 O28 P4 -","2","0.5","","Dietrich-Buchecker Christiane; Sauvage Jean-Pierre; Hwang Neri Geum","A trefoil knot coordinated to two lithium ions : synthesis and structure","New Journal of Chemistry","1999","","","","","10.1039/a904476k","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7051476","12.5569","0.001","13.0513","0.0005","16.5008","0.0005","80.481","0.005","70.949","0.005","82.328","0.005","2511.7","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C51.5 H69 N4 Nb O2 -","- C51.5 H69 N4 Nb O2 -","- C103 H138 N8 Nb2 O4 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a904579a","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051477","13.67","0.002","20.289","0.014","19.765","0.011","90","","92.26","0.03","90","","5477.6","4.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H84 N5 Nb O2 -","- C56 H84 N5 Nb O2 -","- C224 H336 N20 Nb4 O8 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a904579a","","","","","","","0.0479","","","0.1165","","","","","","","","","","","has coordinates,has disorder","180068","2020-10-21","18:00:00",""
"7051478","24.826","0.002","39.023","0.003","14.233","0.004","90","0.005","90","0.008","90","0.012","13789.3","3.6","173","2","173","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C28.5 H34 B Cl4 Mo N8 O2 -","- C28.5 H31 B Cl4 Mo N8 O2 -","- C456 H496 B16 Cl64 Mo16 N128 O32 -","16","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a904599f","","","","","","","0.0511","","","0.1031","","","","","","","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051479","8.3816","0.0013","12.774","0.003","13.902","0.003","108.66","0.02","93.351","0.014","91.54","0.02","1406.2","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C22.5 H29.5 B Cl Mo N9 O -","- C22.5 H29 B Cl Mo N9 O -","- C45 H58 B2 Cl2 Mo2 N18 O2 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a904599f","","","","","","","0.0357","","","0.101","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051480","12.5797","0.0015","12.5797","0.0015","12.5797","0.0015","91.644","0.017","91.644","0.017","91.644","0.017","1988.2","0.4","150","2","150","2","","","","","","","","4","R -3 m :R","-P 3* 2","166","Ti3O(OPri)(O3C9H15)","","","- C30 H64 O11 Ti3 -","- C29.97 O11 Ti3 -","- C59.94 O22 Ti6 -","2","0.166667","","","","New Journal of Chemistry","1999","","","","","10.1039/a904760c","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051481","25.56","0.002","14.1881","0.0006","26.618","0.002","90","","108.478","0.007","90","","9155.3","1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ti11O13(OPri)18","","","- C54 H126 O31 Ti11 -","- C51.03 O31 Ti11 -","- C204.12 O124 Ti44 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a904760c","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051482","16.714","0.002","14.082","0.001","24.612","0.002","90","","100.78","0.02","90","","5690.6","1","298.2","","298.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C36 H76 Cu3 N28 O2 Pt3 -","- C36 H72 Cu3 N28 O2 Pt3 -","- C144 H288 Cu12 N112 O8 Pt12 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a905080i","","","","","","","0.0485","","","0.056","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051483","7.3207","0.0001","11.0326","0.0002","23.3628","0.0004","81.49","0.001","86.265","0.001","84.381","0.001","1854.73","0.05","222","2","222","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H30 In2 Se6 -","- C36 H30 In2 Se6 -","- C72 H60 In4 Se12 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a905250j","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051484","7.877","0.001","8.781","0.002","10.444","0.002","110.69","0.02","95.24","0.01","103.48","0.02","645.1","0.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C10 H36 Cl2 Nd2 O20 -","- C10 H12 Cl2 Nd2 O20 -","- C10 H12 Cl2 Nd2 O20 -","1","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a905284d","","","","","","","0.0347","","","0.0978","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051485","11.057","0.002","26.977","0.005","17.087","0.003","90","","104.63","0.03","90","","4931.5","1.5","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C43 H46 Cl4 Fe N2 O10 P2 Pd Si -","- C43 H46 Cl4 Fe N2 O10 P2 Pd Si -","- C172 H184 Cl16 Fe4 N8 O40 P8 Pd4 Si4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a905842g","","","","","","","0.0577","","","0.1572","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051486","6.348","0.0001","9.5489","0.0001","18.2304","0.0003","90","","90","","90","","1105.06","0.03","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H9 N O5 Zn -","- C9 H9 N O5 Zn -","- C36 H36 N4 O20 Zn4 -","4","1","","Hoong-Kun Fun; S.Shanmuga Sundara Raj; Ren-Gen Xiong; Jing-Lin Zuo; Xiao-Zeng You","(S-(-)-Lactate)(isonicotinato)zinc(II): Structure and Second Harmonic Generation Property if a Chiral Two-dimensional Metal-organic coordination Polymer","New Journal of Chemistry","1999","","","","","10.1039/a905955e","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051487","11.263","0.002","6.863","0.002","14.267","0.002","90","","94.01","0.01","90","","1100.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 Br N3 O -","- C10 H8 Br N3 O -","- C40 H32 Br4 N12 O4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051488","7.565","0.002","14.423","0.002","19.793","0.003","90","","90","","90","","2159.6","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C88 H88 N24 O8 -","8","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051489","12.72","0.002","6.954","0.001","14.783","0.003","90","","111.61","0.01","90","","1215.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 N2 O4 -","- C12 H14 N2 O4 -","- C48 H56 N8 O16 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051490","8.302","0.001","8.516","0.002","9.333","0.002","99.5","0.02","97.06","0.02","108.21","0.02","607.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N3 O3 -","- C12 H11 N3 O3 -","- C24 H22 N6 O6 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051491","12.651","0.002","14.571","0.002","6.649","0.001","90","","90","","90","","1225.7","0.3","293","2","293","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C12 H11 N3 O3 -","- C12 H11 N3 O3 -","- C48 H44 N12 O12 -","4","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051492","11.411","0.002","13.828","0.003","15.143","0.002","90","","98.45","0.01","90","","2363.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 N4 O8 -","- C24 H24 N4 O8 -","- C96 H96 N16 O32 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051493","5.427","0.005","5.828","0.005","7.649","0.005","91.97","0.005","95.84","0.005","107.41","0.005","229.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","methanesulfonic acid hidrazide","","","- C H6 N2 O2 S -","- C H6 N2 O2 S -","- C2 H12 N4 O4 S2 -","2","1","","","Structure and Vibrational Spectroscopy of Methanesulfonic Acid Hydrazide: an Experimental and Theoretical Study","New Journal of Chemistry","1999","","","","","10.1039/a906264e","","","","","","","0.06","","","0.213","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051494","10.3","0.003","10.286","0.003","18.917","0.005","90","","99.77","0.007","90","","1975.1","1","233","2","233","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H26 B N6 Tl -","- C17 H26 B N6 Tl -","- C68 H104 B4 N24 Tl4 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a906292k","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051495","4.5137","0.0012","7.925","0.002","8.898","0.002","90","","99.173","0.004","90","","314.24","0.14","173","2","173","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Cl2 N -","- C5 H5 Cl2 N -","- C10 H10 Cl4 N2 -","2","0.5","","Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel","Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides","New Journal of Chemistry","1999","","","","","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051496","4.4705","0.0012","8.253","0.002","9.398","0.002","90","","98.945","0.006","90","","342.49","0.16","143","2","143","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Br2 N -","- C5 H5 Br2 N -","- C10 H10 Br4 N2 -","2","0.5","","Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel","Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides","New Journal of Chemistry","1999","","","","","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","180068","2020-10-21","18:00:00",""
"7051497","4.5303","0.0006","21.784","0.003","8.0761","0.0012","90","","102.729","0.004","90","","777.42","0.19","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 I2 N -","- C5 H5 I2 N -","- C20 H20 I8 N4 -","4","1","","Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel","Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides","New Journal of Chemistry","1999","","","","","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051498","12.263","0.002","22.3356","0.0013","22.566","0.002","90","","94.169","0.011","90","","6164.3","1.3","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H78 F12 N4 O16 P2 -","- C54 H78 F12 N4 O16 P2 -","- C216 H312 F48 N16 O64 P8 -","4","1","","Huuskonen, Juhani; Buston, Jonathan E. H.; Scotchmer, Neil D.; Anderson, Harry L.","Water-soluble macrocyclic receptors for small neutral guests","New Journal of Chemistry","1999","23","12","1245","1252","10.1039/a906403f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210946","2020-10-21","18:00:00",""
"7051499","14.0149","0.0012","12.7542","0.0012","17.837","0.002","90","","108.711","0.008","90","","3019.8","0.5","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54.5 H70.5 Cl1.5 N2 O17 -","- C57 H75 Cl3 N2 O18 -","- C114 H150 Cl6 N4 O36 -","2","0.5","","Huuskonen, Juhani; Buston, Jonathan E. H.; Scotchmer, Neil D.; Anderson, Harry L.","Water-soluble macrocyclic receptors for small neutral guests","New Journal of Chemistry","1999","23","12","1245","1252","10.1039/a906403f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210946","2020-10-21","18:00:00",""
"7051500","12.466","0.002","11.9827","0.0018","16.456","0.002","90","","105.918","0.012","90","","2363.9","0.6","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C50 H66 N2 O12 -","- C50 H66 N2 O12 -","- C100 H132 N4 O24 -","2","0.5","","Huuskonen, Juhani; Buston, Jonathan E. H.; Scotchmer, Neil D.; Anderson, Harry L.","Water-soluble macrocyclic receptors for small neutral guests","New Journal of Chemistry","1999","23","12","1245","1252","10.1039/a906403f","","","","","","","","","","","","","","","","","","","","","has coordinates","210946","2020-10-21","18:00:00",""
"7051501","14.43","0.02","8.36","0.01","15.9","0.1","90","","110.8","0.2","90","","1793.1","11.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H24 N8 O12 -","- C8 H24 N8 O12 -","- C32 H96 N32 O48 -","4","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a906736a","","","","","","","0.0402","","","0.1028","","","","","","","","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051502","6.0244","0.0006","12.731","0.002","15.0026","0.0013","75.052","0.008","83.802","0.006","86.817","0.009","1104.7","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H19 Cl N2 O4 -","- C28 H19 Cl N2 O4 -","- C56 H38 Cl2 N4 O8 -","2","1","","","","New Journal of Chemistry","1999","","","","","10.1039/a907124e","","","","","","","0.0413","","","0.1092","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051503","16.121","0.003","7.1894","0.0006","13.5772","0.0017","90","","95.567","0.015","90","","1566.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H20 B2 Cl2 N2 -","- C13 H20 B2 Cl2 N2 -","- C52 H80 B8 Cl8 N8 -","4","1","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","","","","","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051504","12.41","0.002","12.8779","0.0014","13.066","0.002","90","","90.428","0.014","90","","2088","0.5","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H26 B2 Cl2 N2 -","- C20 H26 B2 Cl2 N2 -","- C80 H104 B8 Cl8 N8 -","4","1","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","","","","","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051505","10.87","0.003","12.404","0.002","16.086","0.003","90","","92.185","0.009","90","","2167.3","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 B2 Cl2 N2 O2 -","- C20 H26 B2 Cl2 N2 O2 -","- C80 H104 B8 Cl8 N8 O8 -","4","1","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","","","","","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051506","20.496","0.009","9.775","0.004","23.894","0.013","90","","114.37","0.06","90","","4360","3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 B2 Cl3 N2 -","- C20 H27 B2 Cl3 N2 -","- C160 H216 B16 Cl24 N16 -","8","2","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","","","","","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051507","9.266","0.002","13.309","0.002","14.782","0.003","64.28","0.02","82.88","0.02","86.51","0.02","1629.6","0.6","301.2","","301.2","","","","","","","","","7","P -1","-P 1","2","","","","- C66 H52 Cd2 F12 N10 P2 S2 -","- C66 H52 Cd2 F22 N10 P2 S2 -","- C66 H52 Cd2 F22 N10 P2 S2 -","1","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a907417a","","","","","","","0.057","","","0.0863","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051508","9.3987","0.0009","13.184","0.001","14.058","0.002","66.133","0.008","83.369","0.008","85.087","0.008","1580.9","0.3","301.2","","301.2","","","","","","","","","7","P -1","-P 1","2","","","","- C64 H48 Cd2 F12 N10 P2 Se2 -","- C64 H48 Cd2 F26 N10 P2 Se2 -","- C64 H48 Cd2 F26 N10 P2 Se2 -","1","0.5","","","","New Journal of Chemistry","1999","","","","","10.1039/a907417a","","","","","","","0.0353","","","0.0503","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051509","11.2742","0.0012","12.8807","0.0013","15.1438","0.0016","88.712","0.002","89.247","0.003","85.25","0.002","2190.9","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H52 Br2 Fe2 N4 O2 -","- C48 H52 Br2 Fe2 N4 O2 -","- C96 H104 Br4 Fe4 N8 O4 -","2","1","","Bai, Yan; Zhang, Bing-Guang; Duan, Chun-Ying; Dang, Dong-Bin; Meng, Qing-Jin","Anion induced binding electrochemical signal transduction in ferrocenyl benzolimidazolium podands","New Journal of Chemistry","2006","30","2","266","","10.1039/b508173d","","","0.71073","MoKα","","0.2007","0.0634","","","0.1112","0.1667","","","","","","1.02","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051510","12.011","0.001","21.169","0.002","27.819","0.003","90","","98.45","0.002","90","","6996.5","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C67 H69 Br3 Fe3 N6 O2 -","- C67 H63 Br3.01 Fe3 N6 O2 -","- C268 H252 Br12.04 Fe12 N24 O8 -","4","1","","Bai, Yan; Zhang, Bing-Guang; Duan, Chun-Ying; Dang, Dong-Bin; Meng, Qing-Jin","Anion induced binding electrochemical signal transduction in ferrocenyl benzolimidazolium podands","New Journal of Chemistry","2006","30","2","266","","10.1039/b508173d","","","0.71073","MoKα","","0.3928","0.076","","","0.1438","0.2371","","","","","","0.988","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051511","8.366","0.003","11.036","0.004","11.379","0.004","90","","100.58","0.006","90","","1032.7","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1,3-dimethyl-4-nitroimidazolium methylsulfate","","","- C6 H11 N3 O6 S -","- C6 H11 N3 O6 S -","- C24 H44 N12 O24 S4 -","4","1","","Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Smiglak, Marcin; Holbrey, John D.; Reichert, W. Matthew; Rogers, Robin D.","Strategies toward the design of energetic ionic liquids: nitro- and nitrile-substituted N,N′-dialkylimidazolium salts","New Journal of Chemistry","2006","30","3","349","","10.1039/b509260d","","","0.71073","MoKα","","0.0531","0.0385","","","0.0928","0.0992","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051512","9.872","0.002","12.839","0.003","9.5949","0.0019","90","","96.63","0.004","90","","1208","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1-ethyl-3-methyl-4-nitroimidazolium triflate","","","- C7 H10 F3 N3 O5 S -","- C7 H10 F3 N3 O5 S -","- C28 H40 F12 N12 O20 S4 -","4","1","","Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Smiglak, Marcin; Holbrey, John D.; Reichert, W. Matthew; Rogers, Robin D.","Strategies toward the design of energetic ionic liquids: nitro- and nitrile-substituted N,N′-dialkylimidazolium salts","New Journal of Chemistry","2006","30","3","349","","10.1039/b509260d","","","0.71073","MoKα","","0.0253","0.024","","","0.0623","0.0631","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051513","8.113","0.002","12.596","0.004","17.035","0.005","70.065","0.005","81.042","0.005","77.57","0.005","1591.7","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","1,2,3 trimethyl-4 nitroimidazolium NTf2","","","- C8 H10 F6 N4 O6 S2 -","- C8 H10 F6 N4 O6 S2 -","- C32 H40 F24 N16 O24 S8 -","4","2","","Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Smiglak, Marcin; Holbrey, John D.; Reichert, W. Matthew; Rogers, Robin D.","Strategies toward the design of energetic ionic liquids: nitro- and nitrile-substituted N,N′-dialkylimidazolium salts","New Journal of Chemistry","2006","30","3","349","","10.1039/b509260d","","","0.71073","MoKα","","0.0505","0.0355","","","0.0839","0.0924","","","","","","1.04","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051514","6.882","0.003","11.924","0.005","13.324","0.006","90","","96.911","0.006","90","","1085.4","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1,3-dimethyl-2-nitroimidazolium triflate","","","- C6 H8 F3 N3 O5 S -","- C6 H8 F3 N3 O5 S -","- C24 H32 F12 N12 O20 S4 -","4","1","","Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Smiglak, Marcin; Holbrey, John D.; Reichert, W. Matthew; Rogers, Robin D.","Strategies toward the design of energetic ionic liquids: nitro- and nitrile-substituted N,N′-dialkylimidazolium salts","New Journal of Chemistry","2006","30","3","349","","10.1039/b509260d","","","0.71073","MoKα","","0.0328","0.0308","","","0.0808","0.0822","","","","","","1.141","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051515","8.4703","0.0014","7.9","0.0013","8.9145","0.0015","90","","111.568","0.003","90","","554.75","0.16","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","1,3-dimethyl-4,5-dicyanoimidazolium methylsulfate","","","- C8 H10 N4 O4 S -","- C8 H7 N4 O4 S -","- C16 H14 N8 O8 S2 -","2","1","","Katritzky, Alan R.; Yang, Hongfang; Zhang, Dazhi; Kirichenko, Kostyantyn; Smiglak, Marcin; Holbrey, John D.; Reichert, W. Matthew; Rogers, Robin D.","Strategies toward the design of energetic ionic liquids: nitro- and nitrile-substituted N,N′-dialkylimidazolium salts","New Journal of Chemistry","2006","30","3","349","","10.1039/b509260d","","","0.71073","MoKα","","0.0379","0.034","","","0.0965","0.0986","","","","","","1.087","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051516","11.1991","0.0006","15.293","0.001","19.008","0.001","75.286","0.004","86.453","0.004","82.786","0.003","3122.2","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H66 N24 O28.5 S4 -","- C40 H66 N24 O28.3 S4 -","- C80 H132 N48 O56.6 S8 -","2","1","","Lazar, Adina N.; Danylyuk, Oksana; Suwinska, Kinga; Coleman, Anthony W.","Assembly modes in the solid state structure of the complexes of melamine mono-cations with para-calix[4]arene sulfonic acid and calix[4]arene dihydroxyphosphonic acid","New Journal of Chemistry","2006","30","1","59","","10.1039/b510232b","","","0.71073","MoKα","","0.106","0.069","","","0.1476","0.1598","","","","","","1.08","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7051517","22.1727","0.0009","12.4313","0.0007","19.508","0.001","90","","103.281","0.003","90","","5233.3","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H68 N18 O20 P2 -","- C39 H68 N18 O20 P2 -","- C156 H272 N72 O80 P8 -","4","1","","Lazar, Adina N.; Danylyuk, Oksana; Suwinska, Kinga; Coleman, Anthony W.","Assembly modes in the solid state structure of the complexes of melamine mono-cations with para-calix[4]arene sulfonic acid and calix[4]arene dihydroxyphosphonic acid","New Journal of Chemistry","2006","30","1","59","","10.1039/b510232b","","","0.71073","MoKα","","0.1013","0.0565","","","0.0978","0.1104","","","","","","1.005","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7051518","28.659","0.005","6.8903","0.0012","24.209","0.004","90","","113.548","0.003","90","","4382.5","1.3","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H21 N2 O6 P -","- C26 H21 N2 O6 P -","- C208 H168 N16 O48 P8 -","8","1","","Christoph Janiak; Anne-Christine Chamayou; Thomas Dorn","Hydrophilic interior between hydrophobic regions in inverse bilayer structures of cation-1,1'-binaphthalene-2,2'-diyl phosphate salts","New Journal of Chemistry","2006","","","","","10.1039/b510617f","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051519","6.82","0.0011","12.3523","0.0019","25.48","0.004","90","","90","","90","","2146.5","0.6","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H18 N O6 P -","- C26 H18 N O6 P -","- C104 H72 N4 O24 P4 -","4","1","","Christoph Janiak; Anne-Christine Chamayou; Thomas Dorn","Hydrophilic interior between hydrophobic regions in inverse bilayer structures of cation-1,1'-binaphthalene-2,2'-diyl phosphate salts","New Journal of Chemistry","2006","","","","","10.1039/b510617f","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051520","10.0813","0.0015","11.2429","0.0017","21.107","0.003","93.363","0.003","98.274","0.003","112.77","0.003","2165.7","0.6","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H48 N6 O13 P2 -","- C43 H48 N6 O13 P2 -","- C86 H96 N12 O26 P4 -","2","1","","Christoph Janiak; Anne-Christine Chamayou; Thomas Dorn","Hydrophilic interior between hydrophobic regions in inverse bilayer structures of cation-1,1'-binaphthalene-2,2'-diyl phosphate salts","New Journal of Chemistry","2006","","","","","10.1039/b510617f","","","","","","","","","","","","","","","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051521","20.867","0.002","9.1006","0.0011","12.2266","0.0014","90","","97.654","0.002","90","","2301.2","0.5","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43.5 H54.5 Cu N4 O14 P2 -","- C43.498 H54.494 Cu N4 O14 P2 -","- C86.996 H108.988 Cu2 N8 O28 P4 -","2","0.5","","Christoph Janiak; Anne-Christine Chamayou; Thomas Dorn","Hydrophilic interior between hydrophobic regions in inverse bilayer structures of cation-1,1'-binaphthalene-2,2'-diyl phosphate salts","New Journal of Chemistry","2006","","","","","10.1039/b510617f","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051522","41.876","0.006","8.6579","0.0013","13.225","0.002","90","","105.86","0.003","90","","4612.5","1.2","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H54 Cu O17 P2 -","- C46 H54 Cu O17 P2 -","- C184 H216 Cu4 O68 P8 -","4","0.5","","Christoph Janiak; Anne-Christine Chamayou; Thomas Dorn","Hydrophilic interior between hydrophobic regions in inverse bilayer structures of cation-1,1'-binaphthalene-2,2'-diyl phosphate salts","New Journal of Chemistry","2006","","","","","10.1039/b510617f","","","","","","","","","","","","","","","","","","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051523","42.544","0.0018","9.087","0.0004","12.373","0.0005","90","","98.755","0.0019","90","","4727.6","0.3","100","2","100","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C46 H56 N4 Ni O14 P2 -","- C46 H56 N4 Ni O14 P2 -","- C184 H224 N16 Ni4 O56 P8 -","4","1","","Christoph Janiak; Anne-Christine Chamayou; Thomas Dorn","Hydrophilic interior between hydrophobic regions in inverse bilayer structures of cation-1,1'-binaphthalene-2,2'-diyl phosphate salts","New Journal of Chemistry","2006","","","","","10.1039/b510617f","","","","","","","","","","","","","","","","","","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051524","42.599","0.008","9.0906","0.0018","12.432","0.002","90","","98.762","0.004","90","","4758.1","1.6","203","2","203","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C46 H56 N4 Ni O14 P2 -","- C46 H56 N4 Ni O14 P2 -","- C184 H224 N16 Ni4 O56 P8 -","4","1","","Christoph Janiak; Anne-Christine Chamayou; Thomas Dorn","Hydrophilic interior between hydrophobic regions in inverse bilayer structures of cation-1,1'-binaphthalene-2,2'-diyl phosphate salts","New Journal of Chemistry","2006","","","","","10.1039/b510617f","","","","","","","","","","","","","","","","","","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051525","8.2263","0.0016","8.5046","0.0017","9.812","0.002","111.91","0.03","90.79","0.03","102.23","0.03","619.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H11 B F4 N6 O2 -","- C8 H11 B F4 N6 O2 -","- C16 H22 B2 F8 N12 O4 -","2","1","","Armentano, Donatella; De Munno, Giovanni; Rossi, Rachele","The counterion as a useful tool to obtain complexes of cytosine with alkali metal ions","New Journal of Chemistry","2006","30","1","13","","10.1039/b511009b","","","0.71073","MoKα","","0.0734","0.0586","","","0.2534","0.262","","","","","","1.242","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051526","10.014","0.003","11.025","0.003","14.399","0.003","78.36","0.02","84.6","0.02","75.62","0.02","1506.6","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H7.66667 Cl N3 Na O6.33333 -","- C4 H7.66667 Cl N3 Na O6.33333 -","- C24 H46 Cl6 N18 Na6 O38 -","6","3","","Armentano, Donatella; De Munno, Giovanni; Rossi, Rachele","The counterion as a useful tool to obtain complexes of cytosine with alkali metal ions","New Journal of Chemistry","2006","30","1","13","","10.1039/b511009b","","","0.71073","MoKα","","0.128","0.0687","","","0.1888","0.2173","","","","","","0.94","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7051527","9.9433","0.0012","10.9857","0.0015","14.691","0.002","75.706","0.007","70.487","0.005","73.88","0.005","1431.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H7 Cl N3 Na O6 -","- C4 H7 Cl N3 Na O6 -","- C24 H42 Cl6 N18 Na6 O36 -","6","3","","Armentano, Donatella; De Munno, Giovanni; Rossi, Rachele","The counterion as a useful tool to obtain complexes of cytosine with alkali metal ions","New Journal of Chemistry","2006","30","1","13","","10.1039/b511009b","","","0.71073","MoKα","","0.0947","0.0756","","","0.2286","0.2434","","","","","","1.11","","","","has coordinates","183806","2020-10-21","18:00:00",""
"7051528","26.2548","0.0008","26.2548","0.0008","12.7555","0.0005","90","","90","","90","","8792.6","0.5","120","2","120","2","","","","","","","","5","P 42/n c m :2","-P 4ac 2ac","138","","","","- C48 H48 Cl N32 O24 -","- C48 H48 Cl N32 O24.02 -","- C192 H192 Cl4 N128 O96.08 -","4","0.25","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Judith A. K. Howard; Yuri A. Strelenko; Vladimir P. Fedin; Michael V. Alfimov; Sergey P. Gromov","Photoinduced and dark complexation of unsaturated viologen analogues containing two ammonium tails with cucurbit[8]uril","New Journal of Chemistry","2006","30","3","458","","10.1039/b511456j","","","0.71073","MoKα","","0.2546","0.1903","","","0.4958","0.5266","","","","","","1.941","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051529","15.521","0.0007","25.5665","0.0011","32.4483","0.0014","90","","101.039","0.002","90","","12637.8","1","120","0.2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C98 H104 Br1.52 Cl2.48 N52 O35.1 -","- C98 H104 Br1.522 Cl2.478 N52 O35.584 -","- C392 H416 Br6.088 Cl9.912 N208 O142.336 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Judith A. K. Howard; Yuri A. Strelenko; Vladimir P. Fedin; Michael V. Alfimov; Sergey P. Gromov","Photoinduced and dark complexation of unsaturated viologen analogues containing two ammonium tails with cucurbit[8]uril","New Journal of Chemistry","2006","30","3","458","","10.1039/b511456j","","","0.71073","MoKα","","0.3045","0.1253","","","0.3255","0.3702","","","","","","0.921","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051530","12.07","0.03","16.8","0.03","17.13","0.03","72.25","0.16","74.7","0.2","71.82","0.14","3088","12","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H50 F N5 O2 -","- C32 H50 F N5 O2 -","- C128 H200 F4 N20 O8 -","4","2","","Brooks, Simon J.; Edwards, Peter R.; Gale, Philip A.; Light, Mark E.","Carboxylate complexation by a family of easy-to-make ortho-phenylenediamine based bis-ureas: studies in solution and the solid state","New Journal of Chemistry","2006","30","1","65","","10.1039/b511963d","","","0.71073","MoKα","","0.2021","0.096","","","0.1573","0.1877","","","","","","1.053","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051531","18.298","0.005","9.0305","0.0014","20.379","0.005","90","","101.76","0.02","90","","3296.7","1.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H50 Cl N5 O2 -","- C32 H50 Cl N5 O2 -","- C128 H200 Cl4 N20 O8 -","4","1","","Brooks, Simon J.; Edwards, Peter R.; Gale, Philip A.; Light, Mark E.","Carboxylate complexation by a family of easy-to-make ortho-phenylenediamine based bis-ureas: studies in solution and the solid state","New Journal of Chemistry","2006","30","1","65","","10.1039/b511963d","","","0.71073","MoKα","","0.2671","0.1843","","","0.4916","0.5371","","","","","","1.895","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051532","7.9841","0.0003","26.3041","0.0011","8.9855","0.0002","90","","103.535","0.002","90","","1834.68","0.11","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N4 S2 -","- C20 H18 N4 S2 -","- C80 H72 N16 S8 -","4","1","","Brooks, Simon J.; Edwards, Peter R.; Gale, Philip A.; Light, Mark E.","Carboxylate complexation by a family of easy-to-make ortho-phenylenediamine based bis-ureas: studies in solution and the solid state","New Journal of Chemistry","2006","30","1","65","","10.1039/b511963d","","","0.71073","MoKα","","0.1028","0.0522","","","0.1063","0.1242","","","","","","1.018","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051533","13.0454","0.0005","5.0255","0.001","13.777","0.002","90","","96.005","0.009","90","","898.3","0.2","173","","","","","","","","","","Local laboratory","6","P 1 2/c 1","-P 2yc","13","","","","- C18 H14 Cl2 Hg N4 O2 -","- C18 H14 Cl2 Hg N4 O2 -","- C36 H28 Cl4 Hg2 N8 O4 -","2","0.5","","Pansanel, Jérôme; Jouaiti, Abdelaziz; Ferlay, Sylvie; Wais Hosseini, Mir; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 2-D molecular networks by combination of coordination and hydrogen bonds","New Journal of Chemistry","2006","30","1","71","","10.1039/b512569n","","","0.71073","MoKα","","0.0484","0.0328","","","0.0784","0.0912","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051534","8.3336","0.0002","9.2373","0.0002","11.4459","0.0003","90","","94.207","0.005","90","","878.73","0.04","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 Cl2 Hg N4 O2 -","- C18 H14 Cl2 Hg0.5 N4 O2 -","- C36 H28 Cl4 Hg N8 O4 -","2","0.5","","Pansanel, Jérôme; Jouaiti, Abdelaziz; Ferlay, Sylvie; Wais Hosseini, Mir; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 2-D molecular networks by combination of coordination and hydrogen bonds","New Journal of Chemistry","2006","30","1","71","","10.1039/b512569n","","","0.71073","Mo-Kα","","0.026","0.017","","0.036","","0.022","","","1.507","","","0.976","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051535","11.4271","0.001","6.9958","0.0019","15.189","0.003","90","","98.054","0.011","90","","1202.3","0.4","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","25R,5beta-spirostane-1beta,3alpha-diol","","","- C27 H44 O4 -","- C27 H44 O4 -","- C54 H88 O8 -","2","1","","Munro, Orde Q.; du Toit, Karen; Drewes, Siegfried E.; Crouch, Neil R.; Mulholland, Dulcie A.","Experimental and theoretical studies of a naturally occurring non-oligomeric steroidal supramolecular zipper","New Journal of Chemistry","2006","30","2","197","","10.1039/b513734a","","","0.71073","MoKα","","0.0414","0.038","","","0.1006","0.1038","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051536","7.9","0.002","10.14","0.003","23.717","0.004","90","","90","","90","","1899.9","0.8","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H18 N2 O7 S -","- C19 H18 N2 O7 S -","- C76 H72 N8 O28 S4 -","4","1","","Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz","Crystal-state studies on p-toluenesulfonates of N-oxyimides—a possible structural basis of serine proteases inhibition","New Journal of Chemistry","2006","30","2","258","","10.1039/b513741a","","","0.71073","MoKα","","0.0431","0.0333","","","0.0657","0.0677","","","","","","1.023","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051537","9.847","0.003","11.791","0.003","11.014","0.003","90","","110.58","0.03","90","","1197.2","0.6","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 N O5 S -","- C11 H11 N O5 S -","- C44 H44 N4 O20 S4 -","4","1","","Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz","Crystal-state studies on p-toluenesulfonates of N-oxyimides—a possible structural basis of serine proteases inhibition","New Journal of Chemistry","2006","30","2","258","","10.1039/b513741a","","","0.71073","MoKα","","0.047","0.0423","","","0.1193","0.1229","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051538","7.764","0.002","10.265","0.003","19.787","0.004","90","","90","","90","","1577","0.7","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 N2 O7 S -","- C14 H16 N2 O7 S -","- C56 H64 N8 O28 S4 -","4","1","","Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz","Crystal-state studies on p-toluenesulfonates of N-oxyimides—a possible structural basis of serine proteases inhibition","New Journal of Chemistry","2006","30","2","258","","10.1039/b513741a","","","0.71073","MoKα","","0.0524","0.0422","","","0.0824","0.0858","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051539","14.343","","6.654","0.004","15.08","0.002","90","","108.16","0.03","90","","1367.5","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H11 N O5 S -","- C15 H11 N O5 S -","- C60 H44 N4 O20 S4 -","4","1","","Stefanowicz, Piotr; Jaremko, Łukasz; Jaremko, Mariusz; Lis, Tadeusz","Crystal-state studies on p-toluenesulfonates of N-oxyimides—a possible structural basis of serine proteases inhibition","New Journal of Chemistry","2006","30","2","258","","10.1039/b513741a","","","0.71073","MoKα","","0.0795","0.0563","","","0.1441","0.1567","","","","","","1.156","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051540","14.192","0.005","12.461","0.004","20.49","0.005","90","","105.51","0.03","90","","3491.6","1.9","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Lutetium betain-complex","","","- C84 H80 Lu2 O4 P2 -","- C84 H80 Lu2 O4 P2 -","- C168 H160 Lu4 O8 P4 -","2","0.5","","Rufanov, Konstantin A.; Müller, Bernd H.; Spannenberg, Anke; Rosenthal, Uwe","Synthesis and molecular structures of the first phosphoranylidene complexes of rare earth metals","New Journal of Chemistry","2006","30","1","29","","10.1039/b514439f","","","0.71073","MoKα","","0.1371","0.0843","","","0.1929","0.2278","","","","","","0.928","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051541","9.7457","0.0018","10.0458","0.0018","10.715","0.002","73.76","0.02","85.61","0.02","89.94","0.02","1004","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","Triphenylphosphonium-ortho-methoxybenzylide","Triphenylphosphonium-ortho-methoxybenzylide","","- C26 H23 O P -","- C26 H23 O P -","- C52 H46 O2 P2 -","2","1","","Rufanov, Konstantin A.; Müller, Bernd H.; Spannenberg, Anke; Rosenthal, Uwe","Synthesis and molecular structures of the first phosphoranylidene complexes of rare earth metals","New Journal of Chemistry","2006","30","1","29","","10.1039/b514439f","","","0.71073","MoKα","","0.0537","0.0374","","","0.0889","0.0937","","","","","","0.934","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051542","12.513","0.003","14.455","0.003","19.023","0.004","86.89","0.03","75.64","0.03","70.68","0.03","3144.1","1.4","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H72 O6 P2 Y2 -","- C68 H72 O6 P2 Y2 -","- C136 H144 O12 P4 Y4 -","2","1","","Rufanov, Konstantin A.; Müller, Bernd H.; Spannenberg, Anke; Rosenthal, Uwe","Synthesis and molecular structures of the first phosphoranylidene complexes of rare earth metals","New Journal of Chemistry","2006","30","1","29","","10.1039/b514439f","","","0.71073","MoK\α","","0.1193","0.0624","","","0.1338","0.1511","","","","","","0.899","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051543","10.1222","0.0013","13.6129","0.0013","16.5563","0.0015","90","","90","","90","","2281.3","0.4","160","2","160","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C21 H34 B N6 Nb -","- C21 H34 B N6 Nb -","- C84 H136 B4 N24 Nb4 -","4","1","","Teuma, Emmanuelle; Etienne, Michel; Donnadieu, Bruno; McGrady, G. Sean","Synthesis and structural characterisation of [TpMe2Nb(CH3)2(CH3CCCH3)] and [TpMe2NbCl(CH3)(CH3CCCH3)]: is there an intrinsic α-agostic interaction in alkyl complexes of the [TpMe2Nb(alkyne)] moiety?","New Journal of Chemistry","2006","30","3","409","","10.1039/b514820k","","","0.71073","MoKα","","0.0404","0.0318","","","0.0745","0.0776","","","","","","1.002","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051544","10.0681","0.0014","13.6445","0.0012","16.4959","0.0013","90","","90","","90","","2266.1","0.4","160","2","160","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C20 H31 B Cl N6 Nb -","- C20 H31 B Cl N6 Nb -","- C80 H124 B4 Cl4 N24 Nb4 -","4","1","","Teuma, Emmanuelle; Etienne, Michel; Donnadieu, Bruno; McGrady, G. Sean","Synthesis and structural characterisation of [TpMe2Nb(CH3)2(CH3CCCH3)] and [TpMe2NbCl(CH3)(CH3CCCH3)]: is there an intrinsic α-agostic interaction in alkyl complexes of the [TpMe2Nb(alkyne)] moiety?","New Journal of Chemistry","2006","30","3","409","","10.1039/b514820k","","","0.71073","MoKα","","0.0863","0.0473","","","0.0892","0.1005","","","","","","0.942","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051545","9.4023","0.0005","15.7925","0.0005","16.3876","0.0005","90","","90","","90","","2433.33","0.17","120","2","120","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H31 Cl2 N5 Ni O9 -","- C16 H29 Cl2 N5 Ni O9 -","- C64 H116 Cl8 N20 Ni4 O36 -","4","1","","El Ghachtouli, Sanae; Cadiou, Cyril; Déchamps-Olivier, Isabelle; Chuburu, Françoise; Aplincourt, Michel; Patinec, Véronique; Le Baccon, Michel; Handel, Henri; Roisnel, Thierry","Nickel(ii) complexes of cyclen- and cyclam-pyridine: topological reorganisations induced by electron transfer","New Journal of Chemistry","2006","30","3","392","","10.1039/b515107d","","x-ray","0.71073","MoKα","","0.0679","0.0435","","","0.1082","0.124","","","","","","1.011","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051546","14.6107","0.0002","14.6567","0.0002","21.6728","0.0003","90","","90","","90","","4641.11","0.11","120","2","120","2","","","","","","","synthesis as described","6","P b c a","-P 2ac 2ab","61","","","","- C16 H28 Cl2 N6 Ni O8 -","- C16 H28 Cl2 N6 Ni O8 -","- C128 H224 Cl16 N48 Ni8 O64 -","8","1","","El Ghachtouli, Sanae; Cadiou, Cyril; Déchamps-Olivier, Isabelle; Chuburu, Françoise; Aplincourt, Michel; Patinec, Véronique; Le Baccon, Michel; Handel, Henri; Roisnel, Thierry","Nickel(ii) complexes of cyclen- and cyclam-pyridine: topological reorganisations induced by electron transfer","New Journal of Chemistry","2006","30","3","392","","10.1039/b515107d","","x-ray","0.71073","MoKα","","0.0493","0.037","","","0.0922","0.0997","","","","","","1.061","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051547","14.2314","0.0011","12.7251","0.0011","15.5407","0.0012","90","","98.313","0.004","90","","2784.8","0.4","120","2","120","2","","","","","","","synthesis as described","6","P 1 21 1","P 2yb","4","","","","- C20 H35 Cl2 N7 Ni O8 -","- C20 H35 Cl2 N7 Ni O8 -","- C80 H140 Cl8 N28 Ni4 O32 -","4","2","","El Ghachtouli, Sanae; Cadiou, Cyril; Déchamps-Olivier, Isabelle; Chuburu, Françoise; Aplincourt, Michel; Patinec, Véronique; Le Baccon, Michel; Handel, Henri; Roisnel, Thierry","Nickel(ii) complexes of cyclen- and cyclam-pyridine: topological reorganisations induced by electron transfer","New Journal of Chemistry","2006","30","3","392","","10.1039/b515107d","","x-ray","0.71073","MoKα","","0.1285","0.1009","","","0.2005","0.2187","","","","","","1.151","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051548","11.4252","0.0007","25.7105","0.0016","31.2552","0.0019","90","","90","","90","","9181.1","1","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C58 H44 Cu2 N8 O4 -","- C58 H44 Cu2 N8 O4 -","- C464 H352 Cu16 N64 O32 -","8","1","","Mike Ward; Harry Adams; J. Jeffery; T. Riis-Johannessen; Tanya K. Ronson","Mixed Ligand Helicates and Mesocates","New Journal of Chemistry","2006","","","","","10.1039/b515154f","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7051549","14.0294","0.0014","28.052","0.003","28.125","0.003","90","","90","","90","","11068.8","1.9","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C62 H60 N8 O8 Zn2 -","- C62 H60 N8 O8 Zn2 -","- C496 H480 N64 O64 Zn16 -","8","1","","Mike Ward; Harry Adams; J. Jeffery; T. Riis-Johannessen; Tanya K. Ronson","Mixed Ligand Helicates and Mesocates","New Journal of Chemistry","2006","","","","","10.1039/b515154f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"7051550","8.161","0.0001","19.739","0.0001","14.516","0.0001","90","","104.864","0.0004","90","","2260.13","0.03","110","","110","","","","","","","","see text","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H44 Ni P2 -","- C20 H44 Ni P2 -","- C80 H176 Ni4 P8 -","4","1","","Scherer, Wolfgang; Eickerling, Georg; Shorokhov, Dmitry; Gullo, Emanuel; McGrady, G. Sean; Sirsch, Peter","Valence shell charge concentrations and the Dewar‒Chatt‒Duncanson bonding model","New Journal of Chemistry","2006","30","3","309","","10.1039/b515171f","","","0.71073","MoKa","","0.0174","0.0692","","","","0.0205","","","","","","0.739","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051551","8.329","0.002","23.399","0.006","9.458","0.003","90","","108.075","0.009","90","","1752.3","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N'-Acetyl-2-(octyloxy)benzohydrazide","","","- C17 H26 N2 O3 -","- C17 H26 N2 O3 -","- C68 H104 N8 O12 -","4","1","","Yang, Yong; Zhang, Ya-Zhou; Tang, Ya-Lin; Chen, Chuan-Feng","A programmed hydrogen bonding array self-assembles into a polymeric zipper-like architecture","New Journal of Chemistry","2006","30","2","140","","10.1039/b515559b","","","0.71073","MoKα","","0.0766","0.0497","","","0.1166","0.1356","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051552","28.56","0.02","14.706","0.01","15.859","0.011","90","","113.1","0.02","90","","6127","7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H46 N4 O6 -","- C28 H46 N4 O6 -","- C224 H368 N32 O48 -","8","1","","Yang, Yong; Zhang, Ya-Zhou; Tang, Ya-Lin; Chen, Chuan-Feng","A programmed hydrogen bonding array self-assembles into a polymeric zipper-like architecture","New Journal of Chemistry","2006","30","2","140","","10.1039/b515559b","","","0.71073","MoKα","","0.3462","0.125","","","0.2706","0.3791","","","","","","1.008","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051553","30.4401","0.0014","21.4415","0.001","22.4453","0.0011","90","","110.96","0.0008","90","","13680.3","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C73.5 H53 Au2 Cl3 F10 P4 Pt -","- C73.5 H51 Au2 Cl3 F10 P4 Pt -","- C588 H408 Au16 Cl24 F80 P32 Pt8 -","8","2","","Berenguer, Jesús R.; Chaouche, Naima; Forniés, Juan; Fortuño, Consuelo; Martín, Antonio","Coordination of a monomeric diphosphido platinum complex as a bridging ligand","New Journal of Chemistry","2006","30","3","473","","10.1039/b517726j","","","0.71073","MoKα","","0.0502","0.032","","","0.0578","0.0603","","","","","","1.018","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051554","12.682","0.0001","23.978","0.0003","21.791","0.0003","90","","101.224","0.001","90","","6499.66","0.13","223","2","223","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H50 Ag2 F10 P4 Pt -","- C72 H50 Ag2 F10 P4 Pt -","- C288 H200 Ag8 F40 P16 Pt4 -","4","1","","Berenguer, Jesús R.; Chaouche, Naima; Forniés, Juan; Fortuño, Consuelo; Martín, Antonio","Coordination of a monomeric diphosphido platinum complex as a bridging ligand","New Journal of Chemistry","2006","30","3","473","","10.1039/b517726j","","","0.71073","MoKα","","0.0519","0.0316","","","0.0874","0.1236","","","","","","1.03","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051555","8.992","0.002","16.534","0.003","23.992","0.005","90","","92.85","0.03","90","","3562.6","1.3","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H42 F6 O6 S2 Si7 -","- C16 H42 F6 O6 S2 Si7 -","- C64 H168 F24 O24 S8 Si28 -","4","1","","Krempner, C.; Jäger-Fiedler, U.; Mamat, C.; Spannenberg, A.; Weichert, K.","Highly reactive oligosilyltriflates—synthesis, structure and rearrangement","New Journal of Chemistry","2005","29","12","1581","","10.1039/b408573f","","","0.71073","MoKα","","0.0573","0.0455","","0.1209","0.1163","","","","1.017","1.109","1.109","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051556","22.8754","0.0007","16.1015","0.0012","8.7774","0.0016","90","","90.021","0.007","90","","3233","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-Decyl-5-octyl 2,6-dimethyl-4-(3'-pyridyl)-1,4-dihydropyridine- 3,5-dicarboxylate","3-Decyl-5-octyl 2,6-dimethyl-4-(3'-pyridyl)-1,4-dihydropyridine-3,5-dicarboxylate","","- C32 H50 N2 O4 -","- C32 H50 N2 O4 -","- C128 H200 N8 O16 -","4","1","","Suárez, Margarita; de Armas, Merly; Ramírez, Oney; Alvarez, Amaury; Martínez-Alvarez, Roberto; Molero, Dolores; Seoane, Carlos; Liz, Ramón; de Armas, Hector Novoa; Blaton, Norbert M.; Peeters, Oswald M.; Martín, Nazario","Synthesis and structural study of new highly lipophilic 1,4-dihydropyridines","New Journal of Chemistry","2005","29","12","1567","","10.1039/b506018d","","","1.54178","CuKα","","0.2475","0.0856","","","0.2182","0.3405","","","","","","0.968","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051557","6.814","0.001","8.759","0.001","11.015","0.001","67.536","0.002","76.657","0.002","79.036","0.002","587.32","0.12","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H24 N6 O6 S2 -","- C18 H24 N6 O6 S2 -","- C18 H24 N6 O6 S2 -","1","0.5","","Wallace, Karl J.; Morey, Jeroni; Lynch, Vincent M.; Anslyn, Eric V.","Colorimetric detection of chemical warfare simulants","New Journal of Chemistry","2005","29","11","1469","","10.1039/b506100h","","","0.71073","MoKα","","0.0956","0.0583","","","0.1219","0.1393","","","","","","1.041","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051558","39.756","0.0006","8.4865","0.0002","21.6058","0.0004","90","","116.696","0.001","90","","6512.5","0.2","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H49 N7 O6 -","- C30 H49 N7 O6 -","- C240 H392 N56 O48 -","8","1","","Wallace, Karl J.; Morey, Jeroni; Lynch, Vincent M.; Anslyn, Eric V.","Colorimetric detection of chemical warfare simulants","New Journal of Chemistry","2005","29","11","1469","","10.1039/b506100h","","","0.71073","MoKα","","0.1725","0.062","","","0.101","0.1261","","","","","","1.08","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051559","14.5678","0.0019","12.3123","0.0016","16.266","0.002","90","","110.806","0.002","90","","2727.3","0.6","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","1,2-alternate-tetra-t-butyl-25,26,27,28- tetrahydoxycalix(4)areneacid","1,2-alternate-tetra-t-butyl-25,26,27,28-tetrahydoxycalix(4)areneacid","","- C56 H76 O14 -","- C56 H76 O14 -","- C112 H152 O28 -","2","0.5","","Wang, Wei; Gong, Shuling; Chen, Yuanyin; Ma, Jianpin","Fibriform one-dimensional hydrogen-bonded network composed of 1,2-alt calix[4]arene tetra acetic acid","New Journal of Chemistry","2005","29","11","1390","","10.1039/b509092j","","","0.71073","MoKα","","0.0822","0.0657","","","0.1971","0.2152","","","","","","1.056","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051560","8.23","0.003","12.89","0.007","17.337","0.007","90","","90","","90","","1839.2","1.4","120","","120","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H26 I K O7 -","- C12 H26 I K O7 -","- C48 H104 I4 K4 O28 -","4","1","","Arnal-Herault, Carole; Barboiu, Mihail; Petit, Eddy; Michau, Mathieu; van der Lee, Arie","Cation‒π interaction: a case for macrocycle‒cation π-interaction by its ureidoarene counteranion","New Journal of Chemistry","2005","29","12","1535","","10.1039/b509240j","","","0.50915","synchrotron","","0.0797","0.0746","","0.0777","0.0769","0.0769","","","","","","0.9855","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051561","8.7154","0.0009","10.755","0.001","32.742","0.003","90","","90","","90","","3069","0.5","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H37 I K N3 O7 -","- C27 H37 I K N3 O7 -","- C108 H148 I4 K4 N12 O28 -","4","1","","Arnal-Herault, Carole; Barboiu, Mihail; Petit, Eddy; Michau, Mathieu; van der Lee, Arie","Cation‒π interaction: a case for macrocycle‒cation π-interaction by its ureidoarene counteranion","New Journal of Chemistry","2005","29","12","1535","","10.1039/b509240j","","","0.71073","MoKα","","0.0788","0.0317","","0.0387","0.0299","0.0299","","","","","","0.9194","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051562","8.277","0.0011","10.576","0.0013","34.165","0.005","90","","90","","90","","2990.7","0.7","120","","120","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H38 I K N2 O9 -","- C25 H38 I K N2 O9 -","- C100 H152 I4 K4 N8 O36 -","4","1","","Arnal-Herault, Carole; Barboiu, Mihail; Petit, Eddy; Michau, Mathieu; van der Lee, Arie","Cation‒π interaction: a case for macrocycle‒cation π-interaction by its ureidoarene counteranion","New Journal of Chemistry","2005","29","12","1535","","10.1039/b509240j","","","0.50915","synchrotron","","0.0258","0.0243","","0.0224","0.0219","0.0219","","","","","","1.0811","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051563","60.749","0.002","4.9282","0.0001","19.1272","0.0007","90","","95.986","0.0011","90","","5695.1","0.3","123","","123","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H29 N3 O2 S -","- C36 H29 N3 O2 S -","- C288 H232 N24 O16 S8 -","8","1","","Constable, Edwin C.; Hermann, B. A.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Scherer, Lukas J.","2,2′:6′,2″-Terpyridine-4′(1′H)-thione: a missing link in metallosupramolecular chemistry","New Journal of Chemistry","2005","29","11","1475","","10.1039/b510792j","","","0.71073","MoKα","","0.0575","0.0472","","0.0376","0.0365","0.0365","","","","","","1.157","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051564","7.8119","0.0003","17.828","0.0006","11.3151","0.0005","90","","92.703","0.002","90","","1574.11","0.11","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H13 Cl2 N3 S -","- C16 H13 Cl2 N3 S -","- C64 H52 Cl8 N12 S4 -","4","0.5","","Constable, Edwin C.; Hermann, B. A.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Scherer, Lukas J.","2,2′:6′,2″-Terpyridine-4′(1′H)-thione: a missing link in metallosupramolecular chemistry","New Journal of Chemistry","2005","29","11","1475","","10.1039/b510792j","","","0.71073","MoKα","","0.0829","0.0351","","0.0886","0.0372","0.0372","","","","","","1.1341","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051565","11.5557","0.0004","5.5221","0.0002","22.651","0.0009","90","","120.567","0.0015","90","","1244.54","0.08","173","","173","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C30 H20 N6 S2 -","- C30 H20 N6 S2 -","- C60 H40 N12 S4 -","2","0.5","","Constable, Edwin C.; Hermann, B. A.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Scherer, Lukas J.","2,2′:6′,2″-Terpyridine-4′(1′H)-thione: a missing link in metallosupramolecular chemistry","New Journal of Chemistry","2005","29","11","1475","","10.1039/b510792j","","","0.71073","MoKα","","0.1003","0.0485","","0.0746","0.0465","0.0465","","","","","","1.0807","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051566","25.4086","0.0009","20.1144","0.0008","34.5052","0.0011","90","","91.118","0.002","90","","17631.5","1.1","153","","153","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C138 H123.5 B8 F32 Fe4 N29.5 O7 S8 -","- C138 H114.5 B8 F32 Fe4 N29.5 O7 S8 -","- C552 H458 B32 F128 Fe16 N118 O28 S32 -","4","1","","Constable, Edwin C.; Hermann, B. A.; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Scherer, Lukas J.","2,2′:6′,2″-Terpyridine-4′(1′H)-thione: a missing link in metallosupramolecular chemistry","New Journal of Chemistry","2005","29","11","1475","","10.1039/b510792j","","","0.71073","MoKα","","0.2783","0.1621","","0.2587","0.1601","0.1601","","","","","","1.1801","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051567","12.0889","0.0004","10.0599","0.0004","31.2347","0.0011","90","","98.449","0.002","90","","3757.3","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C176 H140 N24 O18 Zn4 -","- C176 H84 N24 O18 Zn4 -","- C176 H84 N24 O18 Zn4 -","1","0.25","","Deiters, Emmanuel; Bulach, Véronique; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: coordination networks based on porphyrins bearing pyridine N-oxide groups as coordinating sites","New Journal of Chemistry","2005","29","12","1508","","10.1039/b511049c","","","0.71073","MoKα","","0.1401","0.0774","","","0.188","0.2141","","","","","","1.138","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051568","11.3493","0.0015","13.7663","0.0017","22.097","0.004","90","","100.786","0.006","90","","3391.4","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H30 N6 O Zn -","- C43 H21 N6 O Zn -","- C172 H84 N24 O4 Zn4 -","4","1","","Deiters, Emmanuel; Bulach, Véronique; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: coordination networks based on porphyrins bearing pyridine N-oxide groups as coordinating sites","New Journal of Chemistry","2005","29","12","1508","","10.1039/b511049c","","","0.71073","MoKα","","0.1389","0.0679","","","0.1573","0.1821","","","","","","1.072","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051569","37.961","0.002","9.2045","0.0005","24.5855","0.0016","90","","118.492","0.004","90","","7550","0.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43.25 H31.5 N6 O3.5 Zn -","- C43.25 H25 N6 O3.5 Zn -","- C346 H200 N48 O28 Zn8 -","8","1","","Deiters, Emmanuel; Bulach, Véronique; Kyritsakas, Nathalie; Hosseini, Mir Wais","Molecular tectonics: coordination networks based on porphyrins bearing pyridine N-oxide groups as coordinating sites","New Journal of Chemistry","2005","29","12","1508","","10.1039/b511049c","","","0.71073","MoKα","","0.155","0.0866","","","0.2546","0.2922","","","","","","1.206","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051570","8.6759","0.0002","17.6854","0.0004","17.4137","0.0005","90","","102.146","0.002","90","","2612.09","0.11","123","2","123","2","","","","","","","","4","P 1 n 1","P -2yac","7","[Li{N(2,6-Me2C6H3)C(H)N(2,6-Me2C6H3)}(PMDETA)]","","","- C52 H84 Li2 N10 -","- C52 H84 Li2 N10 -","- C104 H168 Li4 N20 -","2","1","","Cole, Marcus L.; Davies, Aaron J.; Jones, Cameron; Junk, Peter C.","Bulky formamidinate complexes of lithium: the first examples of η2:η1-C=N,N' metal amidinate coordination","New Journal of Chemistry","2005","29","11","1404","","10.1039/b511519a","","x-ray","0.71073","MoKα","","0.0901","0.0559","","","0.1228","0.1371","","","","","","1.015","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051571","13.889","0.003","15.094","0.003","15.379","0.003","90","","111.31","0.03","90","","3003.6","1.2","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Li{N(2,6-Et2C6H3)C(H)N(2,6-Et2C6H3)}(PMDETA)]","","","- C30 H50 Li N5 -","- C30 H50 Li N5 -","- C120 H200 Li4 N20 -","4","1","","Cole, Marcus L.; Davies, Aaron J.; Jones, Cameron; Junk, Peter C.","Bulky formamidinate complexes of lithium: the first examples of η2:η1-C=N,N' metal amidinate coordination","New Journal of Chemistry","2005","29","11","1404","","10.1039/b511519a","","x-ray","0.71073","MoKα","","0.3643","0.0924","","","0.1932","0.2948","","","","","","0.869","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051572","10.981","0.005","12.583","0.005","17.066","0.005","90","","97.946","0.005","90","","2335.4","1.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H21 Cl2 Fe N5 -","- C25 H21 Cl2 Fe N5 -","- C100 H84 Cl8 Fe4 N20 -","4","1","","Thallaj, Nasser K.; Machkour, Ahmed; Mandon, Dominique; Welter, Richard","Square pyramidal geometry around the metal and tridentate coordination mode of the tripod in the [6-(3′-cyanophenyl)-2-pyridylmethyl]bis(2-pyridylmethyl)amine FeCl2 complex: a solid state effect","New Journal of Chemistry","2005","29","12","1555","","10.1039/b512108f","","","0.71069","MoKα","","0.1147","0.0499","","","0.1016","0.1204","","","","","","0.853","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051573","21.396","0.005","11.286","0.005","22.693","0.005","90","","90.656","0.005","90","","5479","3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H52 Cl6 Fe3 N10 O -","- C54 H52 Cl6 Fe3 N10 O -","- C216 H208 Cl24 Fe12 N40 O4 -","4","0.5","","Thallaj, Nasser K.; Machkour, Ahmed; Mandon, Dominique; Welter, Richard","Square pyramidal geometry around the metal and tridentate coordination mode of the tripod in the [6-(3′-cyanophenyl)-2-pyridylmethyl]bis(2-pyridylmethyl)amine FeCl2 complex: a solid state effect","New Journal of Chemistry","2005","29","12","1555","","10.1039/b512108f","","","0.71069","MoKα","","0.0972","0.0503","","","0.1122","0.1387","","","","","","1.067","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051574","8.218","0.003","9.299","0.004","12.168","0.005","91.93","0.01","91.44","0.01","108.1","0.01","882.7","0.6","298","2","298","2","","","","","","","","4","P -1","-P 1","2","BPDO + CA","","","- C16 H14 N8 O8 -","- C16 H14 N8 O8 -","- C32 H28 N16 O16 -","2","1","","Arora, Kapildev K.; Talwelkar, Mayura S.; Pedireddi, V. R.","Supramolecular synthesis of some molecular adducts of 4,4′-bipyridine N,N′-dioxide","New Journal of Chemistry","2009","33","1","57","","10.1039/b807853j","","","0.71073","MoKα","","0.0731","0.0612","","","0.152","0.1656","","","","","","1.043","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051575","22.129","0.008","13.217","0.005","8.531","0.003","90","","105.82","0.01","90","","2400.6","1.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","BPDO + TCA + WATER","","","- C16 H18 N8 O4 S6 -","- C16 H18 N8 O4 S6 -","- C64 H72 N32 O16 S24 -","4","0.5","","Arora, Kapildev K.; Talwelkar, Mayura S.; Pedireddi, V. R.","Supramolecular synthesis of some molecular adducts of 4,4′-bipyridine N,N′-dioxide","New Journal of Chemistry","2009","33","1","57","","10.1039/b807853j","","","0.71073","MoKα","","0.0405","0.0353","","","0.0896","0.1046","","","","","","1.139","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051576","10.111","0.002","10.377","0.002","10.405","0.002","70.61","0.01","84.88","0.01","61.6","0.01","902.7","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","BPDO + PhgOH","","","- C21 H18 N3 O6 -","- C21 H18 N3 O6 -","- C42 H36 N6 O12 -","2","1","","Arora, Kapildev K.; Talwelkar, Mayura S.; Pedireddi, V. R.","Supramolecular synthesis of some molecular adducts of 4,4′-bipyridine N,N′-dioxide","New Journal of Chemistry","2009","33","1","57","","10.1039/b807853j","","","0.71073","MoKα","","0.0637","0.0558","","","0.1571","0.165","","","","","","1.038","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051577","7.129","0.001","10.253","0.002","23.22","0.004","82.15","0.01","85.26","0.01","70.4","0.01","1582.7","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","BPDO+ResOH+water","","","- C16 H18 N2 O6 -","- C16 H18 N2 O6 -","- C64 H72 N8 O24 -","4","2","","Arora, Kapildev K.; Talwelkar, Mayura S.; Pedireddi, V. R.","Supramolecular synthesis of some molecular adducts of 4,4′-bipyridine N,N′-dioxide","New Journal of Chemistry","2009","33","1","57","","10.1039/b807853j","","","0.71073","MoKα","","0.1095","0.0438","","","0.0971","0.1494","","","","","","0.821","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051578","12.926","0.005","7.948","0.003","19.059","0.007","90","","106.54","0.01","90","","1877","1.2","273","2","273","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 N2 O10 -","- C20 H14 N2 O10 -","- C80 H56 N8 O40 -","4","1","","Arora, Kapildev K.; Talwelkar, Mayura S.; Pedireddi, V. R.","Supramolecular synthesis of some molecular adducts of 4,4′-bipyridine N,N′-dioxide","New Journal of Chemistry","2009","33","1","57","","10.1039/b807853j","","","0.71073","MoKα","","0.0627","0.048","","","0.1196","0.1283","","","","","","1.018","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051579","15.467","0.003","22.956","0.005","19.774","0.004","90","","111.87","0.03","90","","6516","3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C68 H110 N6 -","- C68 H110 N6 -","- C272 H440 N24 -","4","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.14","0.0755","","","0.1545","0.1828","","","","","","1.021","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051580","12.265","0.003","17.424","0.004","15.775","0.003","90","","90.43","0.03","90","","3371.1","1.3","123","2","123","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 N3 -","- C37 H57 N3 -","- C148 H228 N12 -","4","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.1568","0.0629","","","0.1288","0.1584","","","","","","1.02","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051581","18.397","0.004","15.542","0.003","20.168","0.004","90","","90","","90","","5767","2","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C31 H49 N3 -","- C31 H49 N3 -","- C248 H392 N24 -","8","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.0577","0.0435","","","0.1004","0.1069","","","","","","1.032","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051582","19.236","0.004","16.327","0.003","19.536","0.004","90","","106.01","0.03","90","","5898","2","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C32 H49 N3 -","- C32 H49 N3 -","- C256 H392 N24 -","8","2","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.1119","0.0603","","","0.1323","0.1527","","","","","","1.039","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051583","13.042","0.003","12.03","0.002","18.989","0.004","90","","91.97","0.03","90","","2977.5","1.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H80 Cl6 N6 -","- C56 H80 Cl6 N6 -","- C112 H160 Cl12 N12 -","2","0.5","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.0665","0.0465","","","0.1053","0.1147","","","","","","1.024","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051584","10.96","0.002","26.459","0.005","12.934","0.003","90","","112.61","0.03","90","","3462.5","1.4","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H57 N2 P -","- C37 H57 N2 P -","- C148 H228 N8 P4 -","4","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.0652","0.0479","","","0.1136","0.1227","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051585","10.847","0.002","10.942","0.002","14.156","0.003","96.42","0.03","101.6","0.03","102.5","0.03","1585.5","0.6","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H45 N2 P -","- C37 H45 N2 P -","- C74 H90 N4 P2 -","2","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.0598","0.0464","","","0.1081","0.1159","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051586","35.51","0.007","9.877","0.002","21.966","0.004","90","","104.59","0.03","90","","7456","3","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H61 N3 Si -","- C40 H61 N3 Si -","- C320 H488 N24 Si8 -","8","2","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.1177","0.0546","","","0.1184","0.138","","","","","","0.994","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051587","20.707","0.004","12.031","0.002","26.802","0.005","90","","104.33","0.03","90","","6469","2","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C74 H112 Li2 N6 -","- C74 H112 Li2 N6 -","- C296 H448 Li8 N24 -","4","0.5","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.2083","0.0669","","","0.097","0.1301","","","","","","0.946","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051588","18.807","0.004","11.783","0.002","18.773","0.004","90","","113.2","0.03","90","","3823.7","1.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H64 Li N3 O -","- C41 H64 Li N3 O -","- C164 H256 Li4 N12 O4 -","4","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.0645","0.0501","","","0.1153","0.1236","","","","","","1.015","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051589","11.462","0.002","11.997","0.002","21.319","0.004","90","","90","","90","","2931.6","0.9","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H48 K N3 -","- C31 H42 K N3 -","- C124 H168 K4 N12 -","4","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.1013","0.0737","","","0.1297","0.1371","","","","","","1.117","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051590","24.5","0.005","16.473","0.003","20.494","0.004","90","","93.48","0.03","90","","8256","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C82 H132 K2 N6 O7 -","- C82 H132 K2 N6 O7 -","- C328 H528 K8 N24 O28 -","4","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Lippert, Kai-Alexander; Rose, Richard P.; Stasch, Andreas","Synthesis and characterisation of bulky guanidines and phosphaguanidines: precursors for low oxidation state metallacycles","New Journal of Chemistry","2009","33","1","64","","10.1039/b809120j","","","0.71073","MoKα","","0.1012","0.0713","","","0.1704","0.1858","","","","","","1.032","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051591","5.846","0.0019","14.473","0.003","14.149","0.0016","90","","97.66","0.017","90","","1186.5","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 O Se2 -","- C12 H12 O Se2 -","- C48 H48 O4 Se8 -","4","1","","Hayashi, Satoko; Nakanishi, Waro; Furuta, Atsushi; Drabowicz, Jozef; Sasamori, Takahiro; Tokitoh, Norihiro","How does non-covalent Se⋯SeO interaction stabilize selenoxides at naphthalene 1,8-positions: structural and theoretical investigations","New Journal of Chemistry","2009","33","1","196","","10.1039/b809763a","","","0.71069","MoKα","","0.0821","0.0323","","","0.0651","0.0773","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051592","25.549","0.009","5.8653","0.0018","20.85","0.008","90","","117.329","0.004","90","","2775.7","1.7","103","2","103","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H17 O4.5 Se2 -","- C12 H17 O4.5 Se2 -","- C96 H136 O36 Se16 -","8","1","","Hayashi, Satoko; Nakanishi, Waro; Furuta, Atsushi; Drabowicz, Jozef; Sasamori, Takahiro; Tokitoh, Norihiro","How does non-covalent Se⋯SeO interaction stabilize selenoxides at naphthalene 1,8-positions: structural and theoretical investigations","New Journal of Chemistry","2009","33","1","196","","10.1039/b809763a","","","0.7107","MoKα","","0.0221","0.0209","","","0.0529","0.0536","","","","","","1.109","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051593","9.857","0.002","18.365","0.004","19.384","0.004","90","","99.51","0.03","90","","3460.7","1.3","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H52 Li2 N6 Si2 -","- C28 H52 Li2 N6 Si2 -","- C112 H208 Li8 N24 Si8 -","4","0.5","","Jin, Can; Wang, Zhong-Xia","Synthesis and characterization of lithium, aluminium and zinc complexes supported by pyrazolyl-based N,N′-chelate ligands","New Journal of Chemistry","2009","33","3","659","","10.1039/b811094h","","","0.71073","MoKα","","0.0887","0.0522","","","0.1225","0.1454","","","","","","1.022","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051594","8.6331","0.0014","16.006","0.002","15.3112","0.0018","90","","103.749","0.002","90","","2055.1","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Al Cl2 N3 -","- C20 H20 Al Cl2 N3 -","- C80 H80 Al4 Cl8 N12 -","4","1","","Jin, Can; Wang, Zhong-Xia","Synthesis and characterization of lithium, aluminium and zinc complexes supported by pyrazolyl-based N,N′-chelate ligands","New Journal of Chemistry","2009","33","3","659","","10.1039/b811094h","","","0.71073","MoKα","","0.0759","0.0474","","","0.1154","0.1271","","","","","","1.031","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051595","7.412","0.001","24.654","0.002","12.784","0.0015","90","","96.66","0.002","90","","2320.3","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H30 Al N3 O -","- C24 H30 Al N3 O -","- C96 H120 Al4 N12 O4 -","4","1","","Jin, Can; Wang, Zhong-Xia","Synthesis and characterization of lithium, aluminium and zinc complexes supported by pyrazolyl-based N,N′-chelate ligands","New Journal of Chemistry","2009","33","3","659","","10.1039/b811094h","","","0.71073","MoKα","","0.1034","0.0525","","","0.1181","0.1348","","","","","","1.006","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051596","8.435","0.0014","20.454","0.002","13.1771","0.0018","90","","94.58","0.002","90","","2266.2","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 Al N3 -","- C24 H30 Al N3 -","- C96 H120 Al4 N12 -","4","1","","Jin, Can; Wang, Zhong-Xia","Synthesis and characterization of lithium, aluminium and zinc complexes supported by pyrazolyl-based N,N′-chelate ligands","New Journal of Chemistry","2009","33","3","659","","10.1039/b811094h","","","0.71073","MoKα","","0.1224","0.0541","","","0.1434","0.2104","","","","","","1.086","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051597","11.977","0.007","18.109","0.011","12.058","0.007","90","","108.4","0.01","90","","2482","3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H36 Al N3 -","- C26 H36 Al N3 -","- C104 H144 Al4 N12 -","4","1","","Jin, Can; Wang, Zhong-Xia","Synthesis and characterization of lithium, aluminium and zinc complexes supported by pyrazolyl-based N,N′-chelate ligands","New Journal of Chemistry","2009","33","3","659","","10.1039/b811094h","","","0.71073","MoKα","","0.2726","0.0927","","","0.1613","0.1983","","","","","","1.06","","","","has coordinates","180069","2020-10-21","18:00:00",""
"7051598","11.8","0.003","13.208","0.003","41.505","0.009","90","","90","","90","","6469","3","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","1,3-Bis(4,4''-dimethyl-2,2':6',2''-terpyridin-4'-yl)-5- methylbenzene","","","- C41 H34 N6 -","- C41 H34 N6 -","- C328 H272 N48 -","8","1","","Eryazici, Ibrahim; Newkome, George R.","Construction of hexanuclear macrocycles by a coupling strategy from polyfunctionalized bis(terpyridines)","New Journal of Chemistry","2009","33","2","345","","10.1039/b811607e","","","0.71073","MoKα","","0.099","0.0725","","","0.152","0.1614","","","","","","1.114","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051599","14.3505","0.0012","14.4204","0.0012","33.419","0.003","90","","90","","90","","6915.7","1","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","(Ru(4'-(4-Iodophenyl)-4,4''-di(ethoxycarbonyl)-2,2';6',2''- terpyridine))2) ((PF6)2)","","","- C56 H47 F12 I2 N7 O8 P2 Ru -","- C56 H47 F12 I2 N7 O8 P2 Ru -","- C224 H188 F48 I8 N28 O32 P8 Ru4 -","4","1","","Eryazici, Ibrahim; Newkome, George R.","Construction of hexanuclear macrocycles by a coupling strategy from polyfunctionalized bis(terpyridines)","New Journal of Chemistry","2009","33","2","345","","10.1039/b811607e","","","0.71073","MoKα","","0.063","0.0467","","","0.1112","0.1175","","","","","","1.008","","","","has coordinates,has disorder","180069","2020-10-21","18:00:00",""
"7051600","10.0301","0.0009","18.862","0.0019","12.9786","0.0012","90","","93.289","0.006","90","","2451.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(Ph2CHCH2Ph)((CF3SO2)2N)","(Ph2CHCH2Ph)[(CF3SO2)2N]","","- C20 H19 F6 N3 O4 S2 -","- C20 H19 F6 N3 O4 S2 -","- C80 H76 F24 N12 O16 S8 -","4","1","","Stracke, M. P.; Migliorini, M. V.; Lissner, E.; Schrekker, H. S.; Back, D.; Lang, E. S.; Dupont, J.; Gonçalves, R. S.","Electrochemical methodology for determination of imidazolium ionic liquids (solids at room temperature) properties: influence of the temperature","New Journal of Chemistry","2009","33","1","82","","10.1039/b812258j","","","0.71073","MoKα","","0.1779","0.078","","","0.2326","0.2819","","","","","","0.883","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051601","11.1807","0.0002","14.8585","0.0003","12.8594","0.0003","90","","105.496","0.001","90","","2058.66","0.07","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(PhCH2CH2CH2(N2C3H3)CH3)(N(SO2CF3)","[PhCH2CH2CH2(N2C3H3)CH3][N(SO2CF3]","","- C15 H17 F6 N3 O4 S2 -","- C15 H17 F6 N3 O4 S2 -","- C60 H68 F24 N12 O16 S8 -","4","1","","Stracke, M. P.; Migliorini, M. V.; Lissner, E.; Schrekker, H. S.; Back, D.; Lang, E. S.; Dupont, J.; Gonçalves, R. S.","Electrochemical methodology for determination of imidazolium ionic liquids (solids at room temperature) properties: influence of the temperature","New Journal of Chemistry","2009","33","1","82","","10.1039/b812258j","","","0.71073","MoKα","","0.1524","0.0921","","","0.2952","0.3457","","","","","","1.072","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051602","9.7783","0.0009","15.2038","0.0016","12.8926","0.0014","90","","92.951","0.006","90","","1914.2","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ESLJP05","ESLJP05","","- C14 H15 F6 N3 O4 S2 -","- C14 H15 F6 N3 O4 S2 -","- C56 H60 F24 N12 O16 S8 -","4","1","","Stracke, M. P.; Migliorini, M. V.; Lissner, E.; Schrekker, H. S.; Back, D.; Lang, E. S.; Dupont, J.; Gonçalves, R. S.","Electrochemical methodology for determination of imidazolium ionic liquids (solids at room temperature) properties: influence of the temperature","New Journal of Chemistry","2009","33","1","82","","10.1039/b812258j","","","0.71073","MoKα","","0.0596","0.0432","","","0.1127","0.1233","","","","","","1.085","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051603","10.0578","0.0004","9.7055","0.0004","16.5331","0.0006","90","","101.701","0.004","90","","1580.36","0.11","200","2","200","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-methyl-5-nitrotetrazole","1-methyl-5-nitrotetrazole","","- C2 H3 N5 O2 -","- C2 H3 N5 O2 -","- C24 H36 N60 O24 -","12","3","","Klapötke, Thomas M.; Sabaté, Carles Miró; Stierstorfer, Jörg","Neutral 5-nitrotetrazoles: easy initiation with low pollution","New Journal of Chemistry","2009","33","1","136","","10.1039/b812529e","","","0.71073","MoKα","","0.1622","0.0664","","","0.1622","0.2102","","","","","","0.914","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051604","5.3358","0.0004","9.4799","0.0007","8.319","0.0008","90","","106.989","0.009","90","","402.44","0.06","123","2","200","","","","","","","","","4","P 1 21 1","P 2yb","4","2H-5-Nitrotetrazole","2H-5-Nitrotetrazole","","- C H N5 O2 -","- C H N5 O2 -","- C4 H4 N20 O8 -","4","2","","Klapötke, Thomas M.; Sabaté, Carles Miró; Stierstorfer, Jörg","Neutral 5-nitrotetrazoles: easy initiation with low pollution","New Journal of Chemistry","2009","33","1","136","","10.1039/b812529e","","","0.71073","MoKα","","0.0821","0.0274","","","0.0402","0.0497","","","","","","0.835","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051605","6.3305","0.0013","4.9929","0.001","16.388","0.003","90","","97.13","0.03","90","","513.98","0.18","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-methyl-5-nitrotetrazole","2-methyl-5-nitrotetrazole","","- C2 H3 N5 O2 -","- C2 H3 N5 O2 -","- C8 H12 N20 O8 -","4","1","","Klapötke, Thomas M.; Sabaté, Carles Miró; Stierstorfer, Jörg","Neutral 5-nitrotetrazoles: easy initiation with low pollution","New Journal of Chemistry","2009","33","1","136","","10.1039/b812529e","","","0.71073","MoKα","","0.0438","0.0364","","","0.0903","0.0946","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051606","13.5451","0.0007","17.3548","0.001","18.4163","0.001","90","","90","","90","","4329.2","0.4","93","2","93","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H51 B Cl7 F4 Ir N2 -","- C36 H51 B Cl7 F4 Ir N2 -","- C144 H204 B4 Cl28 F16 Ir4 N8 -","4","1","","Fuentes, José A.; France, Marcia B.; Slawin, Alexandra M. Z.; Clarke, Matthew L.","Iridium complexes of chiral diamines containing carbon and nitrogen stereocentres: synthesis, structure and evaluation as transfer hydrogenation catalysts","New Journal of Chemistry","2009","33","3","466","","10.1039/b812699b","","","0.71073","MoKα","","0.0306","0.029","","","0.057","0.0578","","","","","","1.07","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051607","9.743","0.003","10.035","0.003","11.123","0.003","81.707","0.005","69.085","0.005","73.712","0.005","973.9","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H52 K N6 O8 -","- C36 H52 K N6 O8 -","- C36 H52 K N6 O8 -","1","0.5","","Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K.","Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer","New Journal of Chemistry","2009","33","3","545","","10.1039/b812829d","","","0.71073","MoKα","","0.0745","0.0468","","","0.122","0.1308","","","","","","0.944","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051608","6.0656","0.0008","7.8452","0.0011","8.6868","0.0012","86.475","0.002","75.29","0.002","75.507","0.002","387.1","0.09","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H4 N6 S4 -","- C14 H4 N6 S4 -","- C14 H4 N6 S4 -","1","0.5","","Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K.","Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer","New Journal of Chemistry","2009","33","3","545","","10.1039/b812829d","","","0.71073","MoKα","","0.0322","0.0305","","","0.082","0.0838","","","","","","1.064","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051609","8.6134","0.0004","6.9065","0.0003","13.2991","0.0006","90","","90.268","0.001","90","","791.13","0.06","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H8 N6 -","- C20 H8 N6 -","- C40 H16 N12 -","2","0.5","","Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K.","Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer","New Journal of Chemistry","2009","33","3","545","","10.1039/b812829d","","","0.71073","MoKα","","0.0491","0.0423","","","0.1178","0.1236","","","","","","1.064","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051610","14.971","0.015","13.39","0.02","33.07","0.04","90","","90","","90","","6629","14","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C30 H30 N18 -","- C30 H30 N18 -","- C240 H240 N144 -","8","1","","Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K.","Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer","New Journal of Chemistry","2009","33","3","545","","10.1039/b812829d","","","0.71073","MoKα","","0.1425","0.0696","","","0.1532","0.1916","","","","","","0.995","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051611","8.747","0.003","6.94","0.002","15.327","0.005","90","","104.356","0.007","90","","901.4","0.5","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H10 N6 -","- C24 H10 N6 -","- C48 H20 N12 -","2","0.5","","Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K.","Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer","New Journal of Chemistry","2009","33","3","545","","10.1039/b812829d","","","0.71073","MoKα","","0.1003","0.0556","","","0.1206","0.1407","","","","","","1.047","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051612","12.106","0.003","12.153","0.003","12.839","0.003","97.619","0.005","99.31","0.005","108.192","0.005","1736.8","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","[Crypt K+] TCP- * THF","2,2,2-Cryptand potassium tetracyanopirazinide, tetrahydrofuran solvate","","- C60 H88 K2 N16 O14 -","- C60 H88 K2 N16 O14 -","- C60 H88 K2 N16 O14 -","1","0.5","","Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K.","Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer","New Journal of Chemistry","2009","33","3","545","","10.1039/b812829d","","","0.71073","MoKα","","0.1512","0.0802","","","0.1708","0.2","","","","","","0.931","","","","has coordinates","187017","2020-10-21","18:00:00",""
"7051613","10.09","0.002","12.141","0.003","13.85","0.003","90","","90","","90","","1696.7","0.7","173","2","173","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C8 N6 -","- C8 N6 -","- C64 N48 -","8","1","","Rosokha, Sergiy V.; Lu, Jianjiang; Han, Bing; Kochi, Jay K.","Unusual structural effects of intermolecular π-bonding in the tetracyanopyrazine (ion-radical) dimer","New Journal of Chemistry","2009","33","3","545","","10.1039/b812829d","","","0.71073","MoKα","","0.0648","0.0481","","","0.1194","0.1286","","","","","","1.275","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051614","8.1626","0.0015","8.7141","0.0016","16.756","0.003","81.872","0.003","80.78","0.003","62.85","0.003","1043.7","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H28 N2 O5 S -","- C21 H28 N2 O5 S -","- C42 H56 N4 O10 S2 -","2","1","","Hough-Troutman, Whitney L.; Smiglak, Marcin; Griffin, Scott; Matthew Reichert, W.; Mirska, Ilona; Jodynis-Liebert, Jadwiga; Adamska, Teresa; Nawrot, Jan; Stasiewicz, Monika; Rogers, Robin D.; Pernak, Juliusz","Ionic liquids with dual biological function: sweet and anti-microbial, hydrophobic quaternary ammonium-based salts","New Journal of Chemistry","2009","33","1","26","","10.1039/b813213p","","","0.71073","MoKα","","0.0472","0.0362","","","0.0871","0.0937","","","","","","1.033","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051615","7.921","0.003","13.374","0.005","25.689","0.01","76.755","0.007","82.225","0.007","89.26","0.007","2624.2","1.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","1-hexadecylyridinium acesulfame","","","- C25 H42 N2 O4 S -","- C25 H42 N2 O4 S -","- C100 H168 N8 O16 S4 -","4","2","","Hough-Troutman, Whitney L.; Smiglak, Marcin; Griffin, Scott; Matthew Reichert, W.; Mirska, Ilona; Jodynis-Liebert, Jadwiga; Adamska, Teresa; Nawrot, Jan; Stasiewicz, Monika; Rogers, Robin D.; Pernak, Juliusz","Ionic liquids with dual biological function: sweet and anti-microbial, hydrophobic quaternary ammonium-based salts","New Journal of Chemistry","2009","33","1","26","","10.1039/b813213p","","","0.71073","MoKα","","0.0641","0.0462","","","0.1208","0.1411","","","","","","1.07","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051616","6.8693","0.0005","14.9715","0.0012","17.3393","0.0015","90","","100.082","0.003","90","","1755.7","0.2","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C7 H19 Cl3 N O2 P Se2 -","- C7 H19 Cl3 N O2 P Se2 -","- C28 H76 Cl12 N4 O8 P4 Se8 -","4","1","","Sarkar, Bijay; Fang, Chiang-Shiang; You, Lee-Yan; Wang, Ju-Chun; Liu, C. W.","The chemistry of phosphorodiselenoates: structure, catalysis and formation of Se-esters","New Journal of Chemistry","2009","33","3","626","","10.1039/b813267d","","","0.71073","MoKα","","0.0538","0.0364","","","0.0888","0.0937","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051617","7.9318","0.0013","22.409","0.004","11.2624","0.0018","90","","102.172","0.003","90","","1956.8","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H28 N O3 P Se2 -","- C13 H26 N O3 P Se2 -","- C52 H104 N4 O12 P4 Se8 -","4","1","","Sarkar, Bijay; Fang, Chiang-Shiang; You, Lee-Yan; Wang, Ju-Chun; Liu, C. W.","The chemistry of phosphorodiselenoates: structure, catalysis and formation of Se-esters","New Journal of Chemistry","2009","33","3","626","","10.1039/b813267d","","","0.71073","MoKα","","0.0664","0.0464","","","0.0862","0.0937","","","","","","1.033","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051618","5.4647","0.0008","11.1834","0.0017","20.479","0.003","90","","90","","90","","1251.6","0.3","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H14 O8 S2 -","- C8 H14 O8 S2 -","- C32 H56 O32 S8 -","4","1","","Craythorne, Steven J.; Pollock, Ciara L.; Blake, Alexander J.; Nieuwenhuyzen, Mark; Marr, Andrew C.; Marr, Patricia C.","A low molecular weight hydro and organogelator derived from an isohexide and sol‒gel transcription of the alcogel","New Journal of Chemistry","2009","33","3","479","","10.1039/b814274b","","","0.71073","MoKα","","0.0344","0.0291","","","0.0693","0.0719","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051619","11.573","0.005","11.596","0.005","16.367","0.005","76.96","0.005","81.58","0.005","66.012","0.005","1951.3","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H30 Cl2 Co2 N9 O3 -","- C36 H30 Cl2 Co2 N9 O3 -","- C72 H60 Cl4 Co4 N18 O6 -","2","1","","Jacob, Wilson; Mishra, Haritosh; Pandey, Sharmila; Lloret, Francesc; Mukherjee, Rabindranath","Six-coordinate CoIII and four-coordinate MII (M = Co, Zn) mixed-valence dimers supported by a deprotonated pyridine amide ligand: magnetism of a CoIIICoII complex and C‒H⋯O/Cl/Br interactions","New Journal of Chemistry","2009","33","4","893","","10.1039/b814303j","","","0.71069","MoKα","","0.1215","0.082","","","0.1973","0.2465","","","","","","1.12","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051620","12.34","0.005","16.429","0.005","20.045","0.005","93.162","0.005","94.169","0.005","93.594","0.005","4038","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H34 Br2 Co2 N9 O4 -","- C37 H34 Br2 Co2 N9 O4 -","- C148 H136 Br8 Co8 N36 O16 -","4","2","","Jacob, Wilson; Mishra, Haritosh; Pandey, Sharmila; Lloret, Francesc; Mukherjee, Rabindranath","Six-coordinate CoIII and four-coordinate MII (M = Co, Zn) mixed-valence dimers supported by a deprotonated pyridine amide ligand: magnetism of a CoIIICoII complex and C‒H⋯O/Cl/Br interactions","New Journal of Chemistry","2009","33","4","893","","10.1039/b814303j","","","0.71069","MoKα","","0.1497","0.0885","","","0.2206","0.2832","","","","","","1.23","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051621","11.555","0.005","12.482","0.005","16.117","0.005","78.089","0.005","72.04","0.005","86.649","0.005","2163.6","1.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H44 Cl2 Co N9 O9 Zn -","- C36 H30 Cl Co N9 O3 Zn -","- C72 H60 Cl2 Co2 N18 O6 Zn2 -","2","1","","Jacob, Wilson; Mishra, Haritosh; Pandey, Sharmila; Lloret, Francesc; Mukherjee, Rabindranath","Six-coordinate CoIII and four-coordinate MII (M = Co, Zn) mixed-valence dimers supported by a deprotonated pyridine amide ligand: magnetism of a CoIIICoII complex and C‒H⋯O/Cl/Br interactions","New Journal of Chemistry","2009","33","4","893","","10.1039/b814303j","","","0.71069","MoKα","","0.1527","0.0872","","","0.2244","0.2691","","","","","","0.887","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051622","7.1991","0.0006","13.3838","0.0011","10.2926","0.0008","90","","98.898","0.001","90","","979.77","0.14","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H9 La O11 P -","- C3 H9 La O11 P -","- C12 H36 La4 O44 P4 -","4","1","","Zhu, Yanyu; Sun, Zhengang; Zhao, Yan; Zhang, Jing; Lu, Xin; Zhang, Na; Liu, Lei; Tong, Fei","Synthesis, crystal structures and luminescence properties of lanthanide oxalatophosphonates with a three-dimensional framework structure","New Journal of Chemistry","2009","33","1","119","","10.1039/b814400a","","","0.71073","MoKα","","0.0233","0.021","","","0.0548","0.0561","","","","","","1.017","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051623","7.226","0.0007","13.2918","0.0013","10.2745","0.001","90","","99.493","0.001","90","","973.32","0.16","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H9 Ce O11 P -","- C3 H9 Ce O11 P -","- C12 H36 Ce4 O44 P4 -","4","1","","Zhu, Yanyu; Sun, Zhengang; Zhao, Yan; Zhang, Jing; Lu, Xin; Zhang, Na; Liu, Lei; Tong, Fei","Synthesis, crystal structures and luminescence properties of lanthanide oxalatophosphonates with a three-dimensional framework structure","New Journal of Chemistry","2009","33","1","119","","10.1039/b814400a","","","0.71073","MoKα","","0.0296","0.0239","","","0.0526","0.0555","","","","","","1.063","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051624","7.23","0.0007","13.2239","0.0013","10.2535","0.001","90","","99.869","0.001","90","","965.82","0.16","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H9 O11 P Pr -","- C3 H9 O11 P Pr -","- C12 H36 O44 P4 Pr4 -","4","1","","Zhu, Yanyu; Sun, Zhengang; Zhao, Yan; Zhang, Jing; Lu, Xin; Zhang, Na; Liu, Lei; Tong, Fei","Synthesis, crystal structures and luminescence properties of lanthanide oxalatophosphonates with a three-dimensional framework structure","New Journal of Chemistry","2009","33","1","119","","10.1039/b814400a","","","0.71073","MoKα","","0.0318","0.0278","","","0.0726","0.0753","","","","","","1.074","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051625","7.2326","0.0006","13.1558","0.0011","10.2337","0.0008","90","","100.107","0.001","90","","958.63","0.14","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H9 Nd O11 P -","- C3 H9 Nd O11 P -","- C12 H36 Nd4 O44 P4 -","4","1","","Zhu, Yanyu; Sun, Zhengang; Zhao, Yan; Zhang, Jing; Lu, Xin; Zhang, Na; Liu, Lei; Tong, Fei","Synthesis, crystal structures and luminescence properties of lanthanide oxalatophosphonates with a three-dimensional framework structure","New Journal of Chemistry","2009","33","1","119","","10.1039/b814400a","","","0.71073","MoKα","","0.0242","0.022","","","0.0543","0.0557","","","","","","1.039","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051626","7.2351","0.0006","13.055","0.001","10.1999","0.0008","90","","100.427","0.001","90","","947.51","0.13","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H9 O11 P Sm -","- C3 H9 O11 P Sm -","- C12 H36 O44 P4 Sm4 -","4","1","","Zhu, Yanyu; Sun, Zhengang; Zhao, Yan; Zhang, Jing; Lu, Xin; Zhang, Na; Liu, Lei; Tong, Fei","Synthesis, crystal structures and luminescence properties of lanthanide oxalatophosphonates with a three-dimensional framework structure","New Journal of Chemistry","2009","33","1","119","","10.1039/b814400a","","","0.71073","MoKα","","0.0226","0.0206","","","0.0512","0.0523","","","","","","1.09","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051627","7.2293","0.0009","13.0429","0.0016","10.198","0.0013","90","","100.541","0.002","90","","945.4","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H9 Eu O11 P -","- C3 H9 Eu O11 P -","- C12 H36 Eu4 O44 P4 -","4","1","","Zhu, Yanyu; Sun, Zhengang; Zhao, Yan; Zhang, Jing; Lu, Xin; Zhang, Na; Liu, Lei; Tong, Fei","Synthesis, crystal structures and luminescence properties of lanthanide oxalatophosphonates with a three-dimensional framework structure","New Journal of Chemistry","2009","33","1","119","","10.1039/b814400a","","","0.71073","MoKα","","0.0255","0.0243","","","0.0589","0.0595","","","","","","1.099","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051628","8.177","0.0002","14.841","0.0005","10.595","0.0003","90","","94.839","0.001","90","","1281.17","0.06","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C33 H30 B N O3 -","- C33 H30 B N O3 -","- C66 H60 B2 N2 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New J. Chem.","2009","33","1","181","185","10.1039/B815138E","","","0.71073","MoKα","","0.0681","0.0514","","","0.1221","0.1329","","","","","","1.031","","","","has coordinates","282882","2023-04-27","15:29:00",""
"7051629","12.827","0.0002","9.1145","0.0002","13.5149","0.0003","90","","90.4398","0.001","90","","1580","0.06","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H32 B2 Cl6 N2 O3 -","- C26 H32 B2 Cl6 N2 O3 -","- C52 H64 B4 Cl12 N4 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New J. Chem.","2009","33","1","181","185","10.1039/B815138E","","","0.71073","MoKα","","0.0475","0.0437","","","0.1027","0.1059","","","","","","1.038","","","","has coordinates,has disorder","282882","2023-04-27","15:29:01",""
"7051630","9.9035","0.0001","12.138","0.0002","13.9067","0.0002","78.842","0.001","72.3618","0.001","83.1794","0.001","1559.77","0.04","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H24 B2 Cl6 N2 O3 -","- C30 H24 B2 Cl6 N2 O3 -","- C60 H48 B4 Cl12 N4 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New J. Chem.","2009","33","1","181","185","10.1039/B815138E","","","0.71073","MoKα","","0.0829","0.0504","","","0.1244","0.1427","","","","","","1.026","","","","has coordinates,has disorder","282882","2023-04-27","15:29:01",""
"7051631","10.523","0.0002","11.62","0.0003","13.052","0.0004","99.138","0.001","110.461","0.001","106.631","0.001","1371.87","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H31 B2 Cl3 N2 O3 -","- C27 H31 B2 Cl3 N2 O3 -","- C54 H62 B4 Cl6 N4 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New J. Chem.","2009","33","1","181","185","10.1039/B815138E","","","0.71073","MoKα","","0.067","0.0495","","","0.1125","0.1229","","","","","","1.027","","","","has coordinates","282882","2023-04-27","15:29:01",""
"7051632","10.1434","0.0018","10.1853","0.0019","14.427","0.003","94.337","0.009","108.283","0.008","111.195","0.008","1289.1","0.4","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H28 N4 O5 S -","- C27 H24 N4 O5 S -","- C54 H48 N8 O10 S2 -","2","1","","Wu, Hongmei; Zhou, Peng; Wang, Jian; Zhao, Liang; Duan, Chunying","Dansyl-based fluorescent chemosensors for selective responses of Cr(iii)","New Journal of Chemistry","2009","33","3","653","","10.1039/b815207a","","","0.71073","MoKα","","0.062","0.0501","","","0.1478","0.1578","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051633","13.5888","0.0007","14.73","0.001","22.343","0.002","71.118","0.005","74.753","0.005","78.274","0.005","4048.3","0.5","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H81 F24 N11 O10 P4 -","- C68 H81 F24 N11 O10 P4 -","- C136 H162 F48 N22 O20 P8 -","2","1","","Ramos, Susana; Alcalde, Ermitas; Fraser Stoddart, J.; P. White, Andrew J.; Williams, David J.; Pérez-García, Lluïsa","Proton ionizable 1H-1,2,4-triazole π-electron deficient cyclophanes as hosts and in [2]catenanes","New Journal of Chemistry","2009","33","2","300","","10.1039/b815355h","","","1.54178","CuKα","","0.0943","0.0709","","0.2082","0.1836","","","","1.049","1.105","1.105","","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051634","13.5062","0.0006","16.4849","0.0015","18.6366","0.0012","98.186","0.007","92.115","0.004","104.056","0.007","3973.1","0.5","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H81 F24 N15 O10 P4 -","- C66 H81 F24 N15 O10 P4 -","- C132 H162 F48 N30 O20 P8 -","2","1","","Ramos, Susana; Alcalde, Ermitas; Fraser Stoddart, J.; P. White, Andrew J.; Williams, David J.; Pérez-García, Lluïsa","Proton ionizable 1H-1,2,4-triazole π-electron deficient cyclophanes as hosts and in [2]catenanes","New Journal of Chemistry","2009","33","2","300","","10.1039/b815355h","","","1.54178","CuKα","","0.078","0.0597","","0.1673","0.1489","","","","1.044","1.092","1.092","","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051635","38.012","0.001","38.012","0.001","15.523","0.001","90","","90","","120","","19424.4","1.4","115","2","115","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C41 H38.222 Cu F6 N6 O1.444 P S3 -","- C40.99 H37.98 Cu F6 N6 O1.44 P S3 -","- C737.82 H683.64 Cu18 F108 N108 O25.92 P18 S54 -","18","1","","Wang, Leyong; Chambron, Jean-Claude; Espinosa, Enrique","Versatility and dynamics of the copper(i) coordination sphere in sterically hindering tris(pyrazolyl)methane-incorporating macrobicycles","New Journal of Chemistry","2009","33","2","327","","10.1039/b816275a","","","0.71069","MoKα","","0.0876","0.052","","","0.1219","0.1393","","","","","","1.019","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051636","16.0914","0.0003","16.2811","0.0004","16.9439","0.0006","101.575","0.001","94.08","0.002","116.739","0.001","3817.07","0.19","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C81.5 H75 Cl N12 O2 S6 -","- C81.5 H73 Cl N12 O2 S6 -","- C163 H146 Cl2 N24 O4 S12 -","2","1","","Wang, Leyong; Chambron, Jean-Claude; Espinosa, Enrique","Versatility and dynamics of the copper(i) coordination sphere in sterically hindering tris(pyrazolyl)methane-incorporating macrobicycles","New Journal of Chemistry","2009","33","2","327","","10.1039/b816275a","","","0.71069","MoKα","","0.1277","0.0848","","","0.2127","0.2396","","","","","","1.04","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051637","11.2715","0.0009","19.383","0.0007","25.9182","0.0018","90","","99.967","0.006","90","","5577","0.6","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C62 H72 N4 O8 -","- C62 H72 N4 O8 -","- C248 H288 N16 O32 -","4","1","","Cuřínová, Petra; Stibor, Ivan; Budka, Jan; Sýkora, Jan; Lang, Kamil; Lhoták, Pavel","Anion recognition by diureido-calix[4]arenes in the 1,3-alternate conformation","New Journal of Chemistry","2009","33","3","612","","10.1039/b816790g","","","1.5418","CuKα","","0.1658","0.0825","","0.1197","0.0822","0.0822","","","","","","1.1561","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051638","9.7446","0.0009","11.5028","0.0011","11.7836","0.0011","98.106","0.006","98.719","0.006","100.454","0.006","1264.5","0.2","100","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H24 N6 -","- C32 H24 N6 -","- C64 H48 N12 -","2","1","","Tidmarsh, Ian S.; Taylor, Brian F.; Hardie, Michaele J.; Russo, Luca; Clegg, William; Ward, Michael D.","Further investigations into tetrahedral M4L6 cage complexes containing guest anions: new structures and NMR spectroscopic studies","New Journal of Chemistry","2009","33","2","366","","10.1039/b816864d","","","0.71073","MoKα","","0.0524","0.0394","","","0.096","0.1041","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051639","19.8865","0.0006","19.8865","0.0006","48.236","0.003","90","","90","","120","","16520.3","1.2","150","2","150","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C192 H144 B8 F32 N36 Zn4 -","- C192 H144 B4 F16 N36 Zn6 -","- C576 H432 B12 F48 N108 Zn18 -","3","0.166667","","Tidmarsh, Ian S.; Taylor, Brian F.; Hardie, Michaele J.; Russo, Luca; Clegg, William; Ward, Michael D.","Further investigations into tetrahedral M4L6 cage complexes containing guest anions: new structures and NMR spectroscopic studies","New Journal of Chemistry","2009","33","2","366","","10.1039/b816864d","","","0.71073","MoKα","","0.2118","0.1872","","","0.4858","0.5105","","","","","","2.161","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051640","16.0291","0.0003","13.6181","0.0003","16.6842","0.0003","90","","117.256","0.001","90","","3237.56","0.11","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 B2 Cd F8 N8 O4 -","- C30 H28 B2 Cd F8 N8 O4 -","- C120 H112 B8 Cd4 F32 N32 O16 -","4","1","","Tidmarsh, Ian S.; Taylor, Brian F.; Hardie, Michaele J.; Russo, Luca; Clegg, William; Ward, Michael D.","Further investigations into tetrahedral M4L6 cage complexes containing guest anions: new structures and NMR spectroscopic studies","New Journal of Chemistry","2009","33","2","366","","10.1039/b816864d","","","0.71073","MoKα","","0.0389","0.0381","","","0.0939","0.0943","","","","","","1.253","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051641","22.0402","0.0007","19.5943","0.0006","43.0372","0.0013","90","","92.863","0.002","90","","18562.9","1","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C173 H158 B8 Cd4 F32 N36 O8 -","- C173 H147 B6 Cd4 F24 N36 O8 -","- C692 H588 B24 Cd16 F96 N144 O32 -","4","1","","Tidmarsh, Ian S.; Taylor, Brian F.; Hardie, Michaele J.; Russo, Luca; Clegg, William; Ward, Michael D.","Further investigations into tetrahedral M4L6 cage complexes containing guest anions: new structures and NMR spectroscopic studies","New Journal of Chemistry","2009","33","2","366","","10.1039/b816864d","","","0.71073","MoKα","","0.1426","0.1148","","","0.2724","0.2849","","","","","","1.138","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051642","32.973","0.01","32.973","0.01","32.973","0.01","90","","90","","90","","35849","19","120","2","120","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C168 H132 F24 N36 Si4 Zn4 -","- C168 H132 F24 N36 Si4 Zn4 -","- C1344 H1056 F192 N288 Si32 Zn32 -","8","0.333333","","Tidmarsh, Ian S.; Taylor, Brian F.; Hardie, Michaele J.; Russo, Luca; Clegg, William; Ward, Michael D.","Further investigations into tetrahedral M4L6 cage complexes containing guest anions: new structures and NMR spectroscopic studies","New Journal of Chemistry","2009","33","2","366","","10.1039/b816864d","","","0.6926","synchrotron","","0.2315","0.1578","","","0.4413","0.4761","","","","","","1.518","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051643","25.117","0.0004","11.899","0.0006","9.302","0.0012","90","","90","","90","","2780.1","0.4","173","2","173","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C21 H24 F6 N6 O7 S2 Zn -","- C21 H24 F6 N6 O7 S2 Zn -","- C84 H96 F24 N24 O28 S8 Zn4 -","4","1","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.71073","MoKα","","0.1665","0.068","","","0.1108","0.1379","","","","","","1.006","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051644","26.46","0.02","4.493","0.004","17.26","0.013","90","","111.24","0.04","90","","1913","3","273","2","273","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C37 H36 N13.5 -","- C37 H36 N13.5 -","- C74 H72 N27 -","2","0.5","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.2647","synchrotron","","0.1386","0.0898","","","0.2179","0.2592","","","","","","0.969","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051645","6.4521","0.0002","28.569","0.0013","11.0892","0.0004","90","","92.813","0.002","90","","2041.61","0.13","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H28 N4 O2 Si -","- C19 H28 N4 O2 Si -","- C76 H112 N16 O8 Si4 -","4","1","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.71073","MoKα","","0.1225","0.054","","","0.1133","0.1372","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051646","7.2195","0.0004","11.2353","0.0004","13.58","0.0006","92.83","0.003","102.655","0.002","92.846","0.003","1071.38","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H30 N4 O2 Si -","- C20 H30 N4 O2 Si -","- C40 H60 N8 O4 Si2 -","2","1","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.71073","MoKα","","0.0858","0.0528","","","0.1337","0.1538","","","","","","1.039","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051647","10.2401","0.0003","13.1113","0.0006","17.6193","0.0007","90","","98.972","0.002","90","","2336.64","0.16","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 F6 N4 O8 Pb S2 -","- C16 H12 F6 N4 O8 Pb S2 -","- C64 H48 F24 N16 O32 Pb4 S8 -","4","1","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.71073","MoKα","","0.0552","0.0338","","","0.0699","0.0761","","","","","","1.014","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051648","8.7467","0.0002","13.0859","0.0005","26.4906","0.0008","90","","97.775","0.002","90","","3004.2","0.16","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 F6 N6 O8 Pb S2 -","- C22 H24 F6 N6 O8 Pb S2 -","- C88 H96 F24 N24 O32 Pb4 S8 -","4","1","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.71073","MoKα","","0.1056","0.062","","","0.1292","0.1441","","","","","","1.038","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051649","9.5365","0.0019","12.446","0.003","10.605","0.002","90","","110.52","0.03","90","","1178.9","0.5","173","2","173","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C16 H12 F6 N4 O8 Pb S2 -","- C16 H12 F6 N4 O8 Pb S2 -","- C32 H24 F12 N8 O16 Pb2 S4 -","2","0.5","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.71073","MoKα","","0.0549","0.0429","","","0.1041","0.1121","","","","","","1.064","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051650","11.6632","0.0015","22.296","0.004","8.528","0.0008","90","","93.86","0.008","90","","2212.6","0.5","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C16 H12 F6 N4 O8 S2 Zn -","- C16 H12 F6 N4 O8 S2 Zn -","- C64 H48 F24 N16 O32 S8 Zn4 -","4","0.5","","Ulrich, Sébastien; Buhler, Eric; Lehn, Jean-Marie","Reversible constitutional switching between macrocycles and polymers induced by shape change in a dynamic covalent system","New Journal of Chemistry","2009","33","2","271","","10.1039/b817261g","","","0.71073","MoKα","","0.1943","0.1171","","","0.1503","0.1697","","","","","","1.223","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051651","13.8836","0.0018","18.679","0.003","19.283","0.003","92.901","0.002","94.205","0.002","100.971","0.002","4885.4","1.3","80","2","80","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H123 N18 O37.5 Pt3 -","- C66 H84 N18.001 O37.503 Pt3 -","- C132 H168 N36.002 O75.006 Pt6 -","2","1","","Yamashita, Ken-ichi; Sato, Kei-ichi; Kawano, Masaki; Fujita, Makoto","Photo-induced self-assembly of Pt(ii)-linked rings and cages via the photolabilization of a Pt(ii)‒py bond","New Journal of Chemistry","2009","33","2","264","","10.1039/b817713a","","","0.71073","MoKα","","0.0476","0.0383","","","0.1039","0.1129","","","","","","1.022","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051652","9.8178","0.0005","15.3715","0.0007","12.2627","0.0006","90","","91.809","0.001","90","","1849.69","0.16","233","","233","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 Se -","- C26 H18 Se -","- C104 H72 Se4 -","4","1","","Nakamoto, Takashi; Hayashi, Satoko; Nakanishi, Waro; Minoura, Mao; Yamamoto, Gaku","Structures and dynamic stereochemistry of 9-arylselanyltriptycenes: X-ray crystallographic, spectroscopic and theoretical investigations","New Journal of Chemistry","2009","33","7","1588","","10.1039/b817949b","","","0.71073","MoKα","","0.031","0.0243","","","0.06","0.0632","","","","","","1.024","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051653","9.6439","0.0004","11.2233","0.0005","20.4121","0.0008","74.692","0.001","87.418","0.001","77.849","0.001","2083.08","0.15","233","","233","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H23 N Se -","- C28 H23 N Se -","- C112 H92 N4 Se4 -","4","2","","Nakamoto, Takashi; Hayashi, Satoko; Nakanishi, Waro; Minoura, Mao; Yamamoto, Gaku","Structures and dynamic stereochemistry of 9-arylselanyltriptycenes: X-ray crystallographic, spectroscopic and theoretical investigations","New Journal of Chemistry","2009","33","7","1588","","10.1039/b817949b","","","0.71073","MoKα","","0.042","0.034","","","0.0933","0.098","","","","","","1.074","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051654","11.5331","0.0011","14.2581","0.0014","12.4437","0.0012","90","","91.798","0.001","90","","2045.2","0.3","233","","233","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H20 O Se -","- C27 H20 O Se -","- C108 H80 O4 Se4 -","4","1","","Nakamoto, Takashi; Hayashi, Satoko; Nakanishi, Waro; Minoura, Mao; Yamamoto, Gaku","Structures and dynamic stereochemistry of 9-arylselanyltriptycenes: X-ray crystallographic, spectroscopic and theoretical investigations","New Journal of Chemistry","2009","33","7","1588","","10.1039/b817949b","","","0.71073","MoKα","","0.0365","0.0283","","","0.0732","0.0772","","","","","","1.064","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051655","11.8868","0.0006","13.9067","0.0007","22.8836","0.0011","90","","90","","90","","3782.8","0.3","233","","233","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C26 H17 Cl Se -","- C26 H17 Cl Se -","- C208 H136 Cl8 Se8 -","8","1","","Nakamoto, Takashi; Hayashi, Satoko; Nakanishi, Waro; Minoura, Mao; Yamamoto, Gaku","Structures and dynamic stereochemistry of 9-arylselanyltriptycenes: X-ray crystallographic, spectroscopic and theoretical investigations","New Journal of Chemistry","2009","33","7","1588","","10.1039/b817949b","","","0.71073","MoKα","","0.0369","0.0269","","","0.0733","0.0855","","","","","","1.131","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051656","7.9805","0.0004","14.0346","0.0007","34.5168","0.0018","90","","90","","90","","3866","0.3","233","","233","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H17 N O2 Se -","- C26 H17 N O2 Se -","- C208 H136 N8 O16 Se8 -","8","1","","Nakamoto, Takashi; Hayashi, Satoko; Nakanishi, Waro; Minoura, Mao; Yamamoto, Gaku","Structures and dynamic stereochemistry of 9-arylselanyltriptycenes: X-ray crystallographic, spectroscopic and theoretical investigations","New Journal of Chemistry","2009","33","7","1588","","10.1039/b817949b","","","0.71073","MoKα","","0.0542","0.0385","","","0.0968","0.1117","","","","","","1.17","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051657","13.3702","0.0003","15.0329","0.0003","9.6952","0.0002","90","","104.763","0.002","90","","1884.34","0.07","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 N2 O2 -","- C24 H18 N2 O2 -","- C96 H72 N8 O8 -","4","1","","Kowalski, K.; Long, N. J.; Kuimova, M. K.; Kornyshev, A. A.; Taylor, A. G.; White, A. J. P.","Synthesis and characterisation of substituted diphenylamines—charge-transfer, donor‒acceptor systems localised at water‒oil interfaces","New Journal of Chemistry","2009","33","3","598","","10.1039/b818110a","","","0.71073","MoKα","","0.0645","0.0447","","","0.1306","0.1426","","","","","","1.133","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051658","5.69284","0.00014","40.9581","0.001","9.1109","0.0002","90","","101.802","0.002","90","","2079.46","0.09","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 I N2 -","- C24 H21 I N2 -","- C96 H84 I4 N8 -","4","1","","Kowalski, K.; Long, N. J.; Kuimova, M. K.; Kornyshev, A. A.; Taylor, A. G.; White, A. J. P.","Synthesis and characterisation of substituted diphenylamines—charge-transfer, donor‒acceptor systems localised at water‒oil interfaces","New Journal of Chemistry","2009","33","3","598","","10.1039/b818110a","","","0.71073","MoKα","","0.0657","0.0439","","","0.1134","0.1199","","","","","","1.052","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051659","9.067","0.0017","10.852","0.002","21.5","0.004","100.431","0.015","90.436","0.015","103.375","0.016","2021.4","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23.25 H20.5 Cl1.5 N2 O0.5 -","- C23.2505 H19.501 Cl1.501 N2 O0.5 -","- C93.002 H78.004 Cl6.004 N8 O2 -","4","2","","Kowalski, K.; Long, N. J.; Kuimova, M. K.; Kornyshev, A. A.; Taylor, A. G.; White, A. J. P.","Synthesis and characterisation of substituted diphenylamines—charge-transfer, donor‒acceptor systems localised at water‒oil interfaces","New Journal of Chemistry","2009","33","3","598","","10.1039/b818110a","","","1.54248","CuKα","","0.1145","0.0617","","","0.1592","0.1952","","","","","","0.94","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051660","7.2605","0.0001","22.7352","0.0005","9.2648","0.0002","90","","99.396","0.001","90","","1508.81","0.05","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H20 Fe O P2 -","- C15 H20 Fe O P2 -","- C60 H80 Fe4 O4 P8 -","4","1","","Mucha, Bartosz; Kłys, Arkadiusz; Zakrzewski, Janusz; Makal, Anna; Woźniak, Krzysztof","Unusual diastereoselective reduction of 2-propionyl-3,3′,4,4′-tetramethyl-1,1′-diphosphaferrocene to the corresponding alcohol by BH3·Me2S. X-Ray diffraction and DFT study","New Journal of Chemistry","2009","33","4","807","","10.1039/b818242f","","","0.71073","MoKα","","0.0515","0.0431","","","0.1028","0.1064","","","","","","1.067","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051661","7.3557","0.0006","21.277","0.002","20.5269","0.0016","90","","98.503","0.005","90","","3177.3","0.5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H22 Cl Fe O10 P2 W2 -","- C28 H22 Cl0.5 Fe O11 P2 W2 -","- C112 H88 Cl2 Fe4 O44 P8 W8 -","4","1","","Mucha, Bartosz; Kłys, Arkadiusz; Zakrzewski, Janusz; Makal, Anna; Woźniak, Krzysztof","Unusual diastereoselective reduction of 2-propionyl-3,3′,4,4′-tetramethyl-1,1′-diphosphaferrocene to the corresponding alcohol by BH3·Me2S. X-Ray diffraction and DFT study","New Journal of Chemistry","2009","33","4","807","","10.1039/b818242f","","","0.71073","MoKα","","0.0448","0.0393","","","0.0896","0.0926","","","","","","1.14","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051662","22.209","0.003","10.7792","0.0013","19.506","0.002","90","","123.758","0.003","90","","3882.3","0.8","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H48 Cl2 Fe2 O10 -","- C39 H48 Cl2 Fe2 O10 -","- C156 H192 Cl8 Fe8 O40 -","4","0.5","","Dutta, Supriya; Biswas, Papu; Dutta, Sujit K.; Nag, Kamalaksha","Methoxo-bridged diiron(iii) complex of m-xylylenebis(acetylacetonate) showing remarkable thermal stability for encapsulated dichloromethane","New Journal of Chemistry","2009","33","4","847","","10.1039/b818578f","","","0.71073","MoKα","","0.0795","0.05","","","0.1137","0.1286","","","","","","1.015","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051663","6.7522","0.0004","7.788","0.0003","10.0091","0.0004","83.827","0.003","75.925","0.004","66.539","0.004","468.3","0.04","100","2","100","2","","","","","","","5,5-hidrazinebistetrazole was treated with lithium hydroxide in water.","5","P -1","-P 1","2","Lithium hydrazinebistetrazolate trihydrate","lithium hydrazinebistetrazolate trihydrate","","- C2 H8 Li2 N10 O3 -","- C2 H8 Li2 N10 O3 -","- C4 H16 Li4 N20 O6 -","2","1","","Ebespächer, Moritz; Klapötke, Thomas M.; Miró Sabaté, Carles","Nitrogen-rich alkali metal 5,5′-hydrazinebistetrazolate salts: environmentally friendly compounds in pyrotechnic mixtures","New Journal of Chemistry","2009","33","3","517","","10.1039/b818927g","","","0.71073","MoKα","","0.041","0.0316","","","0.0898","0.0933","","","","","","1.104","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051664","6.5093","0.0002","20.3928","0.0006","6.7479","0.0002","90","","111.49","0.004","90","","833.47","0.05","100","2","100","2","","","","","","","5,5-hidrazinebistetrazole was treated with rubidium carbonate in water.","4","P 1 21/n 1","-P 2yn","14","Rubidium hydrazinebistetrazolate","rubidium hydrazinebistetrazolate","","- C2 H2 N10 Rb2 -","- C2 H2 N10 Rb2 -","- C8 H8 N40 Rb8 -","4","1","","Ebespächer, Moritz; Klapötke, Thomas M.; Miró Sabaté, Carles","Nitrogen-rich alkali metal 5,5′-hydrazinebistetrazolate salts: environmentally friendly compounds in pyrotechnic mixtures","New Journal of Chemistry","2009","33","3","517","","10.1039/b818927g","","","0.71073","MoKα","","0.036","0.0211","","","0.0398","0.0452","","","","","","1.019","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051665","6.0662","0.0001","8.5638","0.0002","17.8315","0.0004","90","","90","","90","","926.34","0.03","200","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C2 H2 Cs2 N10 -","- C2 H2 Cs2 N10 -","- C8 H8 Cs8 N40 -","4","1","","Ebespächer, Moritz; Klapötke, Thomas M.; Miró Sabaté, Carles","Nitrogen-rich alkali metal 5,5′-hydrazinebistetrazolate salts: environmentally friendly compounds in pyrotechnic mixtures","New Journal of Chemistry","2009","33","3","517","","10.1039/b818927g","","x-ray","0.71073","MoKα","","0.0175","0.0165","","","0.0376","0.0377","","","","","","1.182","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051666","11.2727","0.0007","12.873","0.0007","12.9939","0.0007","66.724","0.003","72.538","0.003","71.602","0.003","1609.99","0.16","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","Benzene-1,3,5-tricarboxylic acid tris(8-hydroxyquinoline) ester 8-hydroxyquinoline clathrate","","- C38.25 H22.5 N3.25 O6.25 -","- C38.25 H22.5 N3.25 O6.25 -","- C76.5 H45 N6.5 O12.5 -","2","1","","Westcott, Aleema; Sumby, Christopher J.; Walshaw, Richard D.; Hardie, Michaele J.","Metallo-gels and organo-gels with tripodal cyclotriveratrylene-type and 1,3,5-substituted benzene-type ligands","New Journal of Chemistry","2009","33","4","902","","10.1039/b819352e","","","0.71073","MoKα","","0.0993","0.0739","","","0.219","0.2457","","","","","","1.064","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051667","16.1964","0.0013","7.6782","0.0006","27.625","0.002","90","","105.793","0.004","90","","3305.7","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis{1,3,5-tris(2-quinoline-methoxyl)benzenedisilver(I) nitrate","","- C72 H54 Ag2 N8 O12 -","- C71.84 H42 Ag2 N7.98 O12 -","- C143.68 H84 Ag4 N15.96 O24 -","2","0.5","","Westcott, Aleema; Sumby, Christopher J.; Walshaw, Richard D.; Hardie, Michaele J.","Metallo-gels and organo-gels with tripodal cyclotriveratrylene-type and 1,3,5-substituted benzene-type ligands","New Journal of Chemistry","2009","33","4","902","","10.1039/b819352e","","","0.71073","MoKα","","0.1024","0.0608","","","0.1819","0.2151","","","","","","1.101","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051668","22.838","0.003","10.8673","0.0014","10.1015","0.0014","90","","90","","90","","2507.1","0.6","396","2","396","2","","","","","","","","5","C m c 21","C 2c -2","36","Bis-((R),(S)-napthalenylethyl)thiourea","","","- C54 H48 N4 O2 S4 -","- C54 H48 N4 O1.956 S3.716 -","- C108 H96 N8 O3.912 S7.432 -","2","0.25","","Ali, Haslin Dato Paduka; Quinn, Susan J.; McCabe, Thomas; Kruger, Paul E.; Gunnlaugsson, Thorfinnur","Crystallographic, 1H NMR and CD studies of sterically strained thiourea anion receptors possessing two stereogenic centres","New Journal of Chemistry","2009","33","4","793","","10.1039/b819638a","","","0.71073","MoKα","","0.0304","0.0302","","","0.0815","0.0817","","","","","","1.081","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051669","17.0684","0.0015","8.0774","0.0007","18.8459","0.0017","90","","109.117","0.002","90","","2455","0.4","396","2","396","2","","","","","","","","5","C 1 2 1","C 2y","5","Bis-((S)-napthalenylethyl)thiourea","","","- C27 H30 N2 O S2 -","- C27 H30 N2 O S2 -","- C108 H120 N8 O4 S8 -","4","1","","Ali, Haslin Dato Paduka; Quinn, Susan J.; McCabe, Thomas; Kruger, Paul E.; Gunnlaugsson, Thorfinnur","Crystallographic, 1H NMR and CD studies of sterically strained thiourea anion receptors possessing two stereogenic centres","New Journal of Chemistry","2009","33","4","793","","10.1039/b819638a","","","0.71073","MoKα","","0.0463","0.0397","","","0.0922","0.0992","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051670","17.08","0.002","8.101","0.0009","18.903","0.002","90","","109.013","0.002","90","","2472.8","0.5","396","2","396","2","","","","","","","","5","C 1 2 1","C 2y","5","Bis-((R)-naphthalenylethyl)thiourea","","","- C27 H30 N2 O S2 -","- C27 H30 N2 O S2 -","- C108 H120 N8 O4 S8 -","4","1","","Ali, Haslin Dato Paduka; Quinn, Susan J.; McCabe, Thomas; Kruger, Paul E.; Gunnlaugsson, Thorfinnur","Crystallographic, 1H NMR and CD studies of sterically strained thiourea anion receptors possessing two stereogenic centres","New Journal of Chemistry","2009","33","4","793","","10.1039/b819638a","","","0.71073","MoKα","","0.0606","0.0482","","","0.0989","0.1082","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051671","9.532","0.003","8.421","0.002","28.021","0.008","90","","93.225","0.005","90","","2245.7","1.1","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ag7 Fe3 O28 P8 -","- Ag7 Fe3 O28 P8 -","- Ag28 Fe12 O112 P32 -","4","1","","Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian","Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As)","New Journal of Chemistry","2009","33","5","998","","10.1039/b819846b","","","0.71069","MoKα","","0.0383","0.0383","","","0.0414","0.0414","","","","1.92","1.92","1.92","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051672","9.5561","0.0005","8.4417","0.0004","28.2257","0.0014","90","","93.465","0.002","90","","2272.8","0.2","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag7 Fe3 O28 P8 -","- Ag7 Fe3 O28 P8 -","- Ag28 Fe12 O112 P32 -","4","0.5","","Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian","Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As)","New Journal of Chemistry","2009","33","5","998","","10.1039/b819846b","","","0.71069","MoKα","","0.0422","0.0422","","","0.0469","0.0469","","","","1.61","1.61","1.61","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051673","9.9139","0.0014","8.6068","0.0012","28.904","0.004","90","","93.317","0.002","90","","2462.2","0.6","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ag7 As8 Fe3 O28 -","- Ag7 As8 Fe3 O28 -","- Ag28 As32 Fe12 O112 -","4","1","","Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian","Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As)","New Journal of Chemistry","2009","33","5","998","","10.1039/b819846b","","","0.71069","MoKα","","0.0409","0.0409","","","0.041","0.041","","","","1.82","1.82","1.82","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051674","9.9285","0.0003","8.6101","0.0002","29.039","0.0008","90","","93.5228","0.0011","90","","2477.72","0.12","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ag7 As8 Fe3 O28 -","- Ag7 As8 Fe3 O28 -","- Ag28 As32 Fe12 O112 -","4","0.5","","Quarez, Eric; Mentré, Olivier; Oumellal, Yassine; Masquelier, Christian","Crystal structures of new silver ion conductors Ag7Fe3(X2O7)4 (X = P, As)","New Journal of Chemistry","2009","33","5","998","","10.1039/b819846b","","","0.71069","MoKα","","0.0316","0.0316","","","0.0332","0.0332","","","","1.24","1.24","1.24","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051675","8.618","0.0004","12.4218","0.0008","13.606","0.0007","90","","104.255","0.003","90","","1411.69","0.13","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N3 O7 V -","- C12 H12 N3 O7 V -","- C48 H48 N12 O28 V4 -","4","1","","Gyepes, Róbert; Pacigová, Silvia; Sivák, Michal; Tatiersky, Jozef","Experimental and computational evidence of solid-state anion–π and π–π interactions in [VO(O2)(L)(pa)]·xH2O complexes (L = picolinate, pyrazinate or quinolinate; pa = picolinamide)","New Journal of Chemistry","2009","33","7","1515","","10.1039/b819875f","","","0.71073","MoKα","","0.0675","0.0404","","","0.086","0.0959","","","","","","1.032","","","","has coordinates","282882","2023-04-27","15:29:01",""
"7051676","9.6949","0.0003","14.4076","0.0005","11.6205","0.0003","90","","96.242","0.002","90","","1613.53","0.09","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 N3 O10 V -","- C13 H14 N3 O10 V -","- C52 H56 N12 O40 V4 -","4","1","","Gyepes, Róbert; Pacigová, Silvia; Sivák, Michal; Tatiersky, Jozef","Experimental and computational evidence of solid-state anion–π and π–π interactions in [VO(O2)(L)(pa)]·xH2O complexes (L = picolinate, pyrazinate or quinolinate; pa = picolinamide)","New Journal of Chemistry","2009","33","7","1515","","10.1039/b819875f","","","0.71073","MoKα","","0.0459","0.0332","","","0.0874","0.0954","","","","","","1.049","","","","has coordinates","282882","2023-04-27","15:29:02",""
"7051677","4.563","0.001","7.362","0.002","11.334","0.001","105.125","0.001","90.933","0.001","102.871","0.002","357.19","0.13","100","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C4 H16 N16 O4 -","- C4 H16 N16 O4 -","- C4 H16 N16 O4 -","1","0.5","","Klapötke, Thomas M.; Sabaté, Carles Miró","New energetic compounds based on the nitrogen-rich 5,5′-azotetrazolate anion ([C2N10]2−)","New Journal of Chemistry","2009","33","7","1605","","10.1039/b820381d","","x-ray","0.71073","MoKα","","0.059","0.053","","","0.1323","0.1378","","","","","","1.071","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051678","9.3101","0.0003","6.5383","0.0002","19.5637","0.0005","90","","90.481","0.002","90","","1190.84","0.06","200","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H14 N10 O3 -","- C4 H14 N10 O3 -","- C16 H56 N40 O12 -","4","1","","Klapötke, Thomas M.; Sabaté, Carles Miró","New energetic compounds based on the nitrogen-rich 5,5′-azotetrazolate anion ([C2N10]2−)","New Journal of Chemistry","2009","33","7","1605","","10.1039/b820381d","","x-ray","0.71073","MoKα","","0.0676","0.0496","","","0.14","0.15","","","","","","1.073","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051679","9.987","0.002","26.152","0.005","8.529","0.0017","90","","94.71","0.03","90","","2220.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","6-Nitro-((E)-3-phenylallylidene)-2,3- dihydrobenzo(d)(1,3,2)oxazaborole","6-Nitro-((E)-3-phenylallylidene)-2,3-dihydrobenzo[d][1,3,2]oxazaborole","","- C28 H24 B N O -","- C28 H24 B N O -","- C112 H96 B4 N4 O4 -","4","1","","Rodríguez, Mario; Maldonado, José Luis; Ramos-Ortíz, Gabriel; Lamère, Jean François; Lacroix, Pascal G.; Farfán, Norberto; Ochoa, Ma. Eugenia; Santillan, Rosa; Meneses-Nava, Marco Antonio; Barbosa-García, Oracio; Nakatani, Keitaro","Synthesis and non-linear optical characterization of novel borinate derivatives of cinnamaldehyde","New Journal of Chemistry","2009","33","8","1693","","10.1039/b820435g","","","0.71073","MoKα","","0.103","0.0578","","","0.1164","0.1367","","","","","","1.091","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051680","7.9835","0.0003","20.8163","0.0007","11.023","0.0004","90","","101.777","0.002","90","","1793.32","0.11","173","","173","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H22 Cu N2 O5 -","- C20 H22 Cu N2 O5 -","- C80 H88 Cu4 N8 O20 -","4","2","","Constable, Edwin C.; Zhang, Guoqi; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Woggon, Wolf-D.","In search of enantioselective catalysts for the Henry reaction: are two metal centres better than one?","New Journal of Chemistry","2009","33","5","1064","","10.1039/b821995h","","","0.71073","MoKα","","0.0411","0.0235","","0.037","0.0262","0.0262","","","","","","1.0676","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051681","8.8481","0.0003","11.8842","0.0004","11.9786","0.0004","96.919","0.002","106.43","0.002","109.055","0.002","1110.04","0.07","123","","123","","","","","","","","","5","P 1","P 1","1","","","","- C24 H32 Cu N2 O4 -","- C24 H32 Cu N2 O4 -","- C48 H64 Cu2 N4 O8 -","2","2","","Constable, Edwin C.; Zhang, Guoqi; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Woggon, Wolf-D.","In search of enantioselective catalysts for the Henry reaction: are two metal centres better than one?","New Journal of Chemistry","2009","33","5","1064","","10.1039/b821995h","","","0.71073","MoKα","","0.1012","0.0452","","0.0877","0.047","0.047","","","","","","1.1747","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051682","9.5816","0.0007","28.057","0.002","9.7448","0.0007","90","","114.831","0.001","90","","2377.5","0.3","115","2","115","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 B O10 Os3 -","- C19 H17 B O10 Os3 -","- C76 H68 B4 O40 Os12 -","4","1","","Kizas, Ol'ga A.; Erdyakov, Sergey Yu.; Antonov, Dmitrii Yu.; Godovikov, Ivan A.; Vorontsov, Evgenii V.; Dolgushin, Fedor M.; Ezernitskaya, Mariam G.; Barakovskaya, Irina G.","Reactions of H2Os3(CO)10 with triallylboranes: formation of novel triosmium boron-containing olefin clusters","New Journal of Chemistry","2009","33","8","1760","","10.1039/b822277k","","","0.71073","MoKα","","0.0645","0.0461","","","0.0972","0.1018","","","","","","1.044","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051683","9.707","0.003","16.418","0.005","16.152","0.005","90","","97.054","0.007","90","","2554.7","1.4","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 B O10 Os3 -","- C21 H21 B O10 Os3 -","- C84 H84 B4 O40 Os12 -","4","1","","Kizas, Ol'ga A.; Erdyakov, Sergey Yu.; Antonov, Dmitrii Yu.; Godovikov, Ivan A.; Vorontsov, Evgenii V.; Dolgushin, Fedor M.; Ezernitskaya, Mariam G.; Barakovskaya, Irina G.","Reactions of H2Os3(CO)10 with triallylboranes: formation of novel triosmium boron-containing olefin clusters","New Journal of Chemistry","2009","33","8","1760","","10.1039/b822277k","","","0.71073","MoKα","","0.0785","0.0541","","","0.1165","0.1239","","","","","","1.002","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051684","9.6191","0.0005","14.824","0.0007","19.27","0.001","93.924","0.001","98.035","0.001","102.923","0.001","2637.7","0.2","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C21.25 H22 B O10 Os3 -","- C21.25 H22 B O10 Os3 -","- C85 H88 B4 O40 Os12 -","4","2","","Kizas, Ol'ga A.; Erdyakov, Sergey Yu.; Antonov, Dmitrii Yu.; Godovikov, Ivan A.; Vorontsov, Evgenii V.; Dolgushin, Fedor M.; Ezernitskaya, Mariam G.; Barakovskaya, Irina G.","Reactions of H2Os3(CO)10 with triallylboranes: formation of novel triosmium boron-containing olefin clusters","New Journal of Chemistry","2009","33","8","1760","","10.1039/b822277k","","","0.71073","MoKα","","0.0555","0.0331","","","0.062","0.0677","","","","","","0.905","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051685","11.2621","0.0011","18.2768","0.0017","24.541","0.002","90","","90","","90","","5051.4","0.8","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H74 Ba Cu4 N4 O17 -","- C36 H74 Ba Cu4 N4 O17 -","- C144 H296 Ba4 Cu16 N16 O68 -","4","1","","Tahir, Asif Ali; Mazhar, Muhammad; Hamid, Mazhar; Zeller, Matthias; Hunter, Allen D.","Heterobimetallic copper‒barium complexes for deposition of composite oxide thin films","New Journal of Chemistry","2009","33","7","1535","","10.1039/b823024b","","","0.71073","MoKα","","0.068","0.0629","","","0.1668","0.1709","","","","","","1.119","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051686","23.9288","0.0014","19.8564","0.0012","25.5925","0.0015","90","","112.439","0.001","90","","11239.3","1.2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C68 H104 Ba2 Cu8 F36 N8 O33 -","- C68 H104 Ba2 Cu8 F36 N8 O33 -","- C272 H416 Ba8 Cu32 F144 N32 O132 -","4","0.5","","Tahir, Asif Ali; Mazhar, Muhammad; Hamid, Mazhar; Zeller, Matthias; Hunter, Allen D.","Heterobimetallic copper‒barium complexes for deposition of composite oxide thin films","New Journal of Chemistry","2009","33","7","1535","","10.1039/b823024b","","","0.71073","MoKα","","0.0463","0.0374","","","0.0961","0.1069","","","","","","1.079","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051687","9.891","0.001","9.891","0.001","17.167","0.005","90","","90","","90","","1679.5","0.5","294","","","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- C9 H16 O2 -","- C9 H16 O2 -","- C72 H128 O16 -","8","1","","Nguyen, Vi T.; Chan, Isa Y. H.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Crystallisation of C2-symmetric endo,endo-bicyclo[3.3.1]nonane-2-6-diols: supramolecular synthons and concomitant degrees of enantiomer separation","New Journal of Chemistry","2009","33","8","1736","","10.1039/b900463g","","x-ray","1.54184","CuKα","","","0.04","","","","0.056","","","","","","1.41","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051688","8.737","0.002","14.917","0.004","15.313","0.004","90","","103.399","0.004","90","","1941.4","0.9","113.1","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H23 O P -","- C26 H23 O P -","- C104 H92 O4 P4 -","4","1","","Shiraishi, Kentaro; Kashiwabara, Taigo; Sanji, Takanobu; Tanaka, Masato","Aggregation-induced emission of dendritic phosphole oxides","New Journal of Chemistry","2009","33","8","1680","","10.1039/b900923j","","","0.7107","MoKα","","","0.034","","","","0.047","","","","","","1.099","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051689","17.879","0.008","17.879","0.008","17.607","0.008","90","","90","","90","","5628","4","150","1","150","1","","","","","","","","7","P 42/n :2","-P 4bc","86","","","","- C43 H18 Cu2 F30 N4 O8 S2 -","- C43 H18 Cu2 F30 N4 O8 S2 -","- C172 H72 Cu8 F120 N16 O32 S8 -","4","0.5","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Dorlet, Pierre; Métivier, Rémi; Nakatani, Keitaro","Photo-controlled release and uptake of Cu(hfac)2 in solution for a binuclear copper complex with a photochromic dithiazolylethene bridging ligand","New Journal of Chemistry","2009","33","6","1380","","10.1039/b901201j","","x-ray","0.71073","MoKα","","0.0657","0.1034","","","0.1","0.0729","","","","","","1.222","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051690","17.699","0.005","17.418","0.005","17.916","0.005","90","","106.609","0.005","90","","5293","3","100","1","100","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H18 Cu2 F30 N4 O8 S2 -","- C43 H18 Cu2 F30 N4 O8 S2 -","- C172 H72 Cu8 F120 N16 O32 S8 -","4","1","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Dorlet, Pierre; Métivier, Rémi; Nakatani, Keitaro","Photo-controlled release and uptake of Cu(hfac)2 in solution for a binuclear copper complex with a photochromic dithiazolylethene bridging ligand","New Journal of Chemistry","2009","33","6","1380","","10.1039/b901201j","","x-ray","0.71069","MoKα","","0.0741","0.0641","","","0.1812","0.1926","","","","","","1.045","","","","has coordinates,has disorder","180070","2020-10-21","18:00:00",""
"7051691","14.4416","0.0004","15.5291","0.0004","15.5304","0.0003","107.02","0.001","100.316","0.001","104.63","0.001","3099.57","0.14","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H9 Cu F19 N2 O4 S -","- C24 H9 Cu F19 N2 O4 S -","- C96 H36 Cu4 F76 N8 O16 S4 -","4","2","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Dorlet, Pierre; Métivier, Rémi; Nakatani, Keitaro","Photo-controlled release and uptake of Cu(hfac)2 in solution for a binuclear copper complex with a photochromic dithiazolylethene bridging ligand","New Journal of Chemistry","2009","33","6","1380","","10.1039/b901201j","","","0.71073","MoKα","","0.1213","0.0706","","","0.191","0.2292","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051692","17.681","0.005","17.681","0.005","17.726","0.005","90","","90","","90","","5541","3","100","1","100","1","","","","","","","","7","P 42/n :2","-P 4bc","86","","","","- C43 H18 F30 N4 O8 S2 Zn2 -","- C43 H18 F30 N4 O8 S2 Zn2 -","- C172 H72 F120 N16 O32 S8 Zn8 -","4","0.5","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Dorlet, Pierre; Métivier, Rémi; Nakatani, Keitaro","Photo-controlled release and uptake of Cu(hfac)2 in solution for a binuclear copper complex with a photochromic dithiazolylethene bridging ligand","New Journal of Chemistry","2009","33","6","1380","","10.1039/b901201j","","x-ray","0.71069","MoKα","","0.0771","0.0542","","","0.1553","0.1767","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051693","17.8094","0.0003","17.8094","0.0003","18.0024","0.0006","90","","90","","90","","5709.9","0.2","273","2","273","2","","","","","","","","7","P 42/n :2","-P 4bc","86","","","","- C43 H18 F30 N4 Ni2 O8 S2 -","- C43 H18 F30 N4 Ni2 O8 S2 -","- C172 H72 F120 N16 Ni8 O32 S8 -","4","0.5","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Dorlet, Pierre; Métivier, Rémi; Nakatani, Keitaro","Photo-controlled release and uptake of Cu(hfac)2 in solution for a binuclear copper complex with a photochromic dithiazolylethene bridging ligand","New Journal of Chemistry","2009","33","6","1380","","10.1039/b901201j","","x-ray","0.71073","MoKα","","0.1101","0.0772","","","0.2257","0.2661","","","","","","1.045","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051694","17.718","0.005","17.718","0.005","17.836","0.005","90","","90","","90","","5599","3","150","2","150","2","","","","","","","","7","P 42/n :2","-P 4bc","86","","","","- C43 H18 Co2 F30 N4 O8 S2 -","- C43 H18 Co2 F30 N4 O8 S2 -","- C172 H72 Co8 F120 N16 O32 S8 -","4","0.5","","Giraud, Marion; Léaustic, Anne; Guillot, Régis; Yu, Pei; Dorlet, Pierre; Métivier, Rémi; Nakatani, Keitaro","Photo-controlled release and uptake of Cu(hfac)2 in solution for a binuclear copper complex with a photochromic dithiazolylethene bridging ligand","New Journal of Chemistry","2009","33","6","1380","","10.1039/b901201j","","x-ray","0.71069","MoKα","","0.1176","0.0734","","","0.1856","0.2268","","","","","","1.037","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051695","10.224","0.002","11.407","0.003","7.0403","0.0018","107.95","0.02","104.63","0.02","93.175","0.018","747.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-[2-(1,3-dithiol-2-ylidene)-1,3-dithiol-4-yl]-4-(propan-2-yloxy) cyclobut-3-ene-1,2-dione","","- C13 H10 O3 S4 -","- C13 H10 O3 S4 -","- C26 H20 O6 S8 -","2","1","","Miyazaki, Akira; Enoki, Toshiaki","Structure and physical properties of isopropyl TTF semisquarates","New Journal of Chemistry","2009","33","6","1249","","10.1039/b902032b","","","0.71069","MoKα","","0.0848","0.0657","","","0.1974","0.2147","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051696","11.9056","0.0017","9.6629","0.0007","11.3482","0.0019","90","","118.32","0.009","90","","1149.3","0.3","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H13 N5 S -","- C9 H13 N5 S -","- C36 H52 N20 S4 -","4","1","","Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille","Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives","New Journal of Chemistry","2009","33","8","1663","","10.1039/b902225b","","","0.71073","MoKα","","0.1009","0.0621","","","0.1841","0.2046","","","","","","1.086","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051697","7.6762","0.0013","8.512","0.0012","10.3122","0.0012","104.177","0.01","102.599","0.011","93.444","0.013","632.94","0.16","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H16 N6 S -","- C10 H16 N6 S -","- C20 H32 N12 S2 -","2","1","","Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille","Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives","New Journal of Chemistry","2009","33","8","1663","","10.1039/b902225b","","","0.71073","MoKα","","0.0969","0.0483","","","0.1172","0.1334","","","","","","1.018","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051698","9.8198","0.0012","9.615","0.002","10.898","0.003","90","","92.127","0.017","90","","1028.3","0.4","250","2","250","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H12 N6 S -","- C7 H12 N6 S -","- C28 H48 N24 S4 -","4","1","","Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille","Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives","New Journal of Chemistry","2009","33","8","1663","","10.1039/b902225b","","","0.71073","MoKα","","0.1255","0.0543","","","0.1164","0.1399","","","","","","0.995","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051699","12.1254","0.001","14.916","0.002","15.9171","0.0019","90","","108.354","0.008","90","","2732.4","0.6","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 N5 S -","- C13 H15 N5 S -","- C104 H120 N40 S8 -","8","2","","Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille","Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives","New Journal of Chemistry","2009","33","8","1663","","10.1039/b902225b","","","0.71073","MoKα","","0.2126","0.0552","","","0.1154","0.1632","","","","","","0.911","","","","has coordinates","180070","2020-10-21","18:00:00",""
"7051700","5.3123","0.0008","23.048","0.003","9.1244","0.0014","90","","103.276","0.013","90","","1087.3","0.3","200","2","200","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C10 H14 N4 O2 -","- C10 H14 N4 O2 -","- C40 H56 N16 O8 -","4","1","","Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille","Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives","New Journal of Chemistry","2009","33","8","1663","","10.1039/b902225b","","","0.71073","MoKα","","0.0871","0.0459","","","0.0932","0.1086","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051701","7.8076","0.0007","15.593","0.002","10.9987","0.0014","90","","107.222","0.01","90","","1279","0.3","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 N5 O -","- C13 H15 N5 O -","- C52 H60 N20 O4 -","4","1","","Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille","Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives","New Journal of Chemistry","2009","33","8","1663","","10.1039/b902225b","","","0.71073","MoKα","","0.1066","0.0511","","","0.1234","0.1404","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051702","5.691","0.0005","18.042","0.002","11.6058","0.0012","90","","101.178","0.011","90","","1169","0.2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 N4 O S -","- C10 H14 N4 O S -","- C40 H56 N16 O4 S4 -","4","1","","Oms, Olivier; Norel, Lucie; Chamoreau, Lise-Marie; Rousselière, Hélène; Train, Cyrille","Conformation and crystal packing sensitivity to substitution of thioxo- and oxo-tetrazane derivatives","New Journal of Chemistry","2009","33","8","1663","","10.1039/b902225b","","","0.71073","MoKα","","0.0834","0.0451","","","0.1115","0.1226","","","","","","1.005","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051703","11.938","","15.175","0.0002","17.5546","0.0002","81.079","0.006","76.752","0.006","69.389","0.004","2887.73","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C132 H104 Er2 N8 O24 S6 -","- C132 H104 Er2 N8 O24 S6 -","- C132 H104 Er2 N8 O24 S6 -","1","0.5","","Fu, Ruibiao; Hu, Shengmin; Sheng, Tianlu; Wu, Xintao","Synthesis, crystal structures, and luminescent properties of eleven new lanthanide and yttrium complexes with fluorescent whitener and 1,10-phenanthroline","New Journal of Chemistry","2009","33","7","1508","","10.1039/b902803j","","","0.71073","MoKα","","0.0461","0.0397","","","0.0843","0.0887","","","","","","1.099","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051704","27.223","0.006","12.263","0.002","28.284","0.004","90","","97.02","0.009","90","","9371","3","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C52 H128 Cl4 Co2 Cu5 N32 O20 -","- C52 H120 Cl4 Co2 Cu5 N32 O20 -","- C208 H480 Cl16 Co8 Cu20 N128 O80 -","4","0.5","","Hernandez-Molina, Maria; Long, Jérôme; Chamoreau, Lise-Marie; Cantin, Jean-Louis; von Bardeleben, Jürgen; Marvaud, Valérie","Hexacyanidometalate molecular chemistry: di-, tri-, tetra-, penta- (cis/trans) and hepta-nuclear chromium‒copper and cobalt‒copper complexes","New Journal of Chemistry","2009","33","6","1301","","10.1039/b902889g","","","0.71073","MoKα","","0.1136","0.0644","","","0.173","0.2039","","","","","","1.036","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051705","10.1341","0.0008","12.7726","0.0013","18.652","0.002","73.261","0.012","81.953","0.008","85.288","0.01","2287","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H58 Co Cu N10 O7 P -","- C38 H44 Co Cu N10 O7 P -","- C76 H88 Co2 Cu2 N20 O14 P2 -","2","1","","Hernandez-Molina, Maria; Long, Jérôme; Chamoreau, Lise-Marie; Cantin, Jean-Louis; von Bardeleben, Jürgen; Marvaud, Valérie","Hexacyanidometalate molecular chemistry: di-, tri-, tetra-, penta- (cis/trans) and hepta-nuclear chromium‒copper and cobalt‒copper complexes","New Journal of Chemistry","2009","33","6","1301","","10.1039/b902889g","","","0.71073","MoKα","","0.144","0.0719","","","0.1489","0.1897","","","","","","1.045","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051706","6.8062","0.0011","11.3381","0.0018","14.098","0.002","105.873","0.009","101.336","0.009","106.175","0.006","960.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","7,16-bis(4-methoxybenzyl)-1,4,10,13-tetraoxa-7,16- diazoniacyclooctadecane dihexafluorotantalate dihydrate","7,16-bis(4-methoxybenzyl)-1,4,10,13-tetraoxa-7,16- diazoniacyclooctadecane dihexafluorotantalate dihydrate","","- C28 H48 F12 N2 O8 Ta2 -","- C28 H44.668 F12 N2 O6.334 Ta2 -","- C28 H44.668 F12 N2 O6.334 Ta2 -","1","0.5","","Fonari, Marina S.; Ganin, Eduard V.; Chumakov, Yurii M.; Botoshansky, Mark M.; Suwinska, Kinga; Basok, Stepan S.; Simonov, Yurii A.","Conformational mobility of 7,16-bis(4-methoxybenzyl)-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane in molecular and proton-transfer complexes: X-ray and DFT studies","New Journal of Chemistry","2009","33","8","1646","","10.1039/b902953b","","","0.71073","MoKα","","0.0971","0.0546","","","0.1575","0.1874","","","","","","0.926","","","","has coordinates","189495","2020-10-21","18:00:00",""
"7051707","11.3722","0.0019","15.558","0.004","15.257","0.003","90","","94.475","0.01","90","","2691.2","1","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 N4 -","- C15 H14 N4 -","- C120 H112 N32 -","8","2","","Suen, Maw-Cherng; Yeh, Chun-Wei; Ho, Yuh-Wen; Wang, Ju-Chun","Self-assembly of two-dimensional coordination polymers from AgX (X = BF4−, ClO4−, NO3− and PF6−) and 2,6-dimethyl-3,5-dicyano-4-(6-methyl-2-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2009","33","12","2419","","10.1039/b902977j","","","0.71073","MoKα","","0.1714","0.0646","","","0.1206","0.1618","","","","","","0.992","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051708","10.598","0.003","11.63","0.003","13.641","0.003","90","","103.949","0.004","90","","1631.7","0.7","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 Ag N5 O3 -","- C15 H14 Ag N5 O3 -","- C60 H56 Ag4 N20 O12 -","4","1","","Suen, Maw-Cherng; Yeh, Chun-Wei; Ho, Yuh-Wen; Wang, Ju-Chun","Self-assembly of two-dimensional coordination polymers from AgX (X = BF4−, ClO4−, NO3− and PF6−) and 2,6-dimethyl-3,5-dicyano-4-(6-methyl-2-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2009","33","12","2419","","10.1039/b902977j","","","0.71073","MoKα","","0.0372","0.0319","","","0.0968","0.1021","","","","","","1.046","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051709","10.682","0.003","11.957","0.004","13.368","0.004","90","","102.245","0.007","90","","1668.6","0.9","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 Ag Cl N4 O4 -","- C15 H14 Ag Cl N4 O4 -","- C60 H56 Ag4 Cl4 N16 O16 -","4","1","","Suen, Maw-Cherng; Yeh, Chun-Wei; Ho, Yuh-Wen; Wang, Ju-Chun","Self-assembly of two-dimensional coordination polymers from AgX (X = BF4−, ClO4−, NO3− and PF6−) and 2,6-dimethyl-3,5-dicyano-4-(6-methyl-2-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2009","33","12","2419","","10.1039/b902977j","","","0.71073","MoKα","","0.0873","0.0419","","","0.0817","0.0969","","","","","","0.974","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051710","10.6811","0.0008","11.9175","0.0009","13.2109","0.001","90","","102.117","0.001","90","","1644.2","0.2","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 Ag B F4 N4 -","- C15 H14 Ag B F4 N4 -","- C60 H56 Ag4 B4 F16 N16 -","4","1","","Suen, Maw-Cherng; Yeh, Chun-Wei; Ho, Yuh-Wen; Wang, Ju-Chun","Self-assembly of two-dimensional coordination polymers from AgX (X = BF4−, ClO4−, NO3− and PF6−) and 2,6-dimethyl-3,5-dicyano-4-(6-methyl-2-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2009","33","12","2419","","10.1039/b902977j","","","0.71073","MoKα","","0.0363","0.0287","","","0.0727","0.0778","","","","","","1.052","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051711","6.655","0.0008","20.76","0.0018","13.537","0.002","90","","102.726","0.012","90","","1824.3","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 Ag F6 N4 P -","- C15 H14 Ag F6 N4 P -","- C60 H56 Ag4 F24 N16 P4 -","4","1","","Suen, Maw-Cherng; Yeh, Chun-Wei; Ho, Yuh-Wen; Wang, Ju-Chun","Self-assembly of two-dimensional coordination polymers from AgX (X = BF4−, ClO4−, NO3− and PF6−) and 2,6-dimethyl-3,5-dicyano-4-(6-methyl-2-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2009","33","12","2419","","10.1039/b902977j","","","0.71073","MoKα","","0.0336","0.0301","","","0.0734","0.0757","","","","","","1.032","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051712","14.851","0.003","23.826","0.005","28.135","0.006","90","","90","","90","","9955","4","150","2","150","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C39 H36 Br4 Fe Mn2 N10 O9 -","- C39 H32 Br4 Fe Mn2 N10 O9 -","- C312 H256 Br32 Fe8 Mn16 N80 O72 -","8","1","","Ababei, Rodica; Li, Yang-Guang; Roubeau, Olivier; Kalisz, Marguerite; Bréfuel, Nicolas; Coulon, Claude; Harté, Etienne; Liu, Xueting; Mathonière, Corine; Clérac, Rodolphe","Bimetallic cyanido-bridged magnetic materials derived from manganese(iii) Schiff-base complexes and pentacyanidonitrosylferrate(ii) precursor","New Journal of Chemistry","2009","33","6","1237","","10.1039/b903399h","","","0.71073","MoKα","","0.076","0.0511","","","0.1373","0.1479","","","","","","1.084","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051713","14.751","0.002","14.751","0.002","17.063","0.003","90","","90","","90","","3712.8","1","150","2","150","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C37 H28 Fe Mn2 N10 O6 -","- C37 H28 Fe Mn2 N10 O6 -","- C148 H112 Fe4 Mn8 N40 O24 -","4","0.25","","Ababei, Rodica; Li, Yang-Guang; Roubeau, Olivier; Kalisz, Marguerite; Bréfuel, Nicolas; Coulon, Claude; Harté, Etienne; Liu, Xueting; Mathonière, Corine; Clérac, Rodolphe","Bimetallic cyanido-bridged magnetic materials derived from manganese(iii) Schiff-base complexes and pentacyanidonitrosylferrate(ii) precursor","New Journal of Chemistry","2009","33","6","1237","","10.1039/b903399h","","","0.71073","MoKα","","0.0564","0.0496","","","0.1318","0.139","","","","","","0.948","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051714","18.5154","0.0008","18.5154","0.0008","27.4984","0.0013","90","","90","","90","","9427","0.7","150","2","150","2","","","","","","","","7","I 4/m","-I 4","87","","","","- C87 H98 Cl2 Fe Mn4 N14 O20 -","- C87 H88 Cl2 Fe Mn4 N14 O20 -","- C348 H352 Cl8 Fe4 Mn16 N56 O80 -","4","0.25","","Ababei, Rodica; Li, Yang-Guang; Roubeau, Olivier; Kalisz, Marguerite; Bréfuel, Nicolas; Coulon, Claude; Harté, Etienne; Liu, Xueting; Mathonière, Corine; Clérac, Rodolphe","Bimetallic cyanido-bridged magnetic materials derived from manganese(iii) Schiff-base complexes and pentacyanidonitrosylferrate(ii) precursor","New Journal of Chemistry","2009","33","6","1237","","10.1039/b903399h","","","0.7749","synchrotron","","0.0855","0.0699","","","0.2085","0.2284","","","","","","1.032","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051715","13.576","0.0018","20.7486","0.0018","17.305","0.003","90","","98.192","0.002","90","","4824.8","1.1","566","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C46 H46 Fe2 N2 O9 P2 S3 -","- C46 H46 Fe2 N2 O9 P2 S3 -","- C184 H184 Fe8 N8 O36 P8 S12 -","4","1","","Wang, Yanwei; Li, Zhimei; Zeng, Xianghua; Wang, Xiufeng; Zhan, Caixia; Liu, Yinqiu; Zeng, Xirui; Luo, Qiuyan; Liu, Xiaoming","Synthesis and characterisation of three diiron tetracarbonyl complexes related to the diiron centre of [FeFe]-hydrogenase and their protonating, electrochemical investigations","New Journal of Chemistry","2009","33","8","1780","","10.1039/b903758f","","","0.71073","MoKα","","0.1194","0.0644","","","0.1471","0.1609","","","","","","0.995","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051716","15.347","0.003","22.288","0.005","18.484","0.004","90","","90.15","0.03","90","","6323","2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H74 Co2 N12 O25 -","- C54 H36 Co2 N12 O25 -","- C216 H144 Co8 N48 O100 -","4","1","","Palacios, MaAngeles; Rodríguez-Diéguez, Antonio; Sironi, Angelo; Herrera, Juan Manuel; Mota, Antonio J.; Moreno, Virtudes; Cano, Joan; Colacio, Enrique","Double and triple stranded mesocates containing the bis(bidentate) bridging ligand 1,3-bis(pyridine-2-carboxamide)benzene. Structure, properties and DNA interaction","New Journal of Chemistry","2009","33","9","1901","","10.1039/b905330a","","","0.71073","MoKα","","0.0811","0.0701","","","0.1653","0.1702","","","","","","1.164","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7051717","11.248","0.002","12.108","0.002","12.458","0.002","72.468","0.002","71.4","0.002","63.689","0.002","1415.7","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H36 Cu2 F12 Mn N10 O10 -","- C50 H36 Cu2 F12 Mn N10 O10 -","- C50 H36 Cu2 F12 Mn N10 O10 -","1","0.5","","Palacios, MaAngeles; Rodríguez-Diéguez, Antonio; Sironi, Angelo; Herrera, Juan Manuel; Mota, Antonio J.; Moreno, Virtudes; Cano, Joan; Colacio, Enrique","Double and triple stranded mesocates containing the bis(bidentate) bridging ligand 1,3-bis(pyridine-2-carboxamide)benzene. Structure, properties and DNA interaction","New Journal of Chemistry","2009","33","9","1901","","10.1039/b905330a","","","0.71073","MoKα","","0.0912","0.0694","","","0.1935","0.2107","","","","","","1.045","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051718","13.645","0.002","13.645","0.002","22.394","0.001","90","","90","","120","","3610.8","0.8","150","2","150","2","","","","","","","","5","P 63/m","-P 6c","176","","","","- C54 H73 N13 O26 Zn2 -","- C54 H36 N12 O6 Zn2 -","- C108 H72 N24 O12 Zn4 -","2","0.166667","","Palacios, MaAngeles; Rodríguez-Diéguez, Antonio; Sironi, Angelo; Herrera, Juan Manuel; Mota, Antonio J.; Moreno, Virtudes; Cano, Joan; Colacio, Enrique","Double and triple stranded mesocates containing the bis(bidentate) bridging ligand 1,3-bis(pyridine-2-carboxamide)benzene. Structure, properties and DNA interaction","New Journal of Chemistry","2009","33","9","1901","","10.1039/b905330a","","","0.71073","MoKα","","0.0765","0.0606","","","0.1894","0.206","","","","","","0.852","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051719","13.6913","0.0019","13.6913","0.0019","22.13","0.004","90","","90","","120","","3592.5","1","150","2","150","2","","","","","","","","6","P 63/m","-P 6c","176","","","","- C54 H69 Cl N12 Ni2 O25 -","- C54 H36 N12 Ni2 O6 -","- C108 H72 N24 Ni4 O12 -","2","0.166667","","Palacios, MaAngeles; Rodríguez-Diéguez, Antonio; Sironi, Angelo; Herrera, Juan Manuel; Mota, Antonio J.; Moreno, Virtudes; Cano, Joan; Colacio, Enrique","Double and triple stranded mesocates containing the bis(bidentate) bridging ligand 1,3-bis(pyridine-2-carboxamide)benzene. Structure, properties and DNA interaction","New Journal of Chemistry","2009","33","9","1901","","10.1039/b905330a","","","0.71073","MoKα","","0.0585","0.0482","","","0.1638","0.1683","","","","","","1.108","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051720","12.045","0.002","26.99","0.005","11.652","0.002","90","","103.01","0.03","90","","3690.8","1.2","150","2","150","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C35 H23.5 Cl2 N14.5 O8 Zn -","- C35 H23.5 Cl2 N14.5 O8 Zn -","- C140 H94 Cl8 N58 O32 Zn4 -","4","2","","Ballesteros-Garrido, Rafael; Abarca, Belén; Ballesteros, Rafael; Ramírez de Arellano, Carmen; Leroux, Frédéric R.; Colobert, Françoise; García-España, Enrique","[1,2,3]Triazolo[1,5-a]pyridine derivatives as molecular chemosensors for zinc(ii), nitrite and cyanide anions","New Journal of Chemistry","2009","33","10","2102","","10.1039/b906992e","","","0.71073","MoKα","","0.1237","0.0529","","","0.1055","0.1229","","","","","","0.933","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051721","11.812","0.0015","22.452","0.003","8.8916","0.0011","90","","90","","90","","2358.1","0.5","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C19 H20 Au F3 N8 O3 S -","- C19 H20 Au F3 N8 O3 S -","- C76 H80 Au4 F12 N32 O12 S4 -","4","1","","Gabrielli, William F.; Nogai, Stefan D.; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Tetrazolyl and tetrazolylidene complexes of gold: a synthetic and structural study","New Journal of Chemistry","2009","33","11","2208","","10.1039/b907022b","","","0.71073","MoKα","","0.0517","0.0407","","","0.0854","0.089","","","","","","1.108","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051722","8.644","0.0008","12.7376","0.0012","24.885","0.002","90","","94.429","0.002","90","","2731.8","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 Au Cl2 N4 P -","- C28 H26 Au Cl2 N4 P -","- C112 H104 Au4 Cl8 N16 P4 -","4","1","","Gabrielli, William F.; Nogai, Stefan D.; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Tetrazolyl and tetrazolylidene complexes of gold: a synthetic and structural study","New Journal of Chemistry","2009","33","11","2208","","10.1039/b907022b","","","0.71073","MoKα","","0.0241","0.0213","","","0.0487","0.0498","","","","","","1.047","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051723","10.569","0.003","12.484","0.003","16.827","0.005","95.641","0.004","98.979","0.004","110.714","0.004","2022.7","1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H63 Au2 N11 O -","- C36.008 H63 Au2 N11 O -","- C72.016 H126 Au4 N22 O2 -","2","1","","Gabrielli, William F.; Nogai, Stefan D.; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Tetrazolyl and tetrazolylidene complexes of gold: a synthetic and structural study","New Journal of Chemistry","2009","33","11","2208","","10.1039/b907022b","","","0.71073","MoKα","","0.0874","0.0589","","","0.118","0.1283","","","","","","1.077","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051724","22.829","0.002","12.0611","0.0012","23.755","0.002","90","","112.286","0.002","90","","6052.2","1","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C29 H27 Au F3 N4 O3 P S -","- C29 H27 Au F3 N4 O3 P S -","- C232 H216 Au8 F24 N32 O24 P8 S8 -","8","2","","Gabrielli, William F.; Nogai, Stefan D.; McKenzie, Jean M.; Cronje, Stephanie; Raubenheimer, Helgard G.","Tetrazolyl and tetrazolylidene complexes of gold: a synthetic and structural study","New Journal of Chemistry","2009","33","11","2208","","10.1039/b907022b","","","0.71073","MoKα","","0.1445","0.1114","","","0.258","0.284","","","","","","1.035","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051725","12.142","0.005","14.078","0.005","18.389","0.005","97.013","0.005","109.103","0.005","99.798","0.005","2873.1","1.8","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H60 Ga O3 P3 S4 -","- C66 H60 Ga O3 P3 S4 -","- C132 H120 Ga2 O6 P6 S8 -","2","1","","Vălean, Ana-Maria; Gómez-Ruiz, Santiago; Lönnecke, Peter; Silaghi-Dumitrescu, Ioan; Silaghi-Dumitrescu, Luminita; Hey-Hawkins, Evamarie","Stabilisation of an inorganic digallane by the phosphinobisthiolato P,S,S pincer ligand PPh(2-SC6H4)2","New Journal of Chemistry","2009","33","8","1771","","10.1039/b907668a","","","0.71073","MoKα","","0.0698","0.0325","","","0.0429","0.0483","","","","","","0.95","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051726","15.8418","0.0001","14.3993","0.0001","15.897","0.0001","90","","90","","90","","3626.28","0.04","130","2","130","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H16 Ga P S2 -","- C19 H16 Ga P S2 -","- C152 H128 Ga8 P8 S16 -","8","1","","Vălean, Ana-Maria; Gómez-Ruiz, Santiago; Lönnecke, Peter; Silaghi-Dumitrescu, Ioan; Silaghi-Dumitrescu, Luminita; Hey-Hawkins, Evamarie","Stabilisation of an inorganic digallane by the phosphinobisthiolato P,S,S pincer ligand PPh(2-SC6H4)2","New Journal of Chemistry","2009","33","8","1771","","10.1039/b907668a","","","0.71073","MoKα","","0.0354","0.0262","","","0.0588","0.0686","","","","","","1.228","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051727","11.064","0.002","12.605","0.003","15.919","0.003","93.733","0.017","102.653","0.016","99.969","0.017","2121.2","0.8","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 Ga P S2 -","- C22 H22 Ga P S2 -","- C88 H88 Ga4 P4 S8 -","4","2","","Vălean, Ana-Maria; Gómez-Ruiz, Santiago; Lönnecke, Peter; Silaghi-Dumitrescu, Ioan; Silaghi-Dumitrescu, Luminita; Hey-Hawkins, Evamarie","Stabilisation of an inorganic digallane by the phosphinobisthiolato P,S,S pincer ligand PPh(2-SC6H4)2","New Journal of Chemistry","2009","33","8","1771","","10.1039/b907668a","","","0.71073","MoKα","","0.0504","0.028","","","0.0565","0.0618","","","","","","0.919","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051728","12.4389","0.0014","13.867","0.003","24.7218","0.0011","83.4","0.009","83.011","0.006","73.175","0.014","4037.1","1","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","","","- C44.75 H36 Ga2 P2 S4 -","- C44.75 H36 Ga2 P2 S4 -","- C179 H144 Ga8 P8 S16 -","4","2","","Vălean, Ana-Maria; Gómez-Ruiz, Santiago; Lönnecke, Peter; Silaghi-Dumitrescu, Ioan; Silaghi-Dumitrescu, Luminita; Hey-Hawkins, Evamarie","Stabilisation of an inorganic digallane by the phosphinobisthiolato P,S,S pincer ligand PPh(2-SC6H4)2","New Journal of Chemistry","2009","33","8","1771","","10.1039/b907668a","","","0.71073","MoKα","","0.0554","0.0293","","","0.0549","0.0627","","","","","","1.027","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051729","21.4599","0.0008","10.1678","0.0004","18.279","0.0007","90","","95.722","0.003","90","","3968.6","0.3","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H32 Ga2 P2 S5 -","- C42 H32 Ga2 P2 S5 -","- C168 H128 Ga8 P8 S20 -","4","0.5","","Vălean, Ana-Maria; Gómez-Ruiz, Santiago; Lönnecke, Peter; Silaghi-Dumitrescu, Ioan; Silaghi-Dumitrescu, Luminita; Hey-Hawkins, Evamarie","Stabilisation of an inorganic digallane by the phosphinobisthiolato P,S,S pincer ligand PPh(2-SC6H4)2","New Journal of Chemistry","2009","33","8","1771","","10.1039/b907668a","","","0.71073","MoKα","","0.0662","0.0377","","","0.0808","0.0914","","","","","","1.031","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051730","13.9254","0.0003","13.0617","0.0003","21.3133","0.0004","90","","90","","90","","3876.66","0.14","153","2","153","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C20 H20 F N5 O S -","- C20 H20 F N5 O S -","- C160 H160 F8 N40 O8 S8 -","8","1","","Xie, Xiangyun; Liu, Lang; Jia, Dianzeng; Guo, Jixi; Wu, Dongling; Xie, Xiaolin","Photo-switch and INHIBIT logic gate based on two pyrazolone thiosemicarbazone derivatives","New Journal of Chemistry","2009","33","11","2232","","10.1039/b908326j","","","0.71073","MoKα","","0.0385","0.0334","","","0.0909","0.0946","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051731","13.4486","0.0008","13.3331","0.0009","21.691","0.0012","90","","90","","90","","3889.4","0.4","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C19.5 H20 F N5 O1.5 S -","- C19.5 H18.5 F N5 O1.5 S -","- C156 H148 F8 N40 O12 S8 -","8","1","","Xie, Xiangyun; Liu, Lang; Jia, Dianzeng; Guo, Jixi; Wu, Dongling; Xie, Xiaolin","Photo-switch and INHIBIT logic gate based on two pyrazolone thiosemicarbazone derivatives","New Journal of Chemistry","2009","33","11","2232","","10.1039/b908326j","","","0.71073","MoKα","","0.0973","0.0603","","","0.1543","0.1748","","","","","","0.999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051732","23.9121","0.0019","17.6841","0.0014","16.8216","0.0013","90","","99.475","0.002","90","","7016.2","1","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C104 H118 Cl4 N52 O25 -","- C104 H116 Cl4 N52 O25 -","- C208 H232 Cl8 N104 O50 -","2","0.5","","Yan, Ying; Xue, Sai-Feng; Cong, Hang; Zhang, Jian-Xing; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu","Exclusion complexes of the HCl salts of benzidine and bis(4-aminophenyl) methane with two methyl-substituted cucurbiturils","New Journal of Chemistry","2009","33","10","2136","","10.1039/b908490h","","","0.71073","MoKα","","0.1602","0.117","","","0.3501","0.3773","","","","","","1.226","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051733","16.897","0.009","18.037","0.009","18.475","0.01","68.835","0.008","69.689","0.007","73.9","0.008","4849","4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H64 Cl2 N26 O12 -","- C55 H64 Cl2 N26 O12 -","- C110 H128 Cl4 N52 O24 -","2","1","","Yan, Ying; Xue, Sai-Feng; Cong, Hang; Zhang, Jian-Xing; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu","Exclusion complexes of the HCl salts of benzidine and bis(4-aminophenyl) methane with two methyl-substituted cucurbiturils","New Journal of Chemistry","2009","33","10","2136","","10.1039/b908490h","","","0.71073","MoKα","","0.1706","0.0966","","","0.2334","0.2653","","","","","","0.816","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051734","7.6624","0.0006","24.225","0.002","11.3419","0.001","90","","102.611","0.001","90","","2054.5","0.3","293","2","187","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 N2 O -","- C28 H22 N2 O -","- C112 H88 N8 O4 -","4","1","","He, Yabing; Bian, Zheng; Kang, Chuanqing; Jin, Rizhe; Gao, Lianxun","Ultrasound-promoted chiral fluorescent organogel","New Journal of Chemistry","2009","33","10","2073","","10.1039/b909127k","","","0.71073","MoKα","","0.0749","0.0487","","","0.0995","0.1111","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051735","13.029","0.0018","19.014","0.003","34.024","0.005","90","","90","","90","","8429","2","185","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C56 H42 N4 O2 -","- C56 H42 N4 O2 -","- C448 H336 N32 O16 -","8","2","","He, Yabing; Bian, Zheng; Kang, Chuanqing; Jin, Rizhe; Gao, Lianxun","Ultrasound-promoted chiral fluorescent organogel","New Journal of Chemistry","2009","33","10","2073","","10.1039/b909127k","","","0.71073","MoKα","","0.1441","0.0866","","","0.2166","0.2625","","","","","","1.024","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7051736","7.884","0.0005","24.18","0.0015","26.806","0.0016","114.619","0.009","92.681","0.009","96.014","0.01","4596.9","0.6","185","2","293","2","","","","","","","","4","P 1","P 1","1","","","","- C76 H82 N4 O2 -","- C76 H82 N4 O2 -","- C228 H246 N12 O6 -","3","3","","He, Yabing; Bian, Zheng; Kang, Chuanqing; Jin, Rizhe; Gao, Lianxun","Ultrasound-promoted chiral fluorescent organogel","New Journal of Chemistry","2009","33","10","2073","","10.1039/b909127k","","","0.71073","MoKα","","0.0914","0.0577","","","0.129","0.1474","","","","","","0.955","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051737","21.449","0.003","13.6325","0.0016","15.8019","0.0018","90","","108.779","0.002","90","","4374.6","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H60 Cd2 Cu4 N4 O18 -","- C28 H60 Cd2 Cu4 N4 O18 -","- C112 H240 Cd8 Cu16 N16 O72 -","4","0.5","","Shahid, Muhammad; Mazhar, Muhammad; Hamid, Mazhar; Zeller, Matthias; O'Brien, Paul; Malik, Mohammad A.; Raftery, James; Hunter, Allen D.","Isostructural cage complexes of copper with cadmium or zinc for single source deposition of composite materials","New Journal of Chemistry","2009","33","11","2241","","10.1039/b9nj00217k","","","0.71073","MoKα","","0.1028","0.0627","","","0.1381","0.1803","","","","","","1.214","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051738","12.2838","0.0012","13.3453","0.0013","13.6289","0.0013","83.401","0.002","84.511","0.002","79.691","0.002","2177.1","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H64 Cu4 N4 O20 Zn2 -","- C28 H64 Cu4 N4 O20 Zn2 -","- C56 H128 Cu8 N8 O40 Zn4 -","2","1","","Shahid, Muhammad; Mazhar, Muhammad; Hamid, Mazhar; Zeller, Matthias; O'Brien, Paul; Malik, Mohammad A.; Raftery, James; Hunter, Allen D.","Isostructural cage complexes of copper with cadmium or zinc for single source deposition of composite materials","New Journal of Chemistry","2009","33","11","2241","","10.1039/b9nj00217k","","","0.71073","MoKα","","0.0706","0.0391","","","0.0724","0.0797","","","","","","0.803","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051739","21.4029","0.0004","11.2947","0.0003","18.8883","0.0005","90","","90","","90","","4566.05","0.19","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C42 H40 N9 Nd O14 Zn2 -","- C42 H38 N9 Nd O14 Zn2 -","- C168 H152 N36 Nd4 O56 Zn8 -","4","1","","Bi, Weiyu; Wei, Tao; Lü, Xingqiang; Hui, Yani; Song, Jirong; Zhao, Shunsheng; Wong, Wai-Kwok; Jones, Richard A.","Hetero-trinuclear near-infrared (NIR) luminescent Zn2Ln complexes from Salen-type Schiff-base ligands","New Journal of Chemistry","2009","33","11","2326","","10.1039/b9nj00228f","","","1.54184","CuKα","","0.0505","0.0451","","","0.1296","0.1332","","","","","","1.051","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051740","14.654","0.004","19.038","0.005","19.859","0.007","90","","97.99","0.008","90","","5487","3","273","2","273","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C54 H48 N9 Nd O14 Zn2 -","- C54 H48 N9 Nd O14 Zn2 -","- C216 H192 N36 Nd4 O56 Zn8 -","4","1","","Bi, Weiyu; Wei, Tao; Lü, Xingqiang; Hui, Yani; Song, Jirong; Zhao, Shunsheng; Wong, Wai-Kwok; Jones, Richard A.","Hetero-trinuclear near-infrared (NIR) luminescent Zn2Ln complexes from Salen-type Schiff-base ligands","New Journal of Chemistry","2009","33","11","2326","","10.1039/b9nj00228f","","","0.71073","MoKα","","0.062","0.0383","","","0.0807","0.0876","","","","","","0.874","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051741","12.116","0.002","12.633","0.003","14.075","0.003","75.424","0.007","88.977","0.006","73.821","0.007","1999.3","0.7","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C49.5 H39 O5 S3 -","- C49.5 H39 O5 S3 -","- C99 H78 O10 S6 -","2","1","","Krayushkin, Mikhail M.; Levchenko, Konstantin S.; Yarovenko, Vladimir N.; Christoforova, Ludmila V.; Barachevsky, Valery A.; Puankov, Yury A.; Valova, Tatyana M.; Kobeleva, Olga I.; Lyssenko, K.","Synthesis and reactivity of 1-aryl-9H-thieno[3,4-b]chromon-9-ones","New Journal of Chemistry","2009","33","11","2267","","10.1039/b9nj00237e","","","0.71073","MoKα","","0.0778","0.0511","","","0.1335","0.1531","","","","","","0.926","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051742","8.4574","0.0002","9.0194","0.0002","12.9095","0.0003","90","","90.2461","0.0014","90","","984.74","0.04","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H6 I N O4 S -","- C7 H6 I N O4 S -","- C28 H24 I4 N4 O16 S4 -","4","1","","Dolenc, Darko; Modec, Barbara","EDA Complexes of N-halosaccharins with N- and O-donor ligands","New Journal of Chemistry","2009","33","11","2344","","10.1039/b9nj00263d","","","0.71073","MoKα","","0.0222","0.0187","","","0.0451","0.0466","","","","","","1.086","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051743","8.2428","0.0001","9.1428","0.0001","17.6493","0.0003","90","","90","","90","","1330.09","0.03","150","2","150","2","","","","","","","","6","P m n b","-P 2bc 2a","62","","","","- C11 H12 I N O4 S -","- C11 H12 I N O4 S -","- C44 H48 I4 N4 O16 S4 -","4","0.5","","Dolenc, Darko; Modec, Barbara","EDA Complexes of N-halosaccharins with N- and O-donor ligands","New Journal of Chemistry","2009","33","11","2344","","10.1039/b9nj00263d","","","0.71073","MoKα","","0.0226","0.0212","","","0.0521","0.0528","","","","","","1.129","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051744","12.6184","0.0003","7.8019","0.0002","14.8718","0.0004","90","","113.653","0.0012","90","","1341.1","0.06","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C12 H9 I N2 O3 S -","- C12 H9 I N2 O3 S -","- C48 H36 I4 N8 O12 S4 -","4","1","","Dolenc, Darko; Modec, Barbara","EDA Complexes of N-halosaccharins with N- and O-donor ligands","New Journal of Chemistry","2009","33","11","2344","","10.1039/b9nj00263d","","","0.71073","MoKα","","0.0907","0.0879","","","0.2685","0.2702","","","","","","1.12","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051745","9.1283","0.0003","8.1398","0.0002","14.4767","0.0004","90","","90.81","0.002","90","","1075.55","0.05","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 I2 N4 O6 S2 -","- C18 H12 I2 N4 O6 S2 -","- C36 H24 I4 N8 O12 S4 -","2","0.5","","Dolenc, Darko; Modec, Barbara","EDA Complexes of N-halosaccharins with N- and O-donor ligands","New Journal of Chemistry","2009","33","11","2344","","10.1039/b9nj00263d","","","0.71073","MoKα","","0.0205","0.0182","","","0.0434","0.0443","","","","","","1.125","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051746","7.7847","0.0001","9.8956","0.0002","14.0214","0.0002","90","","96.2877","0.001","90","","1073.63","0.03","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 Br2 N4 O6 S2 -","- C18 H12 Br2 N4 O6 S2 -","- C36 H24 Br4 N8 O12 S4 -","2","0.5","","Dolenc, Darko; Modec, Barbara","EDA Complexes of N-halosaccharins with N- and O-donor ligands","New Journal of Chemistry","2009","33","11","2344","","10.1039/b9nj00263d","","","0.71073","MoKα","","0.0229","0.0212","","","0.0547","0.0557","","","","","","1.089","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051747","7.7944","0.0002","28.4335","0.0007","8.6973","0.0002","90","","116.155","0.0012","90","","1730.15","0.08","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C7 H4 Br N O3 S -","- C7 H4 Br N O3 S -","- C56 H32 Br8 N8 O24 S8 -","8","2","","Dolenc, Darko; Modec, Barbara","EDA Complexes of N-halosaccharins with N- and O-donor ligands","New Journal of Chemistry","2009","33","11","2344","","10.1039/b9nj00263d","","","0.71073","MoKα","","0.0476","0.0315","","","0.0736","0.0795","","","","","","1.036","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051748","8.342","0.001","9.678","0.002","13.675","0.002","90","","90","","90","","1104","0.3","298","","298","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C12 H9 N O3 S -","- C12 H9 N O3 S -","- C48 H36 N4 O12 S4 -","4","1","","Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia","Privileged structures: synthesis and structural investigations on tricyclic sulfonamides","New Journal of Chemistry","2009","33","11","2219","","10.1039/b9nj00279k","","","0.71073","MoKα","","0.0712","0.0354","","","0.0629","0.0698","","","","","","0.82","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051749","7.3326","0.0015","8.131","0.003","10.314","0.002","97.41","0.02","90.145","0.017","91.61","0.02","609.5","0.3","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H9 Br N2 O2 S -","- C12 H9 Br N2 O2 S -","- C24 H18 Br2 N4 O4 S2 -","2","1","","Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia","Privileged structures: synthesis and structural investigations on tricyclic sulfonamides","New Journal of Chemistry","2009","33","11","2219","","10.1039/b9nj00279k","","","0.71073","MoKα","","0.069","0.0441","","","0.1141","0.1309","","","","","","0.978","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051750","7.1412","0.0005","22.2553","0.0018","7.9556","0.0005","90","","109.175","0.008","90","","1194.23","0.16","298","","298","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C12 H9 N O2 S2 -","- C12 H9 N O2 S2 -","- C48 H36 N4 O8 S8 -","4","1","","Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia","Privileged structures: synthesis and structural investigations on tricyclic sulfonamides","New Journal of Chemistry","2009","33","11","2219","","10.1039/b9nj00279k","","","0.71073","MoKα","","0.0972","0.0428","","","0.0795","0.1","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051751","8.05","0.003","8.123","0.003","11.287","0.006","101.816","0.009","97.338","0.009","119.11","0.02","608.5","0.5","298","","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H9 N O4 S2 -","- C12 H9 N O4 S2 -","- C24 H18 N2 O8 S4 -","2","1","","Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia","Privileged structures: synthesis and structural investigations on tricyclic sulfonamides","New Journal of Chemistry","2009","33","11","2219","","10.1039/b9nj00279k","","","0.71073","MoKα","","0.1564","0.0567","","","0.1042","0.1189","","","","","","0.792","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051752","8.4934","0.0004","40.567","0.002","8.9646","0.0007","90","","112.706","0.006","90","","2849.4","0.3","298","","298","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C26 H22 Cl2 N2 O7 S3 -","- C26 H22 Cl2 N2 O7 S3 -","- C104 H88 Cl8 N8 O28 S12 -","4","1","","Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia","Privileged structures: synthesis and structural investigations on tricyclic sulfonamides","New Journal of Chemistry","2009","33","11","2219","","10.1039/b9nj00279k","","","1.54018","CuKα","","0.082","0.0598","","","0.1633","0.1715","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051753","9.261","0.002","10.064","0.004","15.947","0.005","99.54","0.03","90.98","0.02","112.46","0.03","1349.3","0.8","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H24 N2 O5 S5 -","- C26 H22 N2 O5 S5 -","- C52 H44 N4 O10 S10 -","2","1","","Altamura, Maria; Fedi, Valentina; Giannotti, Danilo; Paoli, Paola; Rossi, Patrizia","Privileged structures: synthesis and structural investigations on tricyclic sulfonamides","New Journal of Chemistry","2009","33","11","2219","","10.1039/b9nj00279k","","","0.71073","MoKα","","0.104","0.0883","","","0.2886","0.2933","","","","","","1.252","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051754","16.94","0.004","17.775","0.005","19.317","0.005","74.707","0.007","80.588","0.007","75.863","0.007","5410","2","92","2","92","2","","","","","","","","5","P -1","-P 1","2","","","","- C104.5 H108 Fe6 N10 O32.5 -","- C104.5 H108 Fe6 N10 O32.5 -","- C209 H216 Fe12 N20 O65 -","2","1","","Feltham, Humphrey L. C.; Larsen, David S.; Brooker, Sally","A hexanuclear iron(iii) complex of a hexadentate fully conjugated diimine ligand derived from 1,4-diformyl-2,3-dihydroxybenzene","New Journal of Chemistry","2009","33","10","2001","","10.1039/b9nj00347a","","","0.71073","MoKα","","0.234","0.157","","","0.3179","0.3556","","","","","","1.165","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051755","13.7147","0.0017","29.563","0.004","16.5","0.002","90","","90","","90","","6689.9","1.5","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C62 H83.16 F12 N2 O16.58 P2 -","- C62 H82 F12 N2 O16.576 P2 -","- C248 H328 F48 N8 O66.304 P8 -","4","0.5","","Nikitin, Kirill; Müller-Bunz, Helge","Encapsulation of 4,4′-bipyridinium cations by two crown ether molecules: formation and structure of [3]pseudorotaxanes","New Journal of Chemistry","2009","33","12","2472","","10.1039/b9nj00414a","","","0.71073","MoKα","","0.0733","0.0677","","","0.1947","0.2004","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051756","14.1988","0.001","32.459","0.002","16.0338","0.0011","90","","97.301","0.001","90","","7329.7","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70.5 H95.25 F12 N2.25 O18.25 P2 -","- C67 H88 F12 N2 O17 P2 -","- C268 H352 F48 N8 O68 P8 -","4","0.5","","Nikitin, Kirill; Müller-Bunz, Helge","Encapsulation of 4,4′-bipyridinium cations by two crown ether molecules: formation and structure of [3]pseudorotaxanes","New Journal of Chemistry","2009","33","12","2472","","10.1039/b9nj00414a","","","0.71073","MoKα","","0.0665","0.0611","","","0.1349","0.1373","","","","","","1.149","","","","has coordinates","210357","2020-10-21","18:00:00",""
"7051757","16.3602","0.0017","13.2368","0.0014","29.792","0.003","90","","90.006","0.002","90","","6451.7","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H79.2 F12 N2 O16.6 P2 -","- C60 H78 F12.004 N2 O16.598 P2 -","- C240 H312 F48.016 N8 O66.392 P8 -","4","1","","Nikitin, Kirill; Müller-Bunz, Helge","Encapsulation of 4,4′-bipyridinium cations by two crown ether molecules: formation and structure of [3]pseudorotaxanes","New Journal of Chemistry","2009","33","12","2472","","10.1039/b9nj00414a","","","0.71073","MoKα","","0.0728","0.0688","","","0.1794","0.1844","","","","","","1.058","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051758","16.5359","0.001","14.4572","0.0009","31.097","0.002","90","","93.492","0.001","90","","7420.3","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C68 H98 F12 N2 O18 P2 -","- C68 H94 F12 N2 O18 P2 -","- C272 H376 F48 N8 O72 P8 -","4","1","","Nikitin, Kirill; Müller-Bunz, Helge","Encapsulation of 4,4′-bipyridinium cations by two crown ether molecules: formation and structure of [3]pseudorotaxanes","New Journal of Chemistry","2009","33","12","2472","","10.1039/b9nj00414a","","","0.71073","MoKα","","0.0663","0.0534","","","0.1213","0.1287","","","","","","1.05","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051759","21.256","0.005","23.536","0.006","31.09","0.008","83.291","0.004","71.885","0.004","78.756","0.004","14473","6","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C476 H492 O149 P14 S24 Yb2.33 -","- C476 H386 O149 P14 S24 Yb2.34 -","- C476 H386 O149 P14 S24 Yb2.34 -","1","0.5","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Nanoporous materials based on heteroleptic bilayers built up from bisphosphonium, p-sulfonatocalix[4]arene ions","New Journal of Chemistry","2008","32","1","83","","10.1039/b706640f","","","0.71073","MoKα","","0.4015","0.2119","","","0.4676","0.5533","","","","","","1.118","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051760","15.57","0.002","21.425","0.003","22.794","0.004","75.66","0.02","84.2","0.01","77.09","0.01","7172","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C100 H154 Er2 O70 P2 S8 -","- C100 H70 Er2 O70.01 P2 S8 -","- C200 H140 Er4 O140.02 P4 S16 -","2","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Nanoporous materials based on heteroleptic bilayers built up from bisphosphonium, p-sulfonatocalix[4]arene ions","New Journal of Chemistry","2008","32","1","83","","10.1039/b706640f","","","0.71073","MoKα","","0.2145","0.1508","","","0.3791","0.4061","","","","","","1.034","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051761","14.8462","0.0006","21.114","0.001","33.652","0.001","90","","93.277","0.003","90","","10531.4","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C116 H114 Na O25.5 P4 S4 -","- C116 H114 Na O25.5 P4 S4 -","- C464 H456 Na4 O102 P16 S16 -","4","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Nanoporous materials based on heteroleptic bilayers built up from bisphosphonium, p-sulfonatocalix[4]arene ions","New Journal of Chemistry","2008","32","1","83","","10.1039/b706640f","","","0.71073","MoKα","","0.1957","0.1013","","","0.1893","0.2179","","","","","","1.122","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051762","8.3942","0.0012","15.149","0.002","25.099","0.004","90","","90","","90","","3191.7","0.8","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H16 N4 O Pd S -","- C15 H16 N4 O Pd S -","- C120 H128 N32 O8 Pd8 S8 -","8","1","","Halder, Sarmistha; Peng, Shie-Ming; Lee, Gene-Hsiang; Chatterjee, Tanmay; Mukherjee, Asama; Dutta, Sushanta; Sanyal, Utpal; Bhattacharya, Samaresh","Synthesis, structure, spectroscopic properties and cytotoxic effect of some thiosemicarbazone complexes of palladium","New Journal of Chemistry","2008","32","1","105","","10.1039/b707448d","","","0.71073","MoKα","","0.0247","0.0219","","","0.0573","0.0595","","","","","","1.076","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051763","7.5385","0.0004","10.2179","0.0005","16.9756","0.0009","77.025","0.001","80.819","0.001","71.567","0.001","1203.27","0.11","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H22 N3 O P Pd S -","- C26 H22 N3 O P Pd S -","- C52 H44 N6 O2 P2 Pd2 S2 -","2","1","","Halder, Sarmistha; Peng, Shie-Ming; Lee, Gene-Hsiang; Chatterjee, Tanmay; Mukherjee, Asama; Dutta, Sushanta; Sanyal, Utpal; Bhattacharya, Samaresh","Synthesis, structure, spectroscopic properties and cytotoxic effect of some thiosemicarbazone complexes of palladium","New Journal of Chemistry","2008","32","1","105","","10.1039/b707448d","","","0.71073","MoKα","","0.029","0.026","","","0.0702","0.079","","","","","","1.159","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051764","9.7001","0.0003","17.1346","0.0005","24.9317","0.0008","86.658","0.001","79.721","0.002","73.943","0.001","3918.1","0.2","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C173 H118 B2 Cl8 Cu6 F8 N24 O11 -","- C173 H104 B2 Cl8 Cu6 F8 N24 O11 -","- C173 H104 B2 Cl8 Cu6 F8 N24 O11 -","1","0.5","","Deiters, Emmanuel; Bulach, Véronique; Wais Hosseini, Mir","Molecular tectonics: ribbon type coordination networks based on porphyrins bearing two pyridine or two pyridine N-oxide units","New Journal of Chemistry","2008","32","1","99","","10.1039/b708352a","","","0.71073","MoKα","","0.1083","0.0741","","","0.2195","0.2464","","","","","","1.071","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051765","8.7394","0.0004","27.7882","0.0016","31.3773","0.0016","90","","90","","90","","7620","0.7","173","2","173","2","","","","","","","","7","P b c m","-P 2c 2b","57","","","","- C85.5 H55 Cd Cl3 Cu2 N14 O6.5 -","- C85.5 H52 Cd Cl3 Cu2 N14 O6.5 -","- C342 H208 Cd4 Cl12 Cu8 N56 O26 -","4","0.5","","Deiters, Emmanuel; Bulach, Véronique; Wais Hosseini, Mir","Molecular tectonics: ribbon type coordination networks based on porphyrins bearing two pyridine or two pyridine N-oxide units","New Journal of Chemistry","2008","32","1","99","","10.1039/b708352a","","","0.71073","MoKα","","0.2138","0.1123","","","0.2858","0.3157","","","","","","1.566","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051766","9.4956","0.0004","14.4774","0.0006","16.5058","0.0006","82.058","0.002","79.919","0.002","74.55","0.002","2143.27","0.15","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H60 Br2 Cd Cl12 N12 -","- C88 H60 Br2 Cd Cl12 N12 -","- C88 H60 Br2 Cd Cl12 N12 -","1","0.5","","Deiters, Emmanuel; Bulach, Véronique; Wais Hosseini, Mir","Molecular tectonics: ribbon type coordination networks based on porphyrins bearing two pyridine or two pyridine N-oxide units","New Journal of Chemistry","2008","32","1","99","","10.1039/b708352a","","","0.71073","MoKα","","0.0614","0.05","","","0.1565","0.1648","","","","","","1.234","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051767","8.1872","0.0003","14.4491","0.0005","16.8506","0.0005","80.749","0.001","78.467","0.001","75.415","0.001","1877.34","0.11","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C84 H58 Br4 Cu4 N12 O7 -","- C84 H52 Br4 Cu4 N12 O7 -","- C84 H52 Br4 Cu4 N12 O7 -","1","0.5","","Deiters, Emmanuel; Bulach, Véronique; Wais Hosseini, Mir","Molecular tectonics: ribbon type coordination networks based on porphyrins bearing two pyridine or two pyridine N-oxide units","New Journal of Chemistry","2008","32","1","99","","10.1039/b708352a","","","0.71073","MoKα","","0.1111","0.0795","","","0.2533","0.2797","","","","","","1.024","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051768","25.6147","0.0016","10.1935","0.0006","36.361","0.002","90","","105.085","0.004","90","","9166.8","1","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C34 H44 F12 N12 O2 P2 Ru -","- C34 H44 F12 N12 O2 P2 Ru -","- C272 H352 F96 N96 O16 P16 Ru8 -","8","1","","Wei, Qiao-Hua; Argent, Stephen P.; Adams, Harry; Ward, Michael D.","Post-coordination functionalisation of pyrazolyl-based ligands as a route to polynuclear complexes based on an inert RuIIN6 core","New Journal of Chemistry","2008","32","1","73","","10.1039/b708572a","","","0.71073","MoKα","","0.091","0.0553","","","0.129","0.1475","","","","","","1.012","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051769","16.7252","0.0005","16.7252","0.0005","16.1385","0.001","90","","90","","90","","4514.5","0.3","150","2","150","2","","","","","","","","5","I -4","I -4","82","","","","- C86 H78 N24 O10 Ru -","- C86 H70 N22 O4 Ru -","- C172 H140 N44 O8 Ru2 -","2","0.25","","Wei, Qiao-Hua; Argent, Stephen P.; Adams, Harry; Ward, Michael D.","Post-coordination functionalisation of pyrazolyl-based ligands as a route to polynuclear complexes based on an inert RuIIN6 core","New Journal of Chemistry","2008","32","1","73","","10.1039/b708572a","","","0.71073","MoKα","","0.0616","0.0582","","","0.1496","0.1532","","","","","","1.072","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051770","27.3364","0.0011","15.9057","0.0006","24.5589","0.0009","90","","90","","90","","10678.3","0.7","100","2","100","2","","","","","","","","6","P n n a","-P 2a 2bc","52","","","","- C116 H84 F12 N22 P2 Ru -","- C116 H84 F12 N22 P2 Ru -","- C464 H336 F48 N88 P8 Ru4 -","4","0.5","","Wei, Qiao-Hua; Argent, Stephen P.; Adams, Harry; Ward, Michael D.","Post-coordination functionalisation of pyrazolyl-based ligands as a route to polynuclear complexes based on an inert RuIIN6 core","New Journal of Chemistry","2008","32","1","73","","10.1039/b708572a","","","0.71073","MoKα","","0.0742","0.0599","","","0.1722","0.1837","","","","","","1.052","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051771","30.736","0.004","14.284","0.002","21.992","0.003","90","","98.756","0.009","90","","9543","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C92 H84 Ag2 Cl4 N24 O19 Ru -","- C92 H84 Ag2 Cl4 N24 O19 Ru -","- C368 H336 Ag8 Cl16 N96 O76 Ru4 -","4","0.5","","Wei, Qiao-Hua; Argent, Stephen P.; Adams, Harry; Ward, Michael D.","Post-coordination functionalisation of pyrazolyl-based ligands as a route to polynuclear complexes based on an inert RuIIN6 core","New Journal of Chemistry","2008","32","1","73","","10.1039/b708572a","","","0.71073","MoKα","","0.1044","0.0675","","","0.1748","0.1943","","","","","","1.068","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051772","16.1145","0.0008","43.921","0.002","24.9915","0.0012","90","","96.158","0.003","90","","17586","1.5","150","2","150","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C120 H107 B4 Cu4 F52 N26 O6.5 Ru Sb6 -","- C120 H93 B4 Cu4 F52 N26 O6.5 Ru Sb6 -","- C480 H372 B16 Cu16 F208 N104 O26 Ru4 Sb24 -","4","1","","Wei, Qiao-Hua; Argent, Stephen P.; Adams, Harry; Ward, Michael D.","Post-coordination functionalisation of pyrazolyl-based ligands as a route to polynuclear complexes based on an inert RuIIN6 core","New Journal of Chemistry","2008","32","1","73","","10.1039/b708572a","","","0.71073","MoKα","","0.2086","0.1281","","","0.354","0.3847","","","","","","1.249","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051773","7.6014","0.0008","12.5366","0.0013","13.234","0.0014","114.368","0.002","91.703","0.002","106.36","0.002","1086.8","0.2","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H27 F2 I N O -","- C24 H27 F2 I N O -","- C48 H54 F4 I2 N2 O2 -","2","1","","Bruce, Duncan W.; Metrangolo, Pierangelo; Meyer, Franck; Präsang, Carsten; Resnati, Giuseppe; Terraneo, Giancarlo; Whitwood, Adrian C.","Mesogenic, trimeric, halogen-bonded complexes from alkoxystilbazoles and 1,4-diiodotetrafluorobenzene","New Journal of Chemistry","2008","32","3","477","","10.1039/b709107a","","","0.71073","MoKα","","0.0276","0.0237","","","0.0557","0.057","","","","","","1.056","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051774","7.6549","0.0007","12.1014","0.0012","13.0598","0.0013","109.606","0.002","92.273","0.002","107.571","0.002","1073.01","0.18","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H27 Br F2 N O -","- C24 H27 Br F2 N O -","- C48 H54 Br2 F4 N2 O2 -","2","1","","Bruce, Duncan W.; Metrangolo, Pierangelo; Meyer, Franck; Präsang, Carsten; Resnati, Giuseppe; Terraneo, Giancarlo; Whitwood, Adrian C.","Mesogenic, trimeric, halogen-bonded complexes from alkoxystilbazoles and 1,4-diiodotetrafluorobenzene","New Journal of Chemistry","2008","32","3","477","","10.1039/b709107a","","","0.71073","MoKα","","0.0346","0.0305","","","0.0762","0.0778","","","","","","1.072","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051775","16.5047","0.0007","16.5047","0.0007","10.2363","0.0009","90","","90","","120","","2414.8","0.3","193","2","193","2","","","","","","","Pentane","3","R 3 :H","R 3","146","Tris(2,6-diisopropylphenyl)phosphine","Tris(2,6-diisopropylphenyl)phosphane","","- C36 H51 P -","- C36 H51 P -","- C108 H153 P3 -","3","0.333333","","Boeré, René T.; Bond, Alan M.; Cronin, Steve; Duffy, Noel W.; Hazendonk, Paul; Masuda, Jason D.; Pollard, Kyle; Roemmele, Tracey L.; Tran, Peter; Zhang, Yuankui","Photophysical, dynamic and redox behavior of tris(2,6-diisopropylphenyl)phosphine","New Journal of Chemistry","2008","32","2","214","","10.1039/b709602j","","x-ray","0.71073","MoKα","","0.0294","0.0294","","","0.0841","0.0841","","","","","","1.153","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051776","6.996","0.0004","10.257","0.0008","17.878","0.0015","73.592","0.003","84.539","0.005","80.636","0.004","1212.6","0.16","150","1","150","1","","","","","","","synthesized by the authors","8","P -1","-P 1","2","","","","- C19 H31 Br Cu F6 N5 O2 P -","- C19 H31 Br Cu F6 N5 O2 P -","- C38 H62 Br2 Cu2 F12 N10 O4 P2 -","2","1","","Plutnar, Jan; Havlíčková, Jana; Kotek, Jan; Hermann, Petr; Lukeš, Ivan","Unsymmetrically substituted side-bridged cyclam derivatives and their Cu(ii) and Zn(ii) complexes","New Journal of Chemistry","2008","32","3","496","","10.1039/b709747f","","","0.71073","MoKα","","0.2134","0.1759","","","0.4889","0.5043","","","","","","1.973","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051777","19.4788","0.0004","19.7272","0.0004","13.7214","0.0003","90","","97.716","0.0011","90","","5224.88","0.19","150","1","150","1","","","","","","","synthesized by the authors","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H39 Br N5 O6.5 -","- C21 H34 Br N5 O6.5 -","- C168 H272 Br8 N40 O52 -","8","1","","Plutnar, Jan; Havlíčková, Jana; Kotek, Jan; Hermann, Petr; Lukeš, Ivan","Unsymmetrically substituted side-bridged cyclam derivatives and their Cu(ii) and Zn(ii) complexes","New Journal of Chemistry","2008","32","3","496","","10.1039/b709747f","","","0.71073","MoKα","","0.0736","0.059","","","0.168","0.1828","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051778","8.8759","0.0008","12.7053","0.0012","16.6618","0.0015","90","","103.925","0.002","90","","1823.7","0.3","150","1","150","1","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C32 H18 N4 O14 -","- C32 H18 N4 O14 -","- C64 H36 N8 O28 -","2","0.5","","Sobransingh, David; Dewal, Mahender B.; Hiller, Jacob; Smith, Mark D.; Shimizu, Linda S.","Inclusion of electrochemically active guests by novel oxacalixarene hosts","New Journal of Chemistry","2008","32","1","24","","10.1039/b709806e","","","0.71073","MoKα","","0.0648","0.048","","","0.1206","0.1269","","","","","","1.032","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051779","12.1115","0.0004","14.0678","0.0004","17.4915","0.0005","79.918","0.001","86.453","0.001","74.77","0.001","2830.77","0.15","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C38 H24 N4 O12 -","- C38 H24 N4 O12 -","- C114 H72 N12 O36 -","3","1.5","","Sobransingh, David; Dewal, Mahender B.; Hiller, Jacob; Smith, Mark D.; Shimizu, Linda S.","Inclusion of electrochemically active guests by novel oxacalixarene hosts","New Journal of Chemistry","2008","32","1","24","","10.1039/b709806e","","","0.71073","MoKα","","0.053","0.0377","","","0.0782","0.0827","","","","","","0.911","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051780","12.7604","0.0012","9.7885","0.0009","13.9233","0.0013","90","","101.8","0.002","90","","1702.3","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","tris(4,5-dimethylthiazol-2-yl)phosphine","tris(4,5-dimethylthiazol-2-yl)phosphane","","- C15 H18 N3 P S3 -","- C15 H18 N3 P S3 -","- C60 H72 N12 P4 S12 -","4","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.032","0.0296","","","0.0766","0.0783","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051781","7.765","0.002","18.867","0.005","11.069","0.003","90","","90.54","0.004","90","","1621.6","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tris(1-methylimidazol-2-yl)phosphinegold(I) chloride","chloridotris(1-methylimidazol-2-yl)phosphanegold(I)","","- C12 H15 Au Cl N6 P -","- C12 H15 Au Cl N6 P -","- C48 H60 Au4 Cl4 N24 P4 -","4","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0412","0.0308","","","0.0657","0.0699","","","","","","1.042","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051782","10.3829","0.0001","16.2935","0.0001","17.2073","0.0002","90","","92.3216","0.0004","90","","2908.63","0.05","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","tris(thiazol-2-yl)phosphanegold(I) chloride","chlorido[tris(thiazol-2-yl)phosphane]gold(I)","","- C9 H6 Au Cl N3 P S3 -","- C9 H6 Au Cl N3 P S3 -","- C72 H48 Au8 Cl8 N24 P8 S24 -","8","2","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0272","0.0207","","","0.0422","0.0439","","","","","","1.033","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051783","8.0705","0.0004","8.6077","0.0004","10.5184","0.0005","72.425","0.001","84.882","0.001","75.129","0.001","673.2","0.06","100","2","100","2","","","","","","","","7","P -1","-P 1","2","tris(thiazol-2-yl)phosphanegold(I) chloride","chlorido[tris(thiazol-2-yl)phosphane]gold(I)","","- C9 H6 Au Cl N3 P S3 -","- C9 H6 Au Cl N3 P S3 -","- C18 H12 Au2 Cl2 N6 P2 S6 -","2","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0202","0.0192","","","0.0449","0.0453","","","","","","1.028","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051784","8.6111","0.0015","8.7006","0.0015","9.5117","0.0017","90.821","0.003","97.446","0.003","106.515","0.003","676.5","0.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","tris(thiazol-2-yl)phosphanegold(I) chloride","chlorido[tris(thiazol-2-yl)phosphane]gold(I)","","- C9 H6 Au Cl N3 P S3 -","- C9 H6 Au Cl N3 P S3 -","- C18 H12 Au2 Cl2 N6 P2 S6 -","2","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0195","0.0187","","","0.0439","0.0442","","","","","","1.054","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051785","7.9518","0.0009","20.261","0.002","19.413","0.002","90","","96.018","0.002","90","","3110.4","0.6","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","tris(thiazol-2-yl)phosphinegold(I) chloride dichloromethane hemisolvate","chlorido[tris(thiazol-2-yl)phosphane]gold(I) dichloromethane hemisolvate","","- C9.5 H7 Au Cl2 N3 P S3 -","- C9.5 H7 Au Cl2 N3 P S3 -","- C76 H56 Au8 Cl16 N24 P8 S24 -","8","2","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0739","0.0481","","","0.0833","0.0909","","","","","","0.991","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051786","23.574","0.002","10.766","0.0009","17.201","0.0015","90","","128.28","0.001","90","","3426.9","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","tris(4-methylthiazol-2-yl)phosphanegold(I) chloride","chlorido[tris(4-methylthiazol-2-yl)phosphane]gold(I)","","- C12 H12 Au Cl N3 P S3 -","- C12 H12 Au Cl N3 P S3 -","- C96 H96 Au8 Cl8 N24 P8 S24 -","8","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0225","0.0204","","","0.0473","0.0482","","","","","","1.058","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051787","19.8224","0.0019","10.333","0.001","17.5435","0.0017","90","","109.95","0.001","90","","3377.7","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","tris(4-methylthiazol-2-yl)phosphinegold(I) chloride","chloridotris(4-methylthiazol-2-yl)phosphanegold(I)","","- C12 H12 Au Cl N3 P S3 -","- C12 H12 Au Cl N3 P S3 -","- C96 H96 Au8 Cl8 N24 P8 S24 -","8","2","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0277","0.0263","","","0.062","0.0626","","","","","","1.17","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051788","9.0405","0.0009","9.6531","0.001","24.273","0.003","90","","90","","90","","2118.3","0.4","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","tris(4-methylthiazol-2-yl)phosphanegold(I) chloride tetrahydrofuran solvate","chlorido[tris(4-methylthiazol-2-yl)phosphane]gold(I) tetrahydrofuran solvate","","- C16 H20 Au Cl N3 O P S3 -","- C16 H20 Au Cl N3 O P S3 -","- C64 H80 Au4 Cl4 N12 O4 P4 S12 -","4","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0268","0.0245","","","0.0489","0.0495","","","","","","0.906","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051789","12.9541","0.0015","11.2941","0.0013","13.3664","0.0015","90","","90","","90","","1955.6","0.4","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","tris(4,5-dimethylthiazol-2-yl)phosphanegold(I) chloride","chlorido[tris(4,5-dimethylthiazol-2-yl)phosphane]gold(I)","","- C15 H18 Au Cl N3 P S3 -","- C15 H18 Au Cl N3 P S3 -","- C60 H72 Au4 Cl4 N12 P4 S12 -","4","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0255","0.0237","","","0.0581","0.0591","","","","","","1.046","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051790","10.6209","0.0008","17.6637","0.0014","27.839","0.002","90","","90","","90","","5222.7","0.7","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","tris(4-methylthiazol-2-yl)phosphanegold(I) thiobenzoate hemi hexane solvate","(thiobenzoato)[tris(4-methylthiazol-2-yl)phosphane]gold(I) hemi hexane solvate","","- C22 H24 Au N3 O P S4 -","- C19 H17 Au N3 O P S4 -","- C152 H136 Au8 N24 O8 P8 S32 -","8","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0531","0.047","","","0.1051","0.1075","","","","","","1.207","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051791","10.2802","0.0015","12.707","0.0018","13.1407","0.0019","81.504","0.002","81.244","0.003","72.231","0.002","1606.3","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Bis(pentafluorophenyl)-μ-[tris(1-methylimidazolyl)phosphine] digold(I) acetone solvate","Bis(pentafluorophenyl)-μ-[tris(1-methylimidazol-2-yl) phosphane-κP:κN]digold(I) acetone solvate","","- C26.31 H19.62 Au2 F10 N6 O0.77 P -","- C26.31 H19.62 Au2 F10 N6 O0.77 P -","- C52.62 H39.24 Au4 F20 N12 O1.54 P2 -","2","1","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.0635","0.0447","","","0.1043","0.113","","","","","","0.997","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051792","12.3247","0.0012","19.123","0.0019","20.242","0.002","101.251","0.002","98.052","0.002","100.106","0.002","4530.8","0.8","100","2","100","2","","","","","","","","8","P -1","-P 1","2","bis(pentafluorophenyl)-μ-[tris(1-methylimidazol-2-yl)phosphine]digold(I) 5/6 deuteriochloroform solvate","bis(pentafluorophenyl)-μ-[tris(1-methylimidazol-2-yl)phosphane-κ^2^P:N] digold(I) 5/6 deuteriotrichloromethane solvate","","- C24.83 H15 Au2 Cl2.5 D0.83 F10 N6 P -","- C24.8333 H15 Au2 Cl2.5 D0.833333 F10 N6 P -","- C149 H90 Au12 Cl15 D5 F60 N36 P6 -","6","3","","Strasser, Christoph E.; Gabrielli, William F.; Esterhuysen, Catharine; Schuster, Oliver B.; Nogai, Stefan D.; Cronje, Stephanie; Raubenheimer, Helgard G.","Preparation of tris(azolyl)phosphine gold(i) complexes: digold(i) coordination and variation in solid state intermolecular interactions","New Journal of Chemistry","2008","32","1","138","","10.1039/b709896k","","","0.71073","MoKα","","0.045","0.0288","","","0.0622","0.0761","","","","","","1.083","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051793","9.5651","0.0005","10.5104","0.0006","16.2642","0.0009","77.655","0.001","80.68","0.001","74.253","0.001","1527.92","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H49 N12 Nd2 O27 Zn2 -","- C50 H50 N12 Nd2 O27 Zn2 -","- C50 H50 N12 Nd2 O27 Zn2 -","1","0.5","","Lü, Xingqiang; Bi, Weiyu; Chai, Wenli; Song, Jirong; Meng, Jianxin; Wong, Wai-Yeung; Wong, Wai-Kwok; Jones, Richard A.","Tetranuclear NIR luminescent Schiff-base Zn‒Nd complexes","New Journal of Chemistry","2008","32","1","127","","10.1039/b710204f","","","0.71073","MoKα","","0.0281","0.0256","","","0.068","0.0696","","","","","","1.028","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051794","9.1671","0.0014","10.4152","0.0016","16.667","0.003","92.882","0.003","100.841","0.003","104.315","0.003","1506.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H50 N12 Nd2 O28 Zn2 -","- C48 H46 N12 Nd2 O28 Zn2 -","- C48 H46 N12 Nd2 O28 Zn2 -","1","0.5","","Lü, Xingqiang; Bi, Weiyu; Chai, Wenli; Song, Jirong; Meng, Jianxin; Wong, Wai-Yeung; Wong, Wai-Kwok; Jones, Richard A.","Tetranuclear NIR luminescent Schiff-base Zn‒Nd complexes","New Journal of Chemistry","2008","32","1","127","","10.1039/b710204f","","","0.71073","MoKα","","0.1145","0.0595","","","0.1322","0.16","","","","","","0.948","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051795","9.523","0.0006","12.0312","0.0007","14.1546","0.0008","73.512","0.001","86.303","0.001","67.543","0.001","1435.36","0.15","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H56 Ag4 Cl4 N4 O16 S6 -","- C44 H56 Ag4 Cl4 N4 O16 S6 -","- C44 H56 Ag4 Cl4 N4 O16 S6 -","1","0.5","","Kim, Hyun Jee; Yoon, Il; Lee, So Young; Choi, Kyu Seong; Lee, Shim Sung","Exo-coordinated discrete and continuous supramolecular silver(i) complexes with thiaoxa-macrocycles","New Journal of Chemistry","2008","32","2","258","","10.1039/b710581a","","","0.71073","MoKα","","0.0296","0.0239","","","0.0547","0.057","","","","","","1.029","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051796","15.8399","0.001","15.8399","0.001","22.847","0.003","90","","90","","90","","5732.4","0.9","173","2","173","2","","","","","","","","8","P 4/m n c","-P 4 2n","128","","","","- C88 H112 Ag4 Cl8 F24 O8 P4 S12 -","- C88 H112 Ag4 Cl8 F24 O8 P4 S12 -","- C176 H224 Ag8 Cl16 F48 O16 P8 S24 -","2","0.125","","Kim, Hyun Jee; Yoon, Il; Lee, So Young; Choi, Kyu Seong; Lee, Shim Sung","Exo-coordinated discrete and continuous supramolecular silver(i) complexes with thiaoxa-macrocycles","New Journal of Chemistry","2008","32","2","258","","10.1039/b710581a","","","0.71073","MoKα","","0.1902","0.0806","","","0.1821","0.2669","","","","","","1.064","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051797","8.8853","0.0011","11.1795","0.0014","12.822","0.0016","70.863","0.002","87.579","0.002","71.115","0.002","1135.6","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H26 Ag N O6 S2 -","- C21 H26 Ag N O6 S2 -","- C42 H52 Ag2 N2 O12 S4 -","2","1","","Kim, Hyun Jee; Yoon, Il; Lee, So Young; Choi, Kyu Seong; Lee, Shim Sung","Exo-coordinated discrete and continuous supramolecular silver(i) complexes with thiaoxa-macrocycles","New Journal of Chemistry","2008","32","2","258","","10.1039/b710581a","","","0.71073","MoKα","","0.0356","0.0287","","","0.0742","0.0786","","","","","","1.037","","","","has coordinates","180071","2020-10-21","18:00:00",""
"7051798","13.2221","0.0009","12.4315","0.0008","25.7337","0.0019","90","","90","","90","","4229.9","0.5","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C21 H26 O2 S3 -","- C21 H26 O2 S3 -","- C168 H208 O16 S24 -","8","2","","Kim, Hyun Jee; Yoon, Il; Lee, So Young; Choi, Kyu Seong; Lee, Shim Sung","Exo-coordinated discrete and continuous supramolecular silver(i) complexes with thiaoxa-macrocycles","New Journal of Chemistry","2008","32","2","258","","10.1039/b710581a","","","0.71073","MoKα","","0.1151","0.0467","","","0.1011","0.1235","","","","","","1.014","","","","has coordinates,has disorder","180071","2020-10-21","18:00:00",""
"7051799","11.8755","0.0007","11.3829","0.0006","15.7149","0.0009","90","","108.787","0.001","90","","2011.1","0.2","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C21 H26 O3 S2 -","- C21 H26 O3 S2 -","- C84 H104 O12 S8 -","4","1","","Kim, Hyun Jee; Yoon, Il; Lee, So Young; Choi, Kyu Seong; Lee, Shim Sung","Exo-coordinated discrete and continuous supramolecular silver(i) complexes with thiaoxa-macrocycles","New Journal of Chemistry","2008","32","2","258","","10.1039/b710581a","","","0.71073","MoKα","","0.044","0.0383","","","0.1235","0.1466","","","","","","1.111","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051800","14.251","0.006","4.8945","0.0019","28.846","0.011","90","","99.64","0.02","90","","1983.6","1.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H50 N6 O4 -","- C46 H50 N6 O4 -","- C92 H100 N12 O8 -","2","0.5","","Wenzel, Marco; Gloe, Kerstin; Gloe, Karsten; Bernhard, Gert; Clegg, Jack K.; Ji, Xue-Kui; Lindoy, Leonard F.","A new 34-membered N6O4-donor macrocycle: synthetic, X-ray and solvent extraction studies","New Journal of Chemistry","2008","32","1","132","","10.1039/b710641f","","","0.71073","MoKα","","0.223","0.0654","","","0.1188","0.1529","","","","","","0.856","","","","has coordinates","192777","2020-10-21","18:00:00",""
"7051801","17.358","0.002","14.1481","0.0014","24.213","0.002","90","","92.636","0.002","90","","5940","1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","OL2*ZnNO3","bis{4-methyl-2,6-diformylphenolbis-[3,4,5-tri(methoxy)phenylimine]zinc(II) nitrate complex bis-methanol solvate","","- C57 H72 N6 O23 Zn -","- C57 H60 N6 O23 Zn -","- C228 H240 N24 O92 Zn4 -","4","0.5","","Morale, Francesca; Finn, Rachel L.; Collinson, Simon R.; Blake, Alexander J.; Wilson, Claire; Bruce, Duncan W.; Guillon, Daniel; Donnio, Bertrand; Schröder, Martin","Metal-directed columnar phase formation in tetrahedral zinc(ii) and manganese(ii) metallomesogens","New Journal of Chemistry","2008","32","2","297","","10.1039/b710745e","","","0.71073","MoKα","","0.0787","0.0577","","","0.1523","0.1734","","","","","","1.02","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051802","23.568","0.004","12.894","0.002","21.345","0.004","90","","110.065","0.004","90","","6092.7","1.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H42 Cd2 Cl4 N10 O20 S4 -","- C46 H34 Cd2 Cl4 N10 O18 S4 -","- C184 H136 Cd8 Cl16 N40 O72 S16 -","4","1","","Bokolinis, Georgios; Riis-Johannessen, T.; Jeffery, John C.; Rice, Craig R.","Synthesis and X-ray structures of cadmium-containing dinuclear double helicates derived from ligands containing N-oxide units","New Journal of Chemistry","2008","32","1","115","","10.1039/b711039a","","","0.71073","MoKα","","0.0853","0.0548","","","0.1615","0.1737","","","","","","0.992","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051803","11.4892","0.0008","13.6419","0.0009","23.7577","0.0016","93.242","0.001","99.983","0.001","97.955","0.001","3619.6","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C65 H47 Cd2 Cl4 N17 O24 S4 -","- C65 H47 Cd2 Cl4 N17 O24 S4 -","- C130 H94 Cd4 Cl8 N34 O48 S8 -","2","1","","Bokolinis, Georgios; Riis-Johannessen, T.; Jeffery, John C.; Rice, Craig R.","Synthesis and X-ray structures of cadmium-containing dinuclear double helicates derived from ligands containing N-oxide units","New Journal of Chemistry","2008","32","1","115","","10.1039/b711039a","","","0.71073","MoKα","","0.0975","0.0439","","","0.0927","0.1101","","","","","","0.906","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051804","12.0015","0.0009","17.6425","0.0013","4.5555","0.0004","90","","90","","90","","964.57","0.13","90","2","90","2","","","","","","","","4","F d d 2","F 2 -2d","43","DNU","","","- C H2 N4 O5 -","- C H2 N4 O5 -","- C8 H16 N32 O40 -","8","0.5","","Ye, Chengfeng; Gao, Haixiang; Twamley, Brendan; Shreeve, Jean’ne M.","Dense energetic salts of N,N′-dinitrourea (DNU)","New Journal of Chemistry","2008","32","2","317","","10.1039/b712417a","","","0.71073","MoKα","","0.024","0.0236","","","0.0617","0.062","","","","","","1.097","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051805","7.6156","0.0003","4.9837","0.0002","10.3119","0.0004","90","","95.53","0.001","90","","389.55","0.03","90","2","90","2","","","","","","","","4","P 1 21 1","P 2yb","4","C H N4 O5, C2 H4 N3","","","- C3 H5 N7 O5 -","- C3 H5 N7 O5 -","- C6 H10 N14 O10 -","2","1","","Ye, Chengfeng; Gao, Haixiang; Twamley, Brendan; Shreeve, Jean’ne M.","Dense energetic salts of N,N′-dinitrourea (DNU)","New Journal of Chemistry","2008","32","2","317","","10.1039/b712417a","","","0.71073","MoKα","","0.0266","0.0255","","","0.0655","0.0662","","","","","","1.091","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051806","10.372","0.01","14.25","0.013","21.168","0.015","106.19","0.08","91.03","0.11","92.06","0.09","3001","5","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H32 B F2 N5 -","- C36 H32 B F2 N5 -","- C144 H128 B4 F8 N20 -","4","2","","Killoran, John; McDonnell, Shane O.; Gallagher, John F.; O’Shea, Donal F.","A substituted BF2-chelated tetraarylazadipyrromethene as an intrinsic dual chemosensor in the 650‒850 nm spectral range","New Journal of Chemistry","2008","32","3","483","","10.1039/b713020a","","","0.71073","MolybdenumKα","","0.4138","0.1541","","","0.3428","0.492","","","","","","1.015","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051807","10.2169","0.0007","14.0769","0.0008","21.0039","0.0015","105.548","0.002","91.046","0.002","92.138","0.005","2907","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H32 B F2 N5 -","- C36 H32 B F2 N5 -","- C144 H128 B4 F8 N20 -","4","2","","Killoran, John; McDonnell, Shane O.; Gallagher, John F.; O’Shea, Donal F.","A substituted BF2-chelated tetraarylazadipyrromethene as an intrinsic dual chemosensor in the 650‒850 nm spectral range","New Journal of Chemistry","2008","32","3","483","","10.1039/b713020a","","","0.71073","MolybdenumKα","","0.2827","0.0862","","","0.1415","0.2015","","","","","","0.924","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7051808","11.4268","0.0006","51.0126","0.0019","8.3365","0.0005","90","","91.829","0.007","90","","4857","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(BEDT-TTF)2[Cr(ox)2(2,2'-bipy)],CHCl2CH2Cl","","","- C36 H27 Cl3 Cr N2 O8 S16 -","- C36 H27 Cl3 Cr N2 O8 S16 -","- C144 H108 Cl12 Cr4 N8 O32 S64 -","4","1","","Madalan, Augustin M.; Canadell, Enric; Auban-Senzier, Pascale; Brânzea, Diana; Avarvari, Narcis; Andruh, Marius","Conducting mixed-valence salt of bis(ethylenedithio)tetrathiafulvalene (BEDT-TTF) with the paramagnetic heteroleptic anion [CrIII(oxalate)2(2,2′-bipyridine)]−","New Journal of Chemistry","2008","32","2","333","","10.1039/b713030a","","","0.71073","MoKα","","0.1013","0.0656","","","0.1553","0.1757","","","","","","0.998","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051809","5.3281","0.0002","8.3677","0.0003","28.9434","0.0013","90","","90","","90","","1290.41","0.09","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","3-[1-(4-chlorophenyl)ethyl]pentane-2,4-dione","","- C13 H15 Cl O2 -","- C13 H15 Cl O2 -","- C52 H60 Cl4 O8 -","4","1","","Bertolasi, Valerio; Ferretti, Valeria; Gilli, Paola; Yao, Xiaoquan; Li, Chao-Jun","Substituent effects on keto‒enol tautomerization of β-diketones from X-ray structural data and DFT calculations","New Journal of Chemistry","2008","32","4","694","","10.1039/b714708b","","","0.71073","MoKα","","0.0995","0.0516","","","0.1183","0.1411","","","","","","1.025","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051810","15.3369","0.0007","5.5988","0.0002","19.0061","0.0011","90","","109.104","0.002","90","","1542.14","0.13","295","","295","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2-[1-(4-chlorophenyl)ethyl]-1-phenylbutane-1,3-dione","","- C18 H17 Cl O2 -","- C18 H17 Cl O2 -","- C72 H68 Cl4 O8 -","4","1","","Bertolasi, Valerio; Ferretti, Valeria; Gilli, Paola; Yao, Xiaoquan; Li, Chao-Jun","Substituent effects on keto‒enol tautomerization of β-diketones from X-ray structural data and DFT calculations","New Journal of Chemistry","2008","32","4","694","","10.1039/b714708b","","","0.71073","MoKα","","0.1078","0.0493","","","0.1082","0.1328","","","","","","1.012","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051811","7.1662","0.0002","11.4546","0.0003","38.421","0.0012","90","","90","","90","","3153.82","0.16","295","","295","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-[1-(2-chlorophenyl)ethyl]-1-phenylbutane-1.3-dione","","- C18 H17 Cl O2 -","- C18 H17 Cl O2 -","- C144 H136 Cl8 O16 -","8","1","","Bertolasi, Valerio; Ferretti, Valeria; Gilli, Paola; Yao, Xiaoquan; Li, Chao-Jun","Substituent effects on keto‒enol tautomerization of β-diketones from X-ray structural data and DFT calculations","New Journal of Chemistry","2008","32","4","694","","10.1039/b714708b","","","0.71073","MoKα","","0.1375","0.0514","","","0.0955","0.1243","","","","","","1.034","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051812","16.998","0.0002","9.9242","0.0003","21.5231","0.0005","90","","90","","90","","3630.77","0.14","295","","295","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1,3-diphenyl-2-(1-phenylethyl)propane-1,3-dione","","- C23 H20 O2 -","- C23 H20 O2 -","- C184 H160 O16 -","8","1","","Bertolasi, Valerio; Ferretti, Valeria; Gilli, Paola; Yao, Xiaoquan; Li, Chao-Jun","Substituent effects on keto‒enol tautomerization of β-diketones from X-ray structural data and DFT calculations","New Journal of Chemistry","2008","32","4","694","","10.1039/b714708b","","","0.71073","MoKα","","0.0776","0.0491","","","0.1184","0.1354","","","","","","1.013","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051813","11.1539","0.0003","16.3314","0.0006","11.4618","0.0003","90","","114.694","0.001","90","","1896.94","0.1","295","","295","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","2-[1-(2-chlorophenyl)ethyl]-1,3-diphenylpropane-1,3-dione","","- C23 H19 Cl O2 -","- C23 H19 Cl O2 -","- C92 H76 Cl4 O8 -","4","1","","Bertolasi, Valerio; Ferretti, Valeria; Gilli, Paola; Yao, Xiaoquan; Li, Chao-Jun","Substituent effects on keto‒enol tautomerization of β-diketones from X-ray structural data and DFT calculations","New Journal of Chemistry","2008","32","4","694","","10.1039/b714708b","","","0.71073","MoKα","","0.0889","0.0509","","","0.1179","0.1396","","","","","","1.015","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051814","17.0267","0.0004","9.9384","0.0002","22.3568","0.0007","90","","90","","90","","3783.18","0.17","295","","295","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1,3-diphenyl-1-(1-phenylpropyl)propane-1,3-dione","","- C24 H22 O2 -","- C24 H22 O2 -","- C192 H176 O16 -","8","1","","Bertolasi, Valerio; Ferretti, Valeria; Gilli, Paola; Yao, Xiaoquan; Li, Chao-Jun","Substituent effects on keto‒enol tautomerization of β-diketones from X-ray structural data and DFT calculations","New Journal of Chemistry","2008","32","4","694","","10.1039/b714708b","","","0.71073","MoKα","","0.1041","0.049","","","0.1027","0.1249","","","","","","1.004","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051815","10.162","0.003","10.972","0.003","27.065","0.008","90","","90","","90","","3017.7","1.5","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C29 H44 Cl2 N2 O4 Ti -","- C29 H44 Cl2 N2 O4 Ti -","- C116 H176 Cl8 N8 O16 Ti4 -","4","1","","Zaitsev, Kirill V.; Bermeshev, Maxim V.; Samsonov, Alexey A.; Oprunenko, Juri F.; Churakov, Andrei V.; Howard, Judith A. L.; Karlov, Sergey S.; Zaitseva, Galina S.","Titanium complexes based on chiral enantiopure dialkanolamines: synthesis, structures and catalytic activity","New Journal of Chemistry","2008","32","8","1415","","10.1039/b714739b","","","0.71073","MoKα","","0.0508","0.0453","","","0.1201","0.1234","","","","","","1.06","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051816","11.096","0.002","12.761","0.002","26.595","0.005","90","","90","","90","","3765.7","1.1","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H50 N2 O4 Ti -","- C42 H50 N2 O4 Ti -","- C168 H200 N8 O16 Ti4 -","4","1","","Zaitsev, Kirill V.; Bermeshev, Maxim V.; Samsonov, Alexey A.; Oprunenko, Juri F.; Churakov, Andrei V.; Howard, Judith A. L.; Karlov, Sergey S.; Zaitseva, Galina S.","Titanium complexes based on chiral enantiopure dialkanolamines: synthesis, structures and catalytic activity","New Journal of Chemistry","2008","32","8","1415","","10.1039/b714739b","","","0.71073","MoKα","","0.0638","0.0514","","","0.1018","0.1058","","","","","","1.018","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051817","10.8754","0.0008","14.0332","0.0011","17.581","0.0014","90","","90","","90","","2683.2","0.4","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H39 N O4 Ti -","- C27 H39 N O4 Ti -","- C108 H156 N4 O16 Ti4 -","4","1","","Zaitsev, Kirill V.; Bermeshev, Maxim V.; Samsonov, Alexey A.; Oprunenko, Juri F.; Churakov, Andrei V.; Howard, Judith A. L.; Karlov, Sergey S.; Zaitseva, Galina S.","Titanium complexes based on chiral enantiopure dialkanolamines: synthesis, structures and catalytic activity","New Journal of Chemistry","2008","32","8","1415","","10.1039/b714739b","","","0.71073","MoKα","","0.0877","0.0552","","","0.0875","0.0953","","","","","","1.037","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051818","8.6073","0.0004","18.8704","0.0009","19.0174","0.0009","90","","90","","90","","3088.9","0.3","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H50 N2 O4 Ti -","- C32 H50 N2 O4 Ti -","- C128 H200 N8 O16 Ti4 -","4","1","","Zaitsev, Kirill V.; Bermeshev, Maxim V.; Samsonov, Alexey A.; Oprunenko, Juri F.; Churakov, Andrei V.; Howard, Judith A. L.; Karlov, Sergey S.; Zaitseva, Galina S.","Titanium complexes based on chiral enantiopure dialkanolamines: synthesis, structures and catalytic activity","New Journal of Chemistry","2008","32","8","1415","","10.1039/b714739b","","","0.71073","MoKα","","0.0898","0.059","","","0.0957","0.1029","","","","","","1.014","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051819","10.8805","0.0014","17.269","0.002","18.868","0.003","90","","90","","90","","3545.2","0.8","120","2","120","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C40 H50 N2 O4 Ti -","- C40 H50 N2 O4 Ti -","- C160 H200 N8 O16 Ti4 -","4","0.5","","Zaitsev, Kirill V.; Bermeshev, Maxim V.; Samsonov, Alexey A.; Oprunenko, Juri F.; Churakov, Andrei V.; Howard, Judith A. L.; Karlov, Sergey S.; Zaitseva, Galina S.","Titanium complexes based on chiral enantiopure dialkanolamines: synthesis, structures and catalytic activity","New Journal of Chemistry","2008","32","8","1415","","10.1039/b714739b","","","0.71073","MoKα","","0.0557","0.0444","","","0.0898","0.0937","","","","","","1.045","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051820","11.3503","0.0012","17.9768","0.0019","20.083","0.002","90","","90","","90","","4097.8","0.7","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C48 H50 N2 O4 Ti -","- C48 H50 N2 O4 Ti -","- C192 H200 N8 O16 Ti4 -","4","1","","Zaitsev, Kirill V.; Bermeshev, Maxim V.; Samsonov, Alexey A.; Oprunenko, Juri F.; Churakov, Andrei V.; Howard, Judith A. L.; Karlov, Sergey S.; Zaitseva, Galina S.","Titanium complexes based on chiral enantiopure dialkanolamines: synthesis, structures and catalytic activity","New Journal of Chemistry","2008","32","8","1415","","10.1039/b714739b","","","0.71073","MoKα","","0.1006","0.0627","","","0.1006","0.1098","","","","","","1.004","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051821","11.9885","0.0005","19.3301","0.0009","22.2363","0.001","90","","90","","90","","5153","0.4","120","2","120","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C63 H60 Cl2 N2 O4 Ti -","- C63 H60 Cl2 N2 O4 Ti -","- C252 H240 Cl8 N8 O16 Ti4 -","4","1","","Zaitsev, Kirill V.; Bermeshev, Maxim V.; Samsonov, Alexey A.; Oprunenko, Juri F.; Churakov, Andrei V.; Howard, Judith A. L.; Karlov, Sergey S.; Zaitseva, Galina S.","Titanium complexes based on chiral enantiopure dialkanolamines: synthesis, structures and catalytic activity","New Journal of Chemistry","2008","32","8","1415","","10.1039/b714739b","","","0.71073","MoKα","","0.0896","0.0544","","","0.0924","0.1008","","","","","","1.015","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051822","10.929","0.002","14.972","0.005","21.338","0.004","80.54","0.02","80.66","0.01","68.66","0.02","3187.9","1.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H44 Fe N2 O5 -","- C34 H44 Fe N2 O5 -","- C136 H176 Fe4 N8 O20 -","4","2","","Braga, Dario; Giaffreda, Stefano Luca; Grepioni, Fabrizia; Palladino, Giuseppe; Polito, Marco","Mechanochemical assembly of hybrid organic‒organometallic materials. Solid‒solid reactions of 1,1′-di-pyridyl-ferrocene with organic acids","New Journal of Chemistry","2008","32","5","820","","10.1039/b714923a","","","0.71073","MoKα","","0.1848","0.0768","","","0.2115","0.2731","","","","","","1.012","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051823","27.395","0.018","8.934","0.007","21.507","0.015","90","","121.29","0.04","90","","4498","6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 Fe N2 O4 -","- C28 H22 Fe N2 O4 -","- C224 H176 Fe8 N16 O32 -","8","1","","Braga, Dario; Giaffreda, Stefano Luca; Grepioni, Fabrizia; Palladino, Giuseppe; Polito, Marco","Mechanochemical assembly of hybrid organic‒organometallic materials. Solid‒solid reactions of 1,1′-di-pyridyl-ferrocene with organic acids","New Journal of Chemistry","2008","32","5","820","","10.1039/b714923a","","","0.71073","MoKα","","0.0757","0.0425","","","0.0957","0.1101","","","","","","0.99","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051824","14.775","0.0013","17.8029","0.0015","14.1479","0.0017","90","","121.425","0.003","90","","3175.6","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H28 Fe N2 O12 -","- C38 H28 Fe N2 O12 -","- C152 H112 Fe4 N8 O48 -","4","0.5","","Braga, Dario; Giaffreda, Stefano Luca; Grepioni, Fabrizia; Palladino, Giuseppe; Polito, Marco","Mechanochemical assembly of hybrid organic‒organometallic materials. Solid‒solid reactions of 1,1′-di-pyridyl-ferrocene with organic acids","New Journal of Chemistry","2008","32","5","820","","10.1039/b714923a","","","0.71073","MoKα","","0.0753","0.0448","","","0.1018","0.1162","","","","","","0.96","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051825","9.2235","0.0006","9.5841","0.0006","28.3262","0.0018","92.599","0.001","98.53","0.001","104.326","0.001","2390.5","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C112 H82 Fe4 N8 O20 S5 -","- C112 H82 Fe4 N8 O20 S5 -","- C112 H82 Fe4 N8 O20 S5 -","1","0.5","","Braga, Dario; Giaffreda, Stefano Luca; Grepioni, Fabrizia; Palladino, Giuseppe; Polito, Marco","Mechanochemical assembly of hybrid organic‒organometallic materials. Solid‒solid reactions of 1,1′-di-pyridyl-ferrocene with organic acids","New Journal of Chemistry","2008","32","5","820","","10.1039/b714923a","","","0.71073","MoKα","","0.1016","0.0524","","","0.133","0.1523","","","","","","0.992","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051826","10.4677","0.0006","10.9006","0.0006","11.5402","0.0007","87.771","0.001","67.023","0.001","70.163","0.001","1133.7","0.11","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H48 Cr2 O18 Ti2 -","- C32 H48 Cr2 O18 Ti2 -","- C32 H48 Cr2 O18 Ti2 -","1","0.5","","Nogai, Stefan D.; Schuster, Oliver; Bruce, Jocelyn; Raubenheimer, Helgard G.","Titanoxycarbene complexes of Ti(iv) with O- and N-donor ligands","New Journal of Chemistry","2008","32","3","540","","10.1039/b715075j","","","0.71073","MoKα","","0.0375","0.0333","","","0.0924","0.0961","","","","","","1.041","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051827","9.687","0.0005","10.6893","0.0006","11.7611","0.0006","108.787","0.001","107.558","0.001","91.644","0.001","1088.5","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H48 O18 Ti2 W2 -","- C32 H48 O18 Ti2 W2 -","- C32 H48 O18 Ti2 W2 -","1","0.5","","Nogai, Stefan D.; Schuster, Oliver; Bruce, Jocelyn; Raubenheimer, Helgard G.","Titanoxycarbene complexes of Ti(iv) with O- and N-donor ligands","New Journal of Chemistry","2008","32","3","540","","10.1039/b715075j","","","0.71073","MoKα","","0.0265","0.025","","","0.0627","0.0635","","","","","","1.046","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051828","23.5279","0.0014","15.423","0.001","14.9208","0.0008","90","","100.695","0.002","90","","5320.3","0.5","213","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H30 Cr2 N2 O14 Ti -","- C30 H30 Cr2 N2 O14 Ti -","- C180 H180 Cr12 N12 O84 Ti6 -","6","1.5","","Nogai, Stefan D.; Schuster, Oliver; Bruce, Jocelyn; Raubenheimer, Helgard G.","Titanoxycarbene complexes of Ti(iv) with O- and N-donor ligands","New Journal of Chemistry","2008","32","3","540","","10.1039/b715075j","","","0.71073","MoKα","","0.0513","0.0402","","","0.0985","0.1051","","","","","","1.059","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051829","23.5197","0.0015","15.4154","0.001","14.9223","0.0009","90","","100.704","0.001","90","","5316.2","0.6","100","2","100","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C30 H30 N2 O14 Ti W2 -","- C30 H30 N2 O14 Ti W2 -","- C180 H180 N12 O84 Ti6 W12 -","6","1.5","","Nogai, Stefan D.; Schuster, Oliver; Bruce, Jocelyn; Raubenheimer, Helgard G.","Titanoxycarbene complexes of Ti(iv) with O- and N-donor ligands","New Journal of Chemistry","2008","32","3","540","","10.1039/b715075j","","","0.71073","MoKα","","0.049","0.038","","","0.0899","0.0955","","","","","","1.046","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051830","8.7977","0.0005","13.4237","0.0007","16.4837","0.0009","90","","97.906","0.001","90","","1928.18","0.18","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 Cl2 N2 O2 Ti -","- C16 H24 Cl2 N2 O2 Ti -","- C64 H96 Cl8 N8 O8 Ti4 -","4","1","","Nogai, Stefan D.; Schuster, Oliver; Bruce, Jocelyn; Raubenheimer, Helgard G.","Titanoxycarbene complexes of Ti(iv) with O- and N-donor ligands","New Journal of Chemistry","2008","32","3","540","","10.1039/b715075j","","","0.71073","MoKα","","0.0428","0.0373","","","0.0953","0.0991","","","","","","1.025","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051831","13.8819","0.0008","15.8365","0.0009","16.0976","0.0009","95.4","0.001","97.683","0.001","91.18","0.001","3489.6","0.3","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C65 H57 Cl9 F6 N9 O8 P -","- C60 H46 F6 N9 O6 P -","- C120 H92 F12 N18 O12 P2 -","2","1","","Polavarapu, Prasad; Melander, Helena; Langer, Vratislav; Gogoll, Adolf; Grennberg, Helena","Modulation and binding properties of extended glycoluril molecular clips","New Journal of Chemistry","2008","32","4","643","","10.1039/b715208f","","","0.71073","MoKα","","0.0675","0.054","","","0.1589","0.1671","","","","","","0.999","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051832","7.9048","0.0007","10.0563","0.0011","25.4056","0.0025","90","","95.4398","0.0054","90","","2010.5","0.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Cl N5 O -","- C18 H28 Cl N5 O -","- C72 H112 Cl4 N20 O4 -","4","1","","Stavila, Vitalie; Allali, Mustapha; Canaple, Laurence; Stortz, Yvon; Franc, Cécile; Maurin, Philippe; Beuf, Olivier; Dufay, Olivier; Samarut, Jacques; Janier, Marc; Hasserodt, Jens","Significant relaxivity gap between a low-spin and a high-spin iron(ii) complex of structural similarity: an attractive off‒on system for the potential design of responsive MRI probes","New Journal of Chemistry","2008","32","3","428","","10.1039/b715254j","","","0.71069","MoKα","","0.1399","0.0511","","0.138","0.0663","0.0789","","","","","","1.0655","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051833","16.7758","0.0003","14.132","0.0003","23.1203","0.0004","90","","103.193","0.001","90","","5336.59","0.18","123","1","123","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Na(12c4)2](cdm).H2O","[Na(12c4)2](cdm).H2O","","- C20 H38 N3 Na O11 -","- C20 H38 N3 Na O11 -","- C160 H304 N24 Na8 O88 -","8","2","","Turner, David R.; Pek, Sze Nee; Batten, Stuart R.","Amide-water hydrogen-bond motifs in alkali-metal/crown ether complexes of carbamoyldicyanomethanide, C(CONH2)(CN)2−","New Journal of Chemistry","2008","32","4","719","","10.1039/b716191c","","","0.71073","MoKα","","0.1474","0.067","","","0.1552","0.1916","","","","","","0.974","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051834","9.138","0.003","11.009","0.003","25.629","0.007","90","","96.335","0.012","90","","2562.5","1.3","123","1","123","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[K(12c4)2]cdm.H2O","bis(12-crown-4)potassium carbamoyldicyanomethanide hydrate","","- C20 H36 K N3 O10 -","- C20 H36 K N3 O10 -","- C80 H144 K4 N12 O40 -","4","1","","Turner, David R.; Pek, Sze Nee; Batten, Stuart R.","Amide-water hydrogen-bond motifs in alkali-metal/crown ether complexes of carbamoyldicyanomethanide, C(CONH2)(CN)2−","New Journal of Chemistry","2008","32","4","719","","10.1039/b716191c","","","0.71073","MoKα","","0.1276","0.1261","","","0.3244","0.3257","","","","","","1.103","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051835","16.1381","0.0003","18.4737","0.0004","22.6934","0.0005","113.457","0.001","96.583","0.001","93.778","0.001","6119.2","0.2","123","1","123","1","","","","","","","","5","P -1","-P 1","2","[K(15c5)2](cdm).H2O","[K(15c5)2](cdm).H2O","","- C24 H44 K N3 O12 -","- C24 H44 K N3 O12 -","- C192 H352 K8 N24 O96 -","8","4","","Turner, David R.; Pek, Sze Nee; Batten, Stuart R.","Amide-water hydrogen-bond motifs in alkali-metal/crown ether complexes of carbamoyldicyanomethanide, C(CONH2)(CN)2−","New Journal of Chemistry","2008","32","4","719","","10.1039/b716191c","","","0.71073","MoKα","","0.0846","0.0458","","","0.102","0.1211","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051836","10.4626","0.0002","11.7836","0.0003","14.8886","0.0003","106.085","0.002","90.672","0.001","91.569","0.001","1762.69","0.07","123","1","423","2","","","","","","","","5","P -1","-P 1","2","[K(15c5)2](cdm)(cdmH)","[K(15c5)2](cdm)(cdmH)","","- C28 H45 K N6 O12 -","- C28 H45 K N6 O12 -","- C56 H90 K2 N12 O24 -","2","1","","Turner, David R.; Pek, Sze Nee; Batten, Stuart R.","Amide-water hydrogen-bond motifs in alkali-metal/crown ether complexes of carbamoyldicyanomethanide, C(CONH2)(CN)2−","New Journal of Chemistry","2008","32","4","719","","10.1039/b716191c","","","0.71073","MoKα","","0.0948","0.065","","","0.1566","0.1756","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051837","13.4619","0.0002","17.6252","0.0003","18.4777","0.0003","90.386","0.001","90.441","0.001","103.642","0.001","4260.2","0.12","123","1","123","1","","","","","","","","5","P -1","-P 1","2","[K(18c6)(cdm)(H2O)]","[(aqua)(carbamoyldicyanomethanido)(18-crown-6)potassium]","","- C16 H28 K N3 O8 -","- C16 H28 K N3 O8 -","- C128 H224 K8 N24 O64 -","8","4","","Turner, David R.; Pek, Sze Nee; Batten, Stuart R.","Amide-water hydrogen-bond motifs in alkali-metal/crown ether complexes of carbamoyldicyanomethanide, C(CONH2)(CN)2−","New Journal of Chemistry","2008","32","4","719","","10.1039/b716191c","","","0.71073","MoKα","","0.0491","0.0329","","","0.0773","0.0855","","","","","","1.011","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051838","17.4821","0.0002","17.7345","0.0002","17.8705","0.0003","97.04","0.001","109.612","0.001","102.223","0.001","4986.68","0.13","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H57 Cl3 N6 O8 -","- C51 H57 Cl3 N6 O8 -","- C204 H228 Cl12 N24 O32 -","4","2","","Plitt, Patrick; Lynch, Vincent M.; Sessler, Jonathan L.","Oxidation-induced control of self-assembly using a bis-dipyrromethyl substituted phenanthroline building block","New Journal of Chemistry","2008","32","5","777","","10.1039/b716796b","","","0.71073","MoKα","","0.1561","0.0748","","","0.1805","0.2165","","","","","","1.033","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051839","11.0307","0.0002","15.0724","0.0003","18.4602","0.0004","99.633","0.002","99.191","0.002","111.289","0.002","2737","0.11","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H70 Cl2 N6 O10 -","- C56 H70 Cl2 N6 O10 -","- C112 H140 Cl4 N12 O20 -","2","1","","Plitt, Patrick; Lynch, Vincent M.; Sessler, Jonathan L.","Oxidation-induced control of self-assembly using a bis-dipyrromethyl substituted phenanthroline building block","New Journal of Chemistry","2008","32","5","777","","10.1039/b716796b","","","0.71073","MoKα","","0.1164","0.0633","","","0.1407","0.1671","","","","","","1.017","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051840","13.184","0.0016","7.5135","0.0007","9.5583","0.0012","90","","104.607","0.015","90","","916.22","0.19","180","","","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C16 H20 Cl2 N4 O4 -","- C16 H20 Cl2 N4 O4 -","- C32 H40 Cl4 N8 O8 -","2","0.5","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.039","","","","0.038","","","","","","1.35","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051841","8.079","0.0005","8.201","0.0006","16.3774","0.0013","84.534","0.009","84.929","0.009","71.783","0.008","1024.05","0.14","150","","","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H24 Cl2 N4 O4 -","- C18 H24 Cl2 N4 O4 -","- C36 H48 Cl4 N8 O8 -","2","1","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.036","","","","0.036","","","","","","1.45","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051842","8.5668","0.0009","12.2524","0.0011","9.3375","0.001","90","","103.982","0.012","90","","951.06","0.17","220","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H20 Cl2 N4 O3 -","- C16 H20 Cl2 N4 O3 -","- C32 H40 Cl4 N8 O6 -","2","1","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.043","","","","0.042","","","","","","1.49","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051843","16.1313","0.0016","5.0524","0.0004","11.8012","0.0013","90","","109.906","0.011","90","","904.35","0.16","200","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N2 O2 -","- C10 H10 N2 O2 -","- C40 H40 N8 O8 -","4","1","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.032","","","","0.032","","","","","","1.21","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051844","11.4467","0.001","9.5194","0.0006","13.1539","0.001","90","","108.81","0.009","90","","1356.77","0.19","200","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H18 N2 O2 -","- C15 H18 N2 O2 -","- C60 H72 N8 O8 -","4","2","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.032","","","","0.031","","","","","","1.5","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051845","4.6354","0.0005","10.4827","0.0015","10.2152","0.0012","90","","101.112","0.013","90","","487.07","0.11","220","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H10 N2 O3 -","- C10 H10 N2 O3 -","- C20 H20 N4 O6 -","2","1","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.031","","","","0.031","","","","","","1.66","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051846","6.879","0.0003","10.3028","0.0007","15.9544","0.0008","90","","90","","90","","1130.74","0.11","200","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H14 N2 O6 -","- C10 H14 N2 O6 -","- C40 H56 N8 O24 -","4","1","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.032","","","","0.032","","","","","","1.62","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051847","10.5317","0.0008","10.5831","0.0009","9.4968","0.001","90","","90","","90","","1058.49","0.16","200","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H12 N2 O4 -","- C11 H12 N2 O4 -","- C44 H48 N8 O16 -","4","1","","Delval, Franck; Spyratou, Alexandra; Verdan, Simon; Bernardinelli, Gerald; Williams, Alan F.","The clash of the synthons: crystal structures of benzimidazole‒alcohol‒carboxylic acids","New Journal of Chemistry","2008","32","8","1394","","10.1039/b717018a","","","0.71073","MoKα","","","0.031","","","","0.03","","","","","","1.38","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051848","8.8338","0.0007","11.941","0.0006","12.9247","0.0008","90","","97.458","0.006","90","","1351.82","0.15","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 Br N2 O4 S -","- C12 H13 Br N2 O4 S -","- C48 H52 Br4 N8 O16 S4 -","4","1","","Makota, O.; Eilfeld, A.; Trach, Yu.; Schulze, B.; Sieler, J.","Novel hydroperoxy sultam, 2-(6-bromo-pyrid-2-yl)-2,3,4,5,6,7-hexahydro-1,2-benzisothiazol-3-hydroperoxy 1,1-dioxide: synthesis, crystal structure and kinetics of catalytic interaction with cyclooctene","New Journal of Chemistry","2008","32","6","1020","","10.1039/b717726g","","","0.71073","MoKα","","0.0435","0.0355","","","0.0994","0.1019","","","","","","1.139","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051849","12.9568","0.0011","14.4422","0.0014","15.5453","0.0012","92.45","0.002","103.069","0.001","112.024","0.002","2600.5","0.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C45.5 H45.5 Cl10.5 N2 O8 S2 -","- C45.5 H45.5 Cl10.5 N2 O8 S2 -","- C91 H91 Cl21 N4 O16 S4 -","2","1","","Tran, Huu-Anh; Collins, Julie; Georghiou, Paris E.","Synthesis of “calixarene-like” N,N-ditosyldiaza[3.3](1,4)naphthalenophanes","New Journal of Chemistry","2008","32","7","1175","","10.1039/b717797f","","","0.7107","MoKα","","0.0763","0.072","","","0.1773","0.1813","","","","","","1.071","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051850","15.8094","0.0005","14.9432","0.0004","15.5776","0.0004","90","","103.219","0.001","90","","3582.59","0.18","113","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(tetrahydrofuran) clathrate","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(tetrahydrofuran) clathrate","","- C46 H42 O4 -","- C46 H42 O4 -","- C184 H168 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.1244","0.0495","","","0.1047","0.1264","","","","","","0.938","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051851","7.5658","0.0002","32.1197","0.0008","15.3726","0.0005","90","","99.269","0.001","90","","3686.94","0.18","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(diethyl ether) clathrate","9,9'(Biphenyl-4,4'-diyl)difluoren-9-ol.2(diethyl ether) clathrate","","- C46 H46 O4 -","- C46 H46 O4 -","- C184 H184 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.2121","0.0646","","","0.1148","0.1581","","","","","","0.973","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051852","15.1601","0.0006","15.2878","0.0006","15.7069","0.0007","90","","101.288","0.002","90","","3569.9","0.3","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.35(tetrahydrofuran). 0.65(diethyl ether) clathrate","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.35(tetrahydrofuran). 0.65(diethyl ether) clathrate","","- C46 H44 O4 -","- C46 H34 O4 -","- C184 H136 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.1397","0.069","","","0.1652","0.1959","","","","","","1.036","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051853","15.1157","0.0003","15.2709","0.0004","15.7497","0.0004","90","","100.986","0.001","90","","3568.88","0.15","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.15(tetrahydrofuran). 0.85(diethyl ether) clathrate","9,9'-(Biphenyl-4,4'-diyl)difluoren-9-ol. 1.15(tetrahydrofuran). 0.85(diethyl ether) clathrate","","- C46 H44 O4 -","- C46 H42 O4 -","- C184 H168 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.1218","0.0518","","","0.1269","0.1523","","","","","","0.987","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051854","15.0708","0.0005","15.2736","0.0005","15.8003","0.0006","90","","100.415","0.001","90","","3577.1","0.2","103","2","103","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","9,9'-(Biphenyl-4,4'-diyl)bis(fluoren-9-ol). 0.9(tetrahydrofuran). 1.1(diethyl ether) clathrate","9,9'-(Biphenyl-4,4'-diyl)bis(fluoren-9-ol). 0.9(tetrahydrofuran). 1.1(diethyl ether) clathrate","","- C46 H44 O4 -","- C46 H36 O4 -","- C184 H144 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.1207","0.0654","","","0.1492","0.1743","","","","","","1.014","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051855","11.176","0.002","18.325","0.004","23.185","0.005","90","","97.89","0.03","90","","4703.3","1.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","9,9'-(ethyne-1,2-diyl)difluoren-9-ol. (acetonitrile). (water) clathrate","9,9'-(ethyne-1,2-diyl)difluoren-9-ol. (acetonitrile). (water) clathrate","","- C30 H25 N O3 -","- C30 H22 N O3 -","- C240 H176 N8 O24 -","8","2","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.1125","0.0465","","","0.1067","0.1321","","","","","","0.833","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051856","9.5245","0.0019","11.534","0.002","16.275","0.003","99.2","0.03","91.61","0.03","90.19","0.03","1764.1","0.6","173","2","173","2","","","","","","","","3","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 2(ethanol) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 2(ethanol) clathrate","","- C46 H39 O5 -","- C46 H39 O5 -","- C92 H78 O10 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.063","0.041","","","0.0945","0.1025","","","","","","1.056","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051857","9.7084","0.0019","11.562","0.002","16.045","0.003","80.21","0.03","87.41","0.03","89.34","0.03","1773","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). (ethanol). (acetonitrile) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). (ethanol). (acetonitrile) clathrate","","- C46 H36 N O4 -","- C46 H36 N O4 -","- C92 H72 N2 O8 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.0819","0.0415","","","0.0909","0.1017","","","","","","1.034","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051858","9.6894","0.0019","11.558","0.002","16.063","0.003","80.29","0.03","87.53","0.03","89.42","0.03","1771.5","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.07(ethanol). 0.93(acetonitrile) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.07(ethanol). 0.93(acetonitrile) clathrate","","- C46 H36 N O4 -","- C46 H33 N O4 -","- C92 H66 N2 O8 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.097","0.0452","","","0.1071","0.1218","","","","","","1.019","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051859","9.631","0.0019","11.548","0.002","16.154","0.003","80.54","0.03","87.79","0.03","89.66","0.03","1770.9","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.41(ethanol). 0.59(acetonitrile) clathrate","1.5(9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 1.41(ethanol). 0.59(acetonitrile) clathrate","","- C46 H36 N O4 -","- C46 H33 N0.59 O4.41 -","- C92 H66 N1.18 O8.82 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.0868","0.0468","","","0.1142","0.129","","","","","","1.058","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051860","9.9567","0.0001","10.8079","0.0002","11.9167","0.0002","79.455","0.001","88.281","0.001","83.363","0.001","1252.21","0.03","173","2","173","2","","","","","","","","4","P -1","-P 1","2","none","9,9'-(ethyne-1,2-diyl)difluoren-9-ol. 2(acetonitrile) clathrate","","- C32 H24 N2 O2 -","- C32 H24 N2 O2 -","- C64 H48 N4 O4 -","2","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.0546","0.0382","","","0.0918","0.1002","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051861","9.755","0.002","10.638","0.002","24.811","0.005","90","","91.77","0.03","90","","2573.5","0.9","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","none","9,9'-(ethyne-1,2-diyl)difluoren-9-ol). 2(ethanol) clathrate","","- C32 H30 O4 -","- C32 H30 O4 -","- C128 H120 O16 -","4","1","","le Roex, Tanya; Nassimbeni, Luigi R.; Weber, Edwin","Selectivity and structure of mixed guest clathrates","New Journal of Chemistry","2008","32","5","856","","10.1039/b718397f","","","0.71073","MoKα","","0.1596","0.0762","","","0.1885","0.221","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051862","15.879","0.004","17.556","0.004","29.381","0.006","90","","90","","90","","8191","3","273","2","273","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C86 H118 Ga2 Hf O -","- C86 H118 Ga2 Hf O -","- C344 H472 Ga8 Hf4 O4 -","4","0.5","","Quillian, Brandon; Wang, Yuzhong; Wei, Pingrong; Robinson, Gregory H.","Organometallic compounds containing new Hf‒Ga and Hf‒In bonds: Cp2Hf(ER)2 (Cp = C5H5; E = Ga, In; R = ‒C6H3-2,6-(2,4,6-i-Pr3C6H2)2)","New Journal of Chemistry","2008","32","5","774","","10.1039/b718429h","","","0.71073","MoKα","","0.1602","0.0614","","","0.1563","0.2307","","","","","","1.013","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051863","15.748","0.004","17.855","0.005","29.708","0.008","90","","90","","90","","8353","4","273","2","273","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C86 H118 Hf In2 O -","- C86 H118 Hf In2 O -","- C344 H472 Hf4 In8 O4 -","4","0.5","","Quillian, Brandon; Wang, Yuzhong; Wei, Pingrong; Robinson, Gregory H.","Organometallic compounds containing new Hf‒Ga and Hf‒In bonds: Cp2Hf(ER)2 (Cp = C5H5; E = Ga, In; R = ‒C6H3-2,6-(2,4,6-i-Pr3C6H2)2)","New Journal of Chemistry","2008","32","5","774","","10.1039/b718429h","","","0.71073","MoKα","","0.1882","0.0653","","","0.1452","0.208","","","","","","1.01","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051864","10.0458","0.0002","24.5646","0.0006","17.3771","0.0004","90","","97.058","0.001","90","","4255.67","0.17","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C95 H134 N6 O2 Pb2 -","- C95 H134 N6 O2 Pb2 -","- C190 H268 N12 O4 Pb4 -","2","0.5","","Stasch, Andreas; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.","Thermally stable lead(ii) amidinates and guanidinates","New Journal of Chemistry","2008","32","5","829","","10.1039/b718537e","","","0.71073","MoKα","","0.0915","0.0547","","","0.0723","0.0796","","","","","","1.047","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051865","14.9163","0.0003","16.1789","0.0003","20.8178","0.0005","90","","110.09","0.001","90","","4718.26","0.17","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H70 N4 Pb -","- C50 H70 N4 Pb -","- C200 H280 N16 Pb4 -","4","1","","Stasch, Andreas; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.","Thermally stable lead(ii) amidinates and guanidinates","New Journal of Chemistry","2008","32","5","829","","10.1039/b718537e","","","0.71073","MoKα","","0.0959","0.0576","","","0.1298","0.1455","","","","","","1.053","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051866","10.9449","0.0004","13.1345","0.0004","15.3776","0.0007","109.593","0.002","98.675","0.002","95.682","0.003","2032.07","0.14","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C88 H120 Cl2 N6 Pb2 -","- C88 H120 Cl2 N6 Pb2 -","- C88 H120 Cl2 N6 Pb2 -","1","0.5","","Stasch, Andreas; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.","Thermally stable lead(ii) amidinates and guanidinates","New Journal of Chemistry","2008","32","5","829","","10.1039/b718537e","","","0.71073","MoKα","","0.1088","0.0559","","","0.0746","0.0871","","","","","","1.03","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051867","13.2064","0.0003","13.3847","0.0003","13.9367","0.0004","63.026","0.001","80.217","0.001","79.878","0.001","2149.88","0.09","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C95 H136 Cl2 N6 Pb2 -","- C95 H136 Cl2 N6 Pb2 -","- C95 H136 Cl2 N6 Pb2 -","1","0.5","","Stasch, Andreas; Forsyth, Craig M.; Jones, Cameron; Junk, Peter C.","Thermally stable lead(ii) amidinates and guanidinates","New Journal of Chemistry","2008","32","5","829","","10.1039/b718537e","","","0.71073","MoKα","","0.0543","0.041","","","0.0931","0.0988","","","","","","1.059","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051868","19.336","0.004","24.529","0.005","5.4514","0.0011","90","","90","","90","","2585.6","0.9","153","2","153","2","","","","","","","","5","I m m 2","I 2 -2","44","","","","- C18 H23 O16 S3 Tb -","- C18 H23 O16 S3 Tb -","- C72 H92 O64 S12 Tb4 -","4","0.5","","Yang, Xiaoping; Rivers, Joseph H.; McCarty, W. Jeffrey; Wiester, Michael; Jones, Richard A.","Synthesis and structures of luminescent ladder-like lanthanide coordination polymers of 4-hydroxybenzenesulfonate","New Journal of Chemistry","2008","32","5","790","","10.1039/b718590a","","","0.71073","MoKα","","0.0499","0.0437","","","0.1142","0.1178","","","","","","1.129","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051869","19.219","0.004","24.277","0.005","5.425","0.0011","90","","90","","90","","2531.2","0.9","153","2","153","2","","","","","","","","5","I m m 2","I 2 -2","44","","","","- C18 H23 Er O16 S3 -","- C18 H23 Er O16 S3 -","- C72 H92 Er4 O64 S12 -","4","0.5","","Yang, Xiaoping; Rivers, Joseph H.; McCarty, W. Jeffrey; Wiester, Michael; Jones, Richard A.","Synthesis and structures of luminescent ladder-like lanthanide coordination polymers of 4-hydroxybenzenesulfonate","New Journal of Chemistry","2008","32","5","790","","10.1039/b718590a","","","0.71073","MoKα","","0.1942","0.0734","","","0.1362","0.1745","","","","","","0.983","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051870","19.244","0.004","24.149","0.005","5.4176","0.0011","90","","90","","90","","2517.7","0.9","153","2","153","2","","","","","","","","5","I m m 2","I 2 -2","44","","","","- C18 H23 O16 S3 Yb -","- C18 H23 O16 S3 Yb -","- C72 H92 O64 S12 Yb4 -","4","0.5","","Yang, Xiaoping; Rivers, Joseph H.; McCarty, W. Jeffrey; Wiester, Michael; Jones, Richard A.","Synthesis and structures of luminescent ladder-like lanthanide coordination polymers of 4-hydroxybenzenesulfonate","New Journal of Chemistry","2008","32","5","790","","10.1039/b718590a","","","0.71073","MoKα","","0.0741","0.0527","","","0.129","0.1408","","","","","","1.104","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051871","8.036","0.003","10.8","0.004","12.235","0.005","96.582","0.005","106.786","0.005","96.366","0.005","998.3","0.7","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C40.28 H36.56 Cl0.78 O6.5 S6 -","- C40.28 H36.56 Cl0.78 O6.5 S6 -","- C40.28 H36.56 Cl0.78 O6.5 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.111","0.0877","","","0.1982","0.2103","","","","","","1.176","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051872","8.1164","0.0016","10.57","0.002","12.351","0.003","95.006","0.007","107.786","0.006","95.944","0.006","995.6","0.4","100","1","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H38 O7 S6 -","- C41 H38 O7 S6 -","- C41 H38 O7 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0829","0.0597","","","0.1437","0.1612","","","","","","1.043","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051873","7.9717","0.0006","10.8775","0.0007","12.1307","0.0009","97.149","0.004","106.072","0.004","96.567","0.004","990.62","0.13","100","1","95","2","","","","","","","","5","P -1","-P 1","2","","","","- C40.6 H37.2 Cl0.8 O6.6 S6 -","- C40.6 H37.2 Cl0.8 O6.6 S6 -","- C40.6 H37.2 Cl0.8 O6.6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0655","0.0478","","","0.1193","0.1314","","","","","","1.039","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051874","7.9656","0.0006","10.9124","0.0008","12.1583","0.0009","97.297","0.003","105.982","0.004","96.641","0.004","995.12","0.13","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C40.36 H36.72 Cl1.28 O6.36 S6 -","- C40.36 H36.72 Cl1.28 O6.36 S6 -","- C40.36 H36.72 Cl1.28 O6.36 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0582","0.0444","","","0.1184","0.1277","","","","","","1.038","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051875","7.9555","0.0003","10.9385","0.0005","12.1457","0.0005","97.452","0.002","105.862","0.002","96.676","0.002","995.27","0.07","100","1","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C40.24 H36.48 Cl1.52 O6.24 S6 -","- C40.24 H36.48 Cl1.52 O6.24 S6 -","- C40.24 H36.48 Cl1.52 O6.24 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.057","0.0368","","","0.0929","0.1095","","","","","","1.062","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051876","7.9495","0.0007","10.9743","0.001","12.18","0.0012","97.623","0.005","105.816","0.004","96.665","0.004","1000.33","0.16","100","1","100","1","","","","","","","","5","P -1","-P 1","2","","","","- C40 H36 Cl2 O6 S6 -","- C40 H36 Cl2 O6 S6 -","- C40 H36 Cl2 O6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0456","0.0335","","","0.0883","0.0949","","","","","","1.03","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051877","7.9859","0.0008","10.922","0.0011","12.2218","0.0013","97.398","0.002","106.184","0.002","96.687","0.002","1002.17","0.18","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H36 Cl2 O6 S6 -","- C40 H36 Cl2 O6 S6 -","- C40 H36 Cl2 O6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.041","0.0334","","","0.087","0.0931","","","","","","1.044","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051878","7.925","0.003","10.805","0.005","11.946","0.005","96.507","0.006","105.889","0.006","96.037","0.006","967.5","0.7","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C38.52 H33.03 Cl0.52 O6 S6 -","- C38.516 H33.032 Cl0.516 O6 S6 -","- C38.516 H33.032 Cl0.516 O6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.1206","0.0872","","","0.2038","0.2183","","","","","","1.073","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051879","7.944","0.004","10.813","0.006","11.977","0.006","96.448","0.007","105.998","0.007","95.975","0.007","972.8","0.9","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C38.48 H32.96 Cl0.48 O6 S6 -","- C38.48 H32.96 Cl0.48 O6 S6 -","- C38.48 H32.96 Cl0.48 O6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.1113","0.0725","","","0.1753","0.1966","","","","","","1.091","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051880","7.931","0.002","10.798","0.003","11.948","0.003","96.264","0.004","105.987","0.003","95.939","0.003","968.2","0.4","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C38.48 H32.95 Cl0.48 O6 S6 -","- C38.48 H32.96 Cl0.48 O6 S6 -","- C38.48 H32.96 Cl0.48 O6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0824","0.0625","","","0.1421","0.1511","","","","","","1.156","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051881","7.964","0.004","10.792","0.005","12.002","0.006","96.368","0.006","106.028","0.006","95.933","0.006","975.6","0.8","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C38.42 H32.84 Cl0.42 O6 S6 -","- C38.42 H32.84 Cl0.42 O6 S6 -","- C38.42 H32.84 Cl0.42 O6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.1134","0.0903","","","0.2144","0.2275","","","","","","1.195","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051882","7.9498","0.0016","10.739","0.002","11.936","0.002","95.861","0.003","106.164","0.002","95.609","0.003","965.1","0.3","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C38.12 H32.25 Cl0.12 O6 S6 -","- C38.12 H32.24 Cl0.12 O6 S6 -","- C38.12 H32.24 Cl0.12 O6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0726","0.044","","","0.1015","0.1137","","","","","","1.047","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051883","8.1097","0.0008","10.5562","0.001","12.3382","0.0012","94.864","0.002","107.949","0.002","95.909","0.002","991.89","0.17","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H38 O7 S6 -","- C41 H38 O7 S6 -","- C41 H38 O7 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.055","0.037","","","0.0898","0.0996","","","","","","1.017","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051884","8.097","0.0012","10.5845","0.0015","12.3055","0.0018","95.02","0.003","107.818","0.002","95.907","0.002","990.8","0.2","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C40.52 H37.04 O6.84 S6 -","- C40.52 H37.04 O6.84 S6 -","- C40.52 H37.04 O6.84 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.064","0.0529","","","0.1421","0.1506","","","","","","1.05","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051885","8.1018","0.0006","10.5888","0.0008","12.3159","0.0009","94.999","0.001","107.765","0.001","95.96","0.001","992.84","0.13","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H38 O7 S6 -","- C41 H38 O7 S6 -","- C41 H38 O7 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0531","0.0403","","","0.1094","0.1214","","","","","","1.02","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051886","8.0791","0.001","10.6375","0.0013","12.2629","0.0015","95.24","0.002","107.497","0.002","95.945","0.003","991.4","0.2","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C40.4 H36.8 O6.8 S6 -","- C40.4 H36.8 O6.8 S6 -","- C40.4 H36.8 O6.8 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0413","0.037","","","0.097","0.1003","","","","","","1.045","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051887","8.1349","0.0006","10.51","0.0008","12.3775","0.0009","94.624","0.001","108.274","0.001","95.778","0.001","992.7","0.13","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C40.88 H37.76 O6.96 S6 -","- C40.88 H37.76 O6.96 S6 -","- C40.88 H37.76 O6.96 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0408","0.0325","","","0.0872","0.0937","","","","","","1.031","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051888","8.032","0.004","10.645","0.005","12.144","0.006","95.345","0.006","107.251","0.006","95.81","0.006","978.2","0.8","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C39.8 H35.6 O6.6 S6 -","- C39.8 H35.6 O6.6 S6 -","- C39.8 H35.6 O6.6 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0791","0.0594","","","0.1206","0.1267","","","","","","1.149","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051889","7.99","0.003","10.661","0.004","12.05","0.004","95.542","0.005","106.816","0.004","95.76","0.005","969","0.6","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C39.2 H34.4 O6.4 S6 -","- C39.2 H34.4 O6.4 S6 -","- C39.2 H34.4 O6.4 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0999","0.059","","","0.1192","0.131","","","","","","1.102","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051890","7.9572","0.0017","10.694","0.002","11.958","0.003","95.691","0.003","106.43","0.003","95.669","0.003","962.6","0.4","125","2","125","2","","","","","","","","4","P -1","-P 1","2","","","","- C38.72 H33.44 O6.24 S6 -","- C38.72 H33.44 O6.24 S6 -","- C38.72 H33.44 O6.24 S6 -","1","0.5","","Burchell, Tara J.; Enright, Gary D.; Ripmeester, John A.","Guest capture, storage and removal in the TATM host framework: a single-crystal study","New Journal of Chemistry","2008","32","5","864","","10.1039/b718592h","","","0.71073","MoKα","","0.0598","0.0354","","","0.072","0.0803","","","","","","1.061","","","","has coordinates,has disorder","180072","2020-10-21","18:00:00",""
"7051891","11.518","0.002","19.205","0.004","14.668","0.003","90","","103.02","0.03","90","","3161.2","1.1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H96 Cl2 In2 N6 -","- C64 H96 Cl2 In2 N6 -","- C128 H192 Cl4 In4 N12 -","2","0.5","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71073","MoKα","","0.0711","0.0455","","","0.1083","0.1193","","","","","","1.049","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051892","12.5767","0.0018","12.5767","0.0018","23.27","0.005","90","","90","","90","","3680.7","1.1","150","2","150","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C37 H56 Ga I2 N3 -","- C37 H56 Ga I2 N3 -","- C148 H224 Ga4 I8 N12 -","4","0.5","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71073","MoKα","","0.1085","0.067","","","0.1095","0.1216","","","","","","1.034","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051893","17.94","0.004","17.922","0.004","20.153","0.004","90","","107.01","0.03","90","","6196","3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H48 N3 Tl -","- C32 H48 N3 Tl -","- C256 H384 N24 Tl8 -","8","2","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71073","MoKα","","0.0633","0.0369","","","0.0651","0.0725","","","","","","1.026","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051894","9.844","0.005","12.034","0.005","16.117","0.005","82.34","0.005","79.94","0.005","68.729","0.005","1746.7","1.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H56 N2 P Tl -","- C37 H56 N2 P Tl -","- C74 H112 N4 P2 Tl2 -","2","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71069","MoKα","","0.0511","0.0371","","","0.07","0.0748","","","","","","1.044","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051895","14.424","0.003","22.313","0.005","22.538","0.005","116.69","0.03","97.26","0.03","96.81","0.03","6302","3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H96 Cl2 In2 N6 -","- C62 H96 Cl2 In2 N6 -","- C248 H384 Cl8 In8 N24 -","4","2","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71073","MoKα","","0.1398","0.1049","","","0.2252","0.2388","","","","","","1.159","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051896","17.298","0.004","11.948","0.002","15.609","0.003","90","","102.04","0.03","90","","3155","1.1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H48 In N3 -","- C32 H34 In N3 -","- C128 H136 In4 N12 -","4","0.5","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71073","MoKα","","0.0464","0.0394","","","0.1055","0.1098","","","","","","1.058","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051897","9.866","0.005","12.021","0.005","16.135","0.005","82.804","0.005","80.474","0.005","68.833","0.005","1755.4","1.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H56 In N2 P -","- C37 H56 In N2 P -","- C74 H112 In2 N4 P2 -","2","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71069","MoKα","","0.0412","0.0326","","","0.0768","0.0807","","","","","","1.04","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051898","14.425","0.003","11.625","0.002","18.247","0.004","90","","104.28","0.03","90","","2965.3","1.1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H48 N3 Tl -","- C31 H48 N3 Tl -","- C124 H192 N12 Tl4 -","4","1","","Jin, Guoxia; Jones, Cameron; Junk, Peter C.; Stasch, Andreas; Woodul, William D.","Group 13 metal(i) and (ii) guanidinate complexes: effect of ligand backbone on metal oxidation state and coordination sphere","New Journal of Chemistry","2008","32","5","835","","10.1039/b718799h","","","0.71073","MoKα","","0.0348","0.0269","","","0.0549","0.0575","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051899","13.7015","0.0008","14.3052","0.0015","32.13","0.004","90","","95.576","0.008","90","","6267.8","1.1","100","2","100","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C187 H116 N8 Ni2 -","- C187 H116 N8 Ni2 -","- C374 H232 N16 Ni4 -","2","1","","Norret, Marck; Makha, Mohamed; Sobolev, Alexandre N.; Raston, Colin L.","Controlling the confinement of fullerene C60 molecules using a saddle shape Ni(ii) macrocycle","New Journal of Chemistry","2008","32","5","808","","10.1039/b718937k","","","0.71073","MoKα","","0.1167","0.0671","","","0.1531","0.1736","","","","","","1.042","","","","has coordinates","180072","2020-10-21","18:00:00",""
"7051900","7.9746","0.0016","24.528","0.007","20.765","0.004","90","","92.928","0.016","90","","4056.4","1.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C53 H46 N4 Ni -","- C53 H46 N4 Ni -","- C212 H184 N16 Ni4 -","4","1","","Norret, Marck; Makha, Mohamed; Sobolev, Alexandre N.; Raston, Colin L.","Controlling the confinement of fullerene C60 molecules using a saddle shape Ni(ii) macrocycle","New Journal of Chemistry","2008","32","5","808","","10.1039/b718937k","","","0.71073","MoKα","","0.1207","0.0721","","","0.1934","0.2301","","","","","","1.001","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051901","6.793","0.002","11.479","0.005","11.615","0.004","117.05","0.04","93.32","0.03","105.24","0.03","761.5","0.6","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H20 N4 O5 -","- C13 H20 N4 O5 -","- C26 H40 N8 O10 -","2","1","","Formica, Mauro; Fusi, Vieri; Macedi, Eleonora; Paoli, Paola; Piersanti, Giovanni; Rossi, Patrizia; Zappia, Giovanni; Orlando, Pierfrancesco","New branched macrocyclic ligand and its side-arm, two urea-based receptors for anions: synthesis, binding studies and crystal structure","New Journal of Chemistry","2008","32","7","1204","","10.1039/b719342d","","","0.71073","MoKα","","0.0949","0.0454","","","0.0988","0.1087","","","","","","0.818","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051902","11.0581","0.0003","13.2036","0.0003","18.3085","0.0005","99.027","0.001","104.128","0.001","102.882","0.001","2463.12","0.11","100","2","100","2","","","","","","","synthesized","5","P -1","-P 1","2","","","","- C27 H30 Cl N3 O4 -","- C27 H30 Cl N3 O4 -","- C108 H120 Cl4 N12 O16 -","4","2","","Gassensmith, Jeremiah J.; Lee, Jung-Jae; Noll, Bruce C.; Smith, Bradley D.","Crossing the threshold from accelerated substitution to elimination with a bifunctional macrocycle","New Journal of Chemistry","2008","32","5","843","","10.1039/b719658j","","x-ray","0.71073","MoKα","","0.0744","0.0639","","","0.1718","0.1765","","","","","","1.109","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051903","15.4637","0.0011","12.5622","0.0009","14.7103","0.0011","90","","90.469","0.001","90","","2857.5","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[C2mim]3[PrCl6]","","","- C18 H33 Cl6 N6 Pr -","- C18 H33 Cl6 N6 Pr -","- C72 H132 Cl24 N24 Pr4 -","4","1","","Hines, C. Corey; Cordes, David B.; Griffin, Scott T.; Watts, Savannah I.; Cocalia, Violina A.; Rogers, Robin D.","Flexible coordination environments of lanthanide complexes grown from chloride-based ionic liquids","New Journal of Chemistry","2008","32","5","872","","10.1039/b800045j","","","0.71073","MoKα","","0.078","0.0409","","","0.0569","0.0637","","","","","","1.059","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051904","15.459","0.0012","12.5543","0.001","14.7119","0.0011","90","","90.499","0.002","90","","2855.1","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[C2mim]3[NdCl6]","","","- C18 H33 Cl6 N6 Nd -","- C18 H33 Cl6 N6 Nd -","- C72 H132 Cl24 N24 Nd4 -","4","1","","Hines, C. Corey; Cordes, David B.; Griffin, Scott T.; Watts, Savannah I.; Cocalia, Violina A.; Rogers, Robin D.","Flexible coordination environments of lanthanide complexes grown from chloride-based ionic liquids","New Journal of Chemistry","2008","32","5","872","","10.1039/b800045j","","","0.71073","MoKα","","0.0544","0.0272","","","0.0483","0.0539","","","","","","1.011","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051905","15.4235","0.001","12.5234","0.0008","14.6633","0.001","90","","90.507","0.001","90","","2832.2","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[C2mim]3[SmCl6]","","","- C18 H33 Cl6 N6 Sm -","- C18 H33 Cl6 N6 Sm -","- C72 H132 Cl24 N24 Sm4 -","4","1","","Hines, C. Corey; Cordes, David B.; Griffin, Scott T.; Watts, Savannah I.; Cocalia, Violina A.; Rogers, Robin D.","Flexible coordination environments of lanthanide complexes grown from chloride-based ionic liquids","New Journal of Chemistry","2008","32","5","872","","10.1039/b800045j","","","0.71073","MoKα","","0.0695","0.0327","","","0.0521","0.0585","","","","","","1.013","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051906","15.4175","0.001","12.525","0.0008","14.6565","0.0009","90","","90.508","0.001","90","","2830.1","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[C2mim]3[EuCl6]","","","- C18 H33 Cl6 Eu N6 -","- C18 H33 Cl6 Eu N6 -","- C72 H132 Cl24 Eu4 N24 -","4","1","","Hines, C. Corey; Cordes, David B.; Griffin, Scott T.; Watts, Savannah I.; Cocalia, Violina A.; Rogers, Robin D.","Flexible coordination environments of lanthanide complexes grown from chloride-based ionic liquids","New Journal of Chemistry","2008","32","5","872","","10.1039/b800045j","","","0.71073","MoKα","","0.0584","0.0262","","","0.0447","0.0508","","","","","","0.997","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051907","15.4112","0.0011","12.5133","0.0009","14.6384","0.001","90","","90.501","0.001","90","","2822.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[C2mim]3[GdCl6]","","","- C18 H33 Cl6 Gd N6 -","- C18 H33 Cl6 Gd N6 -","- C72 H132 Cl24 Gd4 N24 -","4","1","","Hines, C. Corey; Cordes, David B.; Griffin, Scott T.; Watts, Savannah I.; Cocalia, Violina A.; Rogers, Robin D.","Flexible coordination environments of lanthanide complexes grown from chloride-based ionic liquids","New Journal of Chemistry","2008","32","5","872","","10.1039/b800045j","","","0.71073","MoKα","","0.0503","0.0275","","","0.0488","0.0547","","","","","","1.015","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051908","9.7573","0.0008","10.5481","0.0008","33.524","0.003","90","","91.571","0.001","90","","3449","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[C4mim][GdCl6]","","","- C24 H45 Cl6 Gd N6 -","- C24 H45 Cl6 Gd N6 -","- C96 H180 Cl24 Gd4 N24 -","4","1","","Hines, C. Corey; Cordes, David B.; Griffin, Scott T.; Watts, Savannah I.; Cocalia, Violina A.; Rogers, Robin D.","Flexible coordination environments of lanthanide complexes grown from chloride-based ionic liquids","New Journal of Chemistry","2008","32","5","872","","10.1039/b800045j","","","0.71073","MoKα","","0.0487","0.0313","","","0.0572","0.0605","","","","","","1.021","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051909","8.5556","0.0005","8.7213","0.0005","18.6748","0.0011","76.743","0.001","87.775","0.001","61.121","0.001","1183.4","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","(Gd(OH2)4)2([C2mim]Cl)","","","- C12 H30 Cl5 Gd N4 O4 -","- C12 H30 Cl5 Gd N4 O4 -","- C24 H60 Cl10 Gd2 N8 O8 -","2","1","","Hines, C. Corey; Cordes, David B.; Griffin, Scott T.; Watts, Savannah I.; Cocalia, Violina A.; Rogers, Robin D.","Flexible coordination environments of lanthanide complexes grown from chloride-based ionic liquids","New Journal of Chemistry","2008","32","5","872","","10.1039/b800045j","","","0.71073","MoKα","","0.0333","0.028","","","0.068","0.0701","","","","","","1.022","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051910","15.7823","0.0007","8.7508","0.0004","19.8826","0.0009","90","","90","","90","","2745.9","0.2","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C20 H12 N2 -","- C20 H12 N2 -","- C160 H96 N16 -","8","1","","Bazzini, Cristina; Caronna, Tullio; Fontana, Francesca; Macchi, Piero; Mele, Andrea; Natali Sora, Isabella; Panzeri, Walter; Sironi, Angelo","Synthesis, crystal structure and crystal packing of diaza[5]helicenes","New Journal of Chemistry","2008","32","10","1710","","10.1039/b800050f","","","0.71069","MoKα","","0.0833","0.0806","","","0.1721","0.1736","","","","","","1.303","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051911","18.4176","0.0019","13.8286","0.0014","11.2744","0.0012","90","","107.01","0.002","90","","2745.9","0.5","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 N2 -","- C20 H12 N2 -","- C160 H96 N16 -","8","2","","Bazzini, Cristina; Caronna, Tullio; Fontana, Francesca; Macchi, Piero; Mele, Andrea; Natali Sora, Isabella; Panzeri, Walter; Sironi, Angelo","Synthesis, crystal structure and crystal packing of diaza[5]helicenes","New Journal of Chemistry","2008","32","10","1710","","10.1039/b800050f","","","0.71069","MoKα","","0.1075","0.0486","","","0.1217","0.1489","","","","","","1.029","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051912","20.352","0.0006","9.0912","0.0003","7.54","0.0002","90","","92.28","0.001","90","","1393.98","0.07","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 N2 -","- C20 H12 N2 -","- C80 H48 N8 -","4","0.5","","Bazzini, Cristina; Caronna, Tullio; Fontana, Francesca; Macchi, Piero; Mele, Andrea; Natali Sora, Isabella; Panzeri, Walter; Sironi, Angelo","Synthesis, crystal structure and crystal packing of diaza[5]helicenes","New Journal of Chemistry","2008","32","10","1710","","10.1039/b800050f","","","0.71069","MoKα","","0.151","0.0553","","","0.1256","0.1768","","","","","","1.01","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051913","16.0623","0.0011","7.8336","0.0005","21.4841","0.0014","90","","90","","90","","2703.3","0.3","293","2","293","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C20 H12 N2 -","- C20 H12 N2 -","- C160 H96 N16 -","8","1","","Bazzini, Cristina; Caronna, Tullio; Fontana, Francesca; Macchi, Piero; Mele, Andrea; Natali Sora, Isabella; Panzeri, Walter; Sironi, Angelo","Synthesis, crystal structure and crystal packing of diaza[5]helicenes","New Journal of Chemistry","2008","32","10","1710","","10.1039/b800050f","","","0.71069","MoKα","","0.0583","0.0391","","","0.1028","0.1172","","","","","","1.017","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051914","13.9335","0.0019","5.8691","0.001","17.354","0.002","90","","104.734","0.003","90","","1372.5","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H12 N2 -","- C20 H12 N2 -","- C80 H48 N8 -","4","1","","Bazzini, Cristina; Caronna, Tullio; Fontana, Francesca; Macchi, Piero; Mele, Andrea; Natali Sora, Isabella; Panzeri, Walter; Sironi, Angelo","Synthesis, crystal structure and crystal packing of diaza[5]helicenes","New Journal of Chemistry","2008","32","10","1710","","10.1039/b800050f","","","0.71069","MoKα","","0.0763","0.0532","","","0.1353","0.1515","","","","","","1.131","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051915","9.957","0.003","22.606","0.006","6.2052","0.0016","90","","104.21","0.01","90","","1354","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H12 N2 -","- C20 H12 N2 -","- C80 H48 N8 -","4","1","","Bazzini, Cristina; Caronna, Tullio; Fontana, Francesca; Macchi, Piero; Mele, Andrea; Natali Sora, Isabella; Panzeri, Walter; Sironi, Angelo","Synthesis, crystal structure and crystal packing of diaza[5]helicenes","New Journal of Chemistry","2008","32","10","1710","","10.1039/b800050f","","","0.71069","MoKα","","0.1428","0.063","","","0.143","0.1845","","","","","","0.933","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051916","33.167","0.007","9.954","0.002","14.988","0.003","90","","110.91","0.03","90","","4622.3","1.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 4,4'-bipyridine - 1,2-bis(4-pyridyl)ethane","","- C25 H26 N3 O6 -","- C25 H26 N3 O6 -","- C200 H208 N24 O48 -","8","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.1025","0.053","","","0.1122","0.1425","","","","","","1.064","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051917","10.511","0.0014","11.9877","0.0015","19.72","0.003","90","","92.511","0.002","90","","2482.4","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethylene - 1,2-bis(4-pyridyl)ethane","","- C27 H28 N3 O6 -","- C27 H28 N3 O6 -","- C108 H112 N12 O24 -","4","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.1775","0.1154","","","0.2787","0.3229","","","","","","1.031","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051918","11.2591","0.0016","11.8962","0.0017","20.253","0.003","90","","95.554","0.003","90","","2700","0.7","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1-bromo-1,2-bis(4-pyridyl)ethylene - 1,2-dibromo-1,2-bis(4-pyridyl)ethane","","- C27 H26 Br2 N3 O6 -","- C27 H26 Br2 N3 O6 -","- C108 H104 Br8 N12 O24 -","4","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.0861","0.0475","","","0.1148","0.1316","","","","","","1.029","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051919","11.328","0.003","11.837","0.003","20.015","0.005","90","","94.448","0.004","90","","2675.7","1.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1-bromo-1,2-bis(4-pyridyl)ethylene - 1,2-dibromo-1,2-bis(4-pyridyl)ethane","","- C27 H29 Br1.18 N3 O6 -","- C27 H29 Br1.182 N3 O6 -","- C108 H116 Br4.728 N12 O24 -","4","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.1565","0.0648","","","0.1471","0.1816","","","","","","1.005","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051920","11.678","0.002","14.124","0.003","17.964","0.003","83.231","0.002","83.523","0.002","79.704","0.002","2882.2","0.9","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane","","- C63 H72 N7 O12 -","- C63 N7 O12 -","- C126 N14 O24 -","2","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.1956","0.1707","","","0.4327","0.4621","","","","","","1.856","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051921","5.711","0.0004","14.1003","0.001","18.396","0.0013","86.1","0.001","84.56","0.001","82.123","0.001","1458.51","0.18","100","2","373","2","","","","","","","","4","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - p-xylene","","- C32 H37 N3 O6 -","- C32 H37 N3 O6 -","- C64 H74 N6 O12 -","2","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.0722","0.0641","","","0.1637","0.1704","","","","","","1.04","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051922","5.6882","0.0007","14.0309","0.0018","18.39","0.002","85.767","0.002","84.034","0.002","81.877","0.002","1442.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - 1,4-dichlorobenzene","","- C31 H34 Cl N3 O6 -","- C31 H34 Cl N3 O6 -","- C62 H68 Cl2 N6 O12 -","2","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.064","0.0479","","","0.1046","0.1134","","","","","","1.034","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051923","5.7049","0.0006","14.0883","0.0016","18.287","0.002","85.834","0.002","82.96","0.002","82.027","0.002","1442.3","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - o-xylene","","- C64 H74 N6 O12 -","- C64 H74 N6 O12 -","- C64 H74 N6 O12 -","1","0.5","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.0754","0.0602","","","0.1391","0.1476","","","","","","1.072","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051924","5.7053","0.0005","14.1098","0.0013","18.266","0.0016","86.062","0.001","83.13","0.001","81.92","0.001","1443.4","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - o-chlorotoluene","","- C63 H71 Cl N6 O12 -","- C63 H71 Cl N6 O12 -","- C63 H71 Cl N6 O12 -","1","0.5","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.0637","0.0507","","","0.1283","0.1389","","","","","","1.042","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051925","5.6867","0.0003","14.0676","0.0008","18.3545","0.001","88.4","0.001","86.04","0.001","81.164","0.001","1447.21","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - o-dichlorobenzene","","- C31 H34 Cl N3 O6 -","- C31 H33.5 Cl N3 O6 -","- C62 H67 Cl2 N6 O12 -","2","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.0643","0.0579","","","0.1454","0.1509","","","","","","1.045","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051926","5.7484","0.0005","14.136","0.0012","18.1188","0.0015","85.758","0.001","83.817","0.001","81.574","0.001","1445.4","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - anisole","","- C63 H72 N6 O13 -","- C63 H72 N6 O13 -","- C63 H72 N6 O13 -","1","0.5","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.0586","0.0475","","","0.1171","0.1243","","","","","","1.033","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051927","5.7311","0.0006","18.4298","0.0018","27.577","0.003","94.3","0.002","91.509","0.002","94.623","0.002","2893.6","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","cis,cis-1,3,5-cyclohexanetricarboxylic acid - 1,2-bis(4-pyridyl)ethane - 1,4-bis(4-pyridyl)butane - benzylalcohol","","- C63 H72 N6 O13 -","- C65 H64.44 N6 O14 -","- C130 H128.88 N12 O28 -","2","1","","Bhogala, Balakrishna R.; Nangia, Ashwini","Ternary and quaternary co-crystals of 1,3-cis,5-cis-cyclohexanetricarboxylic acid and 4,4′-bipyridines","New Journal of Chemistry","2008","32","5","800","","10.1039/b800293b","","","0.71073","MoKα","","0.1612","0.1128","","","0.2937","0.3377","","","","","","1.034","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051928","13.6879","0.0004","14.8842","0.0003","20.1813","0.0005","76.265","0.001","74.578","0.002","78.055","0.001","3804.53","0.17","293","2","293","2","","","","","","","","7","P -1","-P 1","2","(EDT-TTFI2)4(Mo3S7Cl6)(CH3CN)","","","- C34 H19 Cl6 I8 Mo3 N S31 -","- C34 H19 Cl6 I8 Mo3 N S31 -","- C68 H38 Cl12 I16 Mo6 N2 S62 -","2","1","","Alberola, Antonio; Fourmigué, Marc; Gómez-García, Carlos J.; Llusar, Rosa; Triguero, Sonia","Halogen bonding interactions with the [Mo3S7Cl6]2− cluster anion in the mixed valence salt [EDT-TTFI2]4[Mo3S7Cl6]·CH3CN","New Journal of Chemistry","2008","32","7","1103","","10.1039/b800298c","","","0.71073","MoKα","","0.1671","0.0624","","","0.1542","0.2348","","","","","","0.922","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051929","9.0726","0.0013","7.3982","0.0011","22.319","0.003","90","","98.604","0.002","90","","1481.2","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","CCl85d23min","","","- C28 H28 Cl4 Cu2 N8 -","- C28 H28 Cl4 Cu2 N8 -","- C56 H56 Cl8 Cu4 N16 -","2","0.5","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.0665","0.0532","","","0.1098","0.1151","","","","","","1.114","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051930","17.992","0.003","7.671","0.0012","11.309","0.0018","90","","90","","90","","1560.8","0.4","100","2","100","2","","","","","","","","6","P n n m","-P 2 2n","58","work","","","- C30 H36 Cl2 Cu N8 O2 -","- C30 H36 Cl2 Cu N8 O2 -","- C60 H72 Cl4 Cu2 N16 O4 -","2","0.25","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.061","0.0453","","","0.0944","0.1002","","","","","","1.123","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051931","8.683","0.002","8.762","0.002","10.844","0.002","75.252","0.004","67.904","0.004","80.906","0.004","737.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","work","","","- C28 H32 Br2 Cu N8 O2 -","- C28 H32 Br2 Cu N8 O2 -","- C28 H32 Br2 Cu N8 O2 -","1","0.5","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.0853","0.0542","","","0.097","0.1063","","","","","","1.02","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051932","9.264","0.005","7.469","0.004","22.621","0.011","90","","98.926","0.009","90","","1546.3","1.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 Br4 Cu2 N8 -","- C28 H28 Br4 Cu2 N8 -","- C56 H56 Br8 Cu4 N16 -","2","0.5","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.0445","0.0344","","","0.0777","0.0818","","","","","","1.009","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051933","11.336","0.005","9.369","0.004","13.865","0.006","90","","103.089","0.008","90","","1434.3","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","work","","","- C28 H28 Cu N10 O6 -","- C28 H28 Cu N10 O6 -","- C56 H56 Cu2 N20 O12 -","2","0.5","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.0704","0.0536","","","0.1089","0.1156","","","","","","1.061","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051934","14.821","0.006","8.908","0.004","21.365","0.009","90","","93.632","0.008","90","","2815","2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","workdew","","","- C28 H28 Cu N10 O6 -","- C28 H28 Cu N10 O6 -","- C112 H112 Cu4 N40 O24 -","4","0.5","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.0962","0.0785","","","0.1485","0.1562","","","","","","1.177","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051935","8.7647","0.0014","10.8794","0.0017","16.984","0.003","89.797","0.003","89.368","0.003","84.603","0.003","1612.2","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","work","","","- C58 H70 Cu2 N18 O19 -","- C58 H70 Cu2 N18 O19 -","- C58 H70 Cu2 N18 O19 -","1","0.5","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.1396","0.0811","","","0.1743","0.2005","","","","","","1.012","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051936","9.841","0.004","8.311","0.003","21.919","0.008","90","","101.047","0.007","90","","1759.5","1.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","cNO3","","","- C14 H16 Cu N6 O7 -","- C14 H16 Cu N6 O7 -","- C56 H64 Cu4 N24 O28 -","4","1","","Dobrzańska, Liliana; Kleinhans, Dewald J.; Barbour, Leonard J.","Influence of the metal-to-ligand ratio on the formation of metal organic complexes","New Journal of Chemistry","2008","32","5","813","","10.1039/b800720a","","","0.71073","MoKα","","0.1086","0.0673","","","0.1313","0.148","","","","","","1.034","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051937","14.9066","0.0005","7.6269","0.0002","26.9624","0.001","90","","90","","90","","3065.39","0.17","150","2","150","2","","","","","","","synthesis as described","6","P b c n","-P 2n 2ab","60","","","","- C12 H10 N2 Ni O6 V2 -","- C12 H10 N2 Ni O6 V2 -","- C96 H80 N16 Ni8 O48 V16 -","8","1","","Fernández de Luis, Roberto; Mesa, José L.; Urtiaga, Miren K.; Lezama, Luis; Arriortua, María I.; Rojo, Teófilo","Topological description of a 3D self-catenated nickel hybrid vanadate Ni(bpe)(VO3)2. Thermal stability, spectroscopic and magnetic properties","New Journal of Chemistry","2008","32","9","1582","","10.1039/b800820e","","x-ray","0.71073","MoKα","","0.0569","0.0373","","","0.087","0.0917","","","","","","0.976","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051938","18.327","0.002","14.1537","0.0014","23.511","0.003","90","","96.263","0.006","90","","6062.2","1.2","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H26 B F4 N4 O3 Re -","- C34 H26 B F4 N4 O3 Re -","- C272 H208 B8 F32 N32 O24 Re8 -","8","2","","Mullice, Lucy A.; Laye, Rebecca H.; Harding, Lindsay P.; Buurma, Niklaas J.; Pope, Simon J. A.","Rhenium complexes of chromophore-appended dipicolylamine ligands: syntheses, spectroscopic properties, DNA binding and X-ray crystal structure","New Journal of Chemistry","2008","32","12","2140","","10.1039/b800999f","","","0.71073","MoKα","","0.0497","0.0285","","","0.0512","0.0572","","","","","","1.008","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051939","9.3471","0.0006","18.9283","0.0011","12.4791","0.0009","90","","101.718","0.008","90","","2161.8","0.3","213","2","213","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Copper(I) Dithionate bis(Acetonitrile) complex with 1,4-bi(pyridazin-4-yl)benzene","","- C18 H16 Cu2 N6 O6 S2 -","- C18 H16 Cu2 N6 O6 S2 -","- C72 H64 Cu8 N24 O24 S8 -","4","0.5","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.0351","0.0287","","","0.0729","0.0742","","","","","","0.968","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051940","12.5703","0.0009","13.7895","0.0013","14.1629","0.0012","94.203","0.011","93.205","0.011","107.835","0.01","2322.8","0.4","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","Copper(I) Tetrafluoroborate 4:5 complex with 1,4-bi(pyridazin-4-yl)benzene, solvate with 4 Chloroform","","- C74 H54 B4 Cl12 Cu4 F16 N20 -","- C74 H50 B4 Cl12 Cu4 F16 N20 -","- C74 H50 B4 Cl12 Cu4 F16 N20 -","1","0.5","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.0754","0.0553","","","0.1486","0.1548","","","","","","0.908","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051941","8.3964","0.0002","9.5399","0.0002","12.4383","0.0003","80.0473","0.001","82.901","0.002","64.952","0.0011","887.61","0.04","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Silver(I) nitrate 1:1 complex with 1,4-bi(pyridazin-4-yl)benzene, Chloroform solvate","","- C15 H11 Ag Cl3 N5 O3 -","- C15 H11 Ag Cl3 N5 O3 -","- C30 H22 Ag2 Cl6 N10 O6 -","2","1","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.0465","0.0347","","","0.0657","0.0703","","","","","","1.057","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051942","10.9059","0.001","11.1531","0.0011","13.8012","0.0013","92.62","0.011","108.916","0.011","117.522","0.01","1369.6","0.3","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","Silver(I) Trifluoroacetate 4:3 complex with 1,4-bi(pyridazin-4-yl)benzene, Acetonitrile solvate","","- C52 H33 Ag4 F12 N13 O8 -","- C52 H30 Ag4 F12 N13 O8 -","- C52 H30 Ag4 F12 N13 O8 -","1","0.5","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.0402","0.03","","","0.0744","0.0762","","","","","","0.889","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051943","5.5566","0.0007","10.5875","0.0013","15.419","0.002","72.987","0.01","84.721","0.011","82.058","0.011","857.82","0.19","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","Silver(I) Pentafluoropropionate 1:1 complex with 1,4-bi(pyridazin-4-yl)benzene","","- C17 H10 Ag F5 N4 O2 -","- C17 H10 Ag F5 N4 O2 -","- C34 H20 Ag2 F10 N8 O4 -","2","1","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.0465","0.0317","","","0.0701","0.0721","","","","","","0.85","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051944","19.3101","0.0019","17.3714","0.0015","18.1903","0.0015","90","","99.346","0.005","90","","6020.8","0.9","213","2","213","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Silver(I) Methanesulfonate 4:3 complex with 1,4-bi(pyridazin-4-yl)benzene, solvate with 2 Chloroform","","- C48 H44 Ag4 Cl6 N12 O12 S4 -","- C46 H39 Ag4 N12 O12 S4 -","- C184 H156 Ag16 N48 O48 S16 -","4","1","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.1191","0.0932","","","0.2418","0.2555","","","","","","1.088","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051945","7.2863","0.0003","14.3867","0.0006","12.2774","0.0005","90","","90.945","0.003","90","","1286.81","0.09","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Silver(I) Benzoate 2:1 complex with 1,4-bi(pyridazin-4-yl)benzene, Hydrate","","- C28 H24 Ag2 N4 O6 -","- C28 H24 Ag2 N4 O6 -","- C56 H48 Ag4 N8 O12 -","2","0.5","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.0479","0.033","","","0.0637","0.0688","","","","","","1.048","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051946","9.4238","0.0006","14.2038","0.0012","14.2032","0.001","104.457","0.008","98.14","0.008","108.924","0.009","1689.3","0.3","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","Silver(I) Isophthalate 1:1 complex with 1,4-bi(pyridazin-4-yl)benzene, Hydrate","","- C66 H62 Ag6 N12 O22 -","- C66 H54 Ag6 N12 O22 -","- C66 H54 Ag6 N12 O22 -","1","0.5","","Degtyarenko, Anna S.; Solntsev, Pavlo V.; Krautscheid, Harald; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.","Copper(i) and silver(i) coordination frameworks involving extended bipyridazine bridges","New Journal of Chemistry","2008","32","11","1910","","10.1039/b801231h","","","0.71073","MoKα","","0.0654","0.0489","","","0.1161","0.1198","","","","","","0.879","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051947","37.319","0.008","15.438","0.005","21.72","0.006","90","","115.7","0.1","90","","11276","11","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H45.5 Br5 Cl6 O12.25 -","- C48 H41 Br5 Cl6 O12.25 -","- C384 H328 Br40 Cl48 O98 -","8","1","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Su, Dian; Rohrs, Henry; Gross, Michael L.; Atwood, Jerry L.; Raston, Colin L.","Self-organised nano-arrays of p-phosphonic acid functionalised higher order calixarenes","New Journal of Chemistry","2008","32","9","1478","","10.1039/b801256c","","","0.71073","MoKα","","0.1294","0.071","","","0.16","0.188","","","","","","1.034","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051948","12.9938","0.0004","16.3618","0.0005","18.4136","0.0006","100.825","0.003","94.164","0.003","112.261","0.003","3513.7","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","P(O)(OEt)2-OAc-Calix(5)","","","- C65 H85 O25 P5 -","- C65 H85 O25 P5 -","- C130 H170 O50 P10 -","2","1","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Su, Dian; Rohrs, Henry; Gross, Michael L.; Atwood, Jerry L.; Raston, Colin L.","Self-organised nano-arrays of p-phosphonic acid functionalised higher order calixarenes","New Journal of Chemistry","2008","32","9","1478","","10.1039/b801256c","","","1.54178","CuKα","","0.1128","0.0731","","","0.1995","0.228","","","","","","1.008","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051949","11.347","0.002","12.878","0.002","13.849","0.002","112.802","0.002","98.427","0.002","110.792","0.002","1646.6","0.5","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C70 H62 Br6 O12 -","- C70 H62 Br6 O12 -","- C70 H62 Br6 O12 -","1","0.5","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Su, Dian; Rohrs, Henry; Gross, Michael L.; Atwood, Jerry L.; Raston, Colin L.","Self-organised nano-arrays of p-phosphonic acid functionalised higher order calixarenes","New Journal of Chemistry","2008","32","9","1478","","10.1039/b801256c","","","0.71073","MoKα","","0.072","0.0488","","","0.1251","0.1356","","","","","","1.008","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051950","15.701","0.002","15.946","0.002","20.01","0.002","72.218","0.002","85.667","0.002","80.292","0.002","4700.7","1","153","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C81.5 H108 O31 P6 -","- C81.5 H98 O31 P6 -","- C163 H196 O62 P12 -","2","1","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Su, Dian; Rohrs, Henry; Gross, Michael L.; Atwood, Jerry L.; Raston, Colin L.","Self-organised nano-arrays of p-phosphonic acid functionalised higher order calixarenes","New Journal of Chemistry","2008","32","9","1478","","10.1039/b801256c","","","0.71073","MoKα","","0.1752","0.1346","","","0.2911","0.312","","","","","","1.142","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051951","14.055","0.002","14.498","0.002","15.077","0.002","75.011","0.003","88.677","0.003","74.754","0.003","2859.9","0.7","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C104 H136 O40 P8 -","- C104 H136 O40 P8 -","- C104 H136 O40 P8 -","1","0.5","","Clark, Thomas E.; Makha, Mohamed; Sobolev, Alexandre N.; Su, Dian; Rohrs, Henry; Gross, Michael L.; Atwood, Jerry L.; Raston, Colin L.","Self-organised nano-arrays of p-phosphonic acid functionalised higher order calixarenes","New Journal of Chemistry","2008","32","9","1478","","10.1039/b801256c","","","0.71073","MoKα","","0.1308","0.0985","","","0.2717","0.3068","","","","","","1.05","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051952","37.1481","0.0005","11.0741","0.0002","10.5643","0.0002","90","","92.026","0.001","90","","4343.24","0.13","293","2","293","2","","","","","","","synthesis as described","8","C 1 2/c 1","-C 2yc","15","","","","- C24 H25 Au2 Br4 Cl3 N2 O2 S12 -","- C24 H22 Au2 Br4 Cl3 N2 O2 S12 -","- C96 H88 Au8 Br16 Cl12 N8 O8 S48 -","4","0.5","","Cauliez, Pascal; Mézière, Cécile; Auban-Senzier, Pascale; Clérac, Rodolphe; Fourmigué, Marc","Square-lattice hybrid organic‒inorganic conducting layers in the τ phase of a TTF tertiary amide derivative","New Journal of Chemistry","2008","32","9","1561","","10.1039/b801464g","","x-ray","0.71073","MoKα","","0.0523","0.0423","","","0.1213","0.1305","","","","","","1.07","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051953","13.1289","0.0015","19.649","0.003","22.054","0.003","110.835","0.002","98.568","0.002","104.848","0.002","4954.8","1.2","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C42.35 H46.35 Cl1.05 F6 O8 S6 -","- C42.35 H46 Cl1.05 F6 O8 S6 -","- C169.4 H184 Cl4.2 F24 O32 S24 -","4","2","","Habashneh, Almeqdad; Jablonski, Chester R.; Collins, Julie; Georghiou, Paris E.","Reactions of thiacalix[4]arene 1,3-bistriflate: formation of thiacalix[2]phenoxathiins—structural and complexation studies","New Journal of Chemistry","2008","32","9","1590","","10.1039/b801483c","","","0.7107","MoKα","","0.0944","0.0862","","","0.2452","0.255","","","","","","1.065","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051954","10.9907","0.0013","14.3416","0.0011","15.5658","0.0008","61.816","0.009","75.573","0.013","81.851","0.013","2093.6","0.4","138","2","138","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H47 F3 O5 S5 -","- C41 H47 F3 O5 S5 -","- C82 H94 F6 O10 S10 -","2","1","","Habashneh, Almeqdad; Jablonski, Chester R.; Collins, Julie; Georghiou, Paris E.","Reactions of thiacalix[4]arene 1,3-bistriflate: formation of thiacalix[2]phenoxathiins—structural and complexation studies","New Journal of Chemistry","2008","32","9","1590","","10.1039/b801483c","","","0.7107","MoKα","","0.0973","0.0865","","","0.2274","0.2403","","","","","","1.106","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051955","13.5552","0.0009","10.8734","0.0006","14.9307","0.001","90","","111.653","0.001","90","","2045.4","0.2","113","2","113","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C46 H50 O2 S4 -","- C46 H50 O2 S4 -","- C92 H100 O4 S8 -","2","1","","Habashneh, Almeqdad; Jablonski, Chester R.; Collins, Julie; Georghiou, Paris E.","Reactions of thiacalix[4]arene 1,3-bistriflate: formation of thiacalix[2]phenoxathiins—structural and complexation studies","New Journal of Chemistry","2008","32","9","1590","","10.1039/b801483c","","","0.7107","MoKα","","0.0391","0.0388","","","0.1028","0.1034","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051956","17.027","0.004","10.3137","0.0018","24.212","0.005","90","","117.24","0.006","90","","3780.4","1.4","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H12 O2 S4 -","- C24 H12 O2 S4 -","- C192 H96 O16 S32 -","8","2","","Habashneh, Almeqdad; Jablonski, Chester R.; Collins, Julie; Georghiou, Paris E.","Reactions of thiacalix[4]arene 1,3-bistriflate: formation of thiacalix[2]phenoxathiins—structural and complexation studies","New Journal of Chemistry","2008","32","9","1590","","10.1039/b801483c","","","0.7107","MoKα","","0.0544","0.0519","","","0.1231","0.1251","","","","","","1.176","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051957","12.49","0.003","16.513","0.002","21.792","0.004","90","","104.682","0.005","90","","4347.8","1.4","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H47 F3 O6 S5 -","- C41 H47 F3 O6 S5 -","- C164 H188 F12 O24 S20 -","4","1","","Habashneh, Almeqdad; Jablonski, Chester R.; Collins, Julie; Georghiou, Paris E.","Reactions of thiacalix[4]arene 1,3-bistriflate: formation of thiacalix[2]phenoxathiins—structural and complexation studies","New Journal of Chemistry","2008","32","9","1590","","10.1039/b801483c","","","0.7107","MoKα","","0.076","0.0695","","","0.193","0.1976","","","","","","1.079","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051958","7.553","0.001","8.305","0.002","10.514","0.002","68.89","0.02","80.78","0.01","75.12","0.02","592.9","0.2","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H11 N O4 -","- C15 H11 N O4 -","- C30 H22 N2 O8 -","2","1","","Altamura, Maria; Dapporto, Paolo; Guidi, Antonio; Harmat, Nicholas J. S.; Jierry, Loïc; Libralesso, Elisa; Paoli, Paola; Rossi, Patrizia","Investigation on the flexibility of chiral tricyclic derivatives","New Journal of Chemistry","2008","32","9","1617","","10.1039/b801569d","","","0.71069","MoKα","","0.0737","0.0416","","","0.0848","0.0943","","","","","","0.895","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051959","7.768","0.0009","11.736","0.001","14.923","0.002","90","","104.66","0.01","90","","1316.2","0.3","150","","150","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C15 H11 N O3 S -","- C15 H11 N O3 S -","- C60 H44 N4 O12 S4 -","4","1","","Altamura, Maria; Dapporto, Paolo; Guidi, Antonio; Harmat, Nicholas J. S.; Jierry, Loïc; Libralesso, Elisa; Paoli, Paola; Rossi, Patrizia","Investigation on the flexibility of chiral tricyclic derivatives","New Journal of Chemistry","2008","32","9","1617","","10.1039/b801569d","","","1.54018","","","0.1361","0.0555","","","0.1117","0.1194","","","","","","0.887","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051960","8.117","0.001","8.432","0.001","11.705","0.002","108.32","0.01","90.98","0.01","99.13","0.01","748.96","0.19","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H13 N O6 S -","- C15 H13 N O6 S -","- C30 H26 N2 O12 S2 -","2","1","","Altamura, Maria; Dapporto, Paolo; Guidi, Antonio; Harmat, Nicholas J. S.; Jierry, Loïc; Libralesso, Elisa; Paoli, Paola; Rossi, Patrizia","Investigation on the flexibility of chiral tricyclic derivatives","New Journal of Chemistry","2008","32","9","1617","","10.1039/b801569d","","","0.71069","MoKα","","0.0507","0.0415","","","0.1159","0.1249","","","","","","1.112","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051961","7.7913","0.0013","7.9556","0.0013","12.052","0.002","99.069","0.002","93.211","0.003","102.462","0.002","717.2","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H24 Cl Ga N2 O2 -","- C10 H24 Cl Ga N2 O2 -","- C20 H48 Cl2 Ga2 N4 O4 -","2","1","","Basharat, Siama; Knapp, Caroline E.; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A.","Synthesis and structures of gallium alkoxides","New Journal of Chemistry","2008","32","9","1513","","10.1039/b801579a","","","0.71073","MoKα","","0.0298","0.0264","","","0.0649","0.0662","","","","","","1.046","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7051962","8.4505","0.001","13.7024","0.0017","8.6396","0.0011","90","","113.648","0.002","90","","916.4","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H22 Cl4 Ga2 O4 -","- C10 H22 Cl4 Ga2 O4 -","- C20 H44 Cl8 Ga4 O8 -","2","0.5","","Basharat, Siama; Knapp, Caroline E.; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A.","Synthesis and structures of gallium alkoxides","New Journal of Chemistry","2008","32","9","1513","","10.1039/b801579a","","","0.71073","MoKα","","0.0325","0.0294","","","0.0818","0.0829","","","","","","1.062","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7051963","9.3818","0.0008","12.2919","0.001","10.7257","0.0009","90","","90","","90","","1236.89","0.18","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C8 H20 Cl Ga N2 O2 -","- C8 H20 Cl Ga N2 O2 -","- C32 H80 Cl4 Ga4 N8 O8 -","4","1","","Basharat, Siama; Knapp, Caroline E.; Carmalt, Claire J.; Barnett, Sarah A.; Tocher, Derek A.","Synthesis and structures of gallium alkoxides","New Journal of Chemistry","2008","32","9","1513","","10.1039/b801579a","","","0.71073","MoKα","","0.0292","0.0273","","","0.0628","0.0637","","","","","","1.115","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7051964","10.1997","0.0003","18.1058","0.0006","18.9884","0.0007","90","","96.489","0.002","90","","3484.2","0.2","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","ggban3","","","- C42 H41 Fe O P3 -","- C42 H41 Fe O P3 -","- C168 H164 Fe4 O4 P12 -","4","1","","Guilera, Gemma; McGrady, G. Sean; Steed, Jonathan W.; Burchell, Richard P. L.; Sirsch, Peter; Deeming, Anthony J.","Synthesis and characterisation of [(triphos)Fe(CO)H2] and its protonation to a dihydrogen complex via an unconventional hydrogen-bonded intermediate","New Journal of Chemistry","2008","32","9","1573","","10.1039/b801652f","","","0.71073","MoKα","","0.125","0.0588","","","0.0869","0.1057","","","","","","1.038","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051965","5.644","0.001","12.047","0.002","16.159","0.002","82.02","0.05","82.48","0.05","81.9","0.04","1070.2","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C27 H24 O2 -","- C27 H24 O2 -","- C54 H48 O4 -","2","1","","Olivier, Jean-Hubert; Camerel, Franck; Ziessel, Raymond; Retailleau, Pascal; Amadou, Julien; Pham-Huu, Cuong","Microwave-promoted hydrogenation and alkynylation reactions with palladium-loaded multi-walled carbon nanotubes","New Journal of Chemistry","2008","32","6","920","","10.1039/b802014k","","","0.7107","MoKα","","0.0718","0.0475","","","0.1244","0.1436","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051966","12.395","0.002","12.491","0.002","15.5","0.003","82.46","0.01","75.89","0.01","81.42","0.01","2290.1","0.7","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","2,2'-bis(Hydroxydiphenylmethyl)-1,1'-binaphthyl pyridine morpholine benzene clathrate","","- C61 H54 N2 O3 -","- C61 H54 N2 O3 -","- C122 H108 N4 O6 -","2","1","","Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin","Polymorphism, isostructurality and variability in the inclusion chemistry of a diol host compound","New Journal of Chemistry","2008","32","10","1702","","10.1039/b802269k","","","0.71073","MoKα","","0.16","0.1036","","","0.2694","0.3219","","","","","","1.017","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051967","4.1115","0.0004","14.688","0.001","17.247","0.002","90","","90","","90","","1041.54","0.17","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H7 Br O2 S2 -","- C10 H7 Br O2 S2 -","- C40 H28 Br4 O8 S8 -","4","1","","Hergué, Noémie; Leriche, Philippe; Blanchard, Philippe; Allain, Magali; Gallego-Planas, Nuria; Frère, Pierre; Roncali, Jean","Evidence for the contribution of sulfur‒bromine intramolecular interactions to the self-rigidification of thiophene-based π-conjugated systems","New Journal of Chemistry","2008","32","6","932","","10.1039/b802313a","","x-ray","0.71073","MoKα","","","0.0292","","","","0.0721","","","","","","0.978","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051968","20.59","0.006","13.4517","0.0008","14.543","0.001","90","","103.64","0.02","90","","3914.4","1.2","293","2","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 Cd Cl2 N5 O10 S8 -","- C26 H27 Cd Cl2 N5 O10 S8 -","- C104 H108 Cd4 Cl8 N20 O40 S32 -","4","1","","Benhaoua, Chahrazed; Mazari, Miloud; Mercier, Nicolas; Le Derf, Franck; Sallé, Marc","Electrochemical M2+ recognition by an amidopyridyl-tetrathiafulvalene derivative","New Journal of Chemistry","2008","32","6","913","","10.1039/b802726a","","x-ray","0.71073","MoKα","","","0.048","","","","0.1492","","","","","","1.02","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051969","15.289","0.0002","17.458","0.0002","18.783","0.0002","90","","90","","90","","5013.47","0.1","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C56 H68 N4 O8 -","- C56 H68 N4 O8 -","- C224 H272 N16 O32 -","4","1","","Stibor, Ivan; Budka, Jan; Michlová, Veronika; Tkadlecová, Marcela; Pojarová, Michaela; Cuřínová, Petra; Lhoták, Pavel","Systematic approach to new ligands for anion recognition based on ureido-calix[4]arenes","New Journal of Chemistry","2008","32","9","1597","","10.1039/b802871k","","","0.71073","MoKα","","0.0449","0.0397","","0.0524","0.0474","0.0474","","","","","","1.0463","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7051970","23.612","0.002","15.0618","0.0012","17.8456","0.0015","90","","128.492","0.002","90","","4967.4","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 N2 O8 -","- C27 H22 N2 O7 -","- C216 H176 N16 O56 -","8","1","","Santra, Ramkinkar; Ghosh, Nayan; Biradha, Kumar","Crystal engineering with acid and pyridine heteromeric synthon: neutral and ionic co-crystals","New Journal of Chemistry","2008","32","10","1673","","10.1039/b803280g","","","0.71073","MoKα","","0.1592","0.0637","","","0.1302","0.1565","","","","","","0.942","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051971","19.1296","0.0007","7.7639","0.0003","15.7687","0.0006","90","","98.138","0.001","90","","2318.39","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H22 N2 O7 -","- C27 H22 N2 O7 -","- C108 H88 N8 O28 -","4","1","","Santra, Ramkinkar; Ghosh, Nayan; Biradha, Kumar","Crystal engineering with acid and pyridine heteromeric synthon: neutral and ionic co-crystals","New Journal of Chemistry","2008","32","10","1673","","10.1039/b803280g","","","0.71073","MoKα","","0.0964","0.0504","","","0.1396","0.169","","","","","","1.022","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7051972","6.6119","0.0008","19.013","0.002","30.15","0.004","90","","92.3","0.004","90","","3787.2","0.8","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C45 H38 N4 O8 -","- C45 H38 N4 O8 -","- C180 H152 N16 O32 -","4","1","","Santra, Ramkinkar; Ghosh, Nayan; Biradha, Kumar","Crystal engineering with acid and pyridine heteromeric synthon: neutral and ionic co-crystals","New Journal of Chemistry","2008","32","10","1673","","10.1039/b803280g","","","0.71073","MoKα","","0.082","0.0507","","","0.1526","0.1718","","","","","","1.104","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051973","13.3963","0.0001","13.3963","0.0001","31.0233","0.0005","90","","90","","120","","4821.57","0.09","120","2","120","2","","","","","","","","4","P 31 2 1","P 31 2""","152","","","","- C32 H45 Cl O9 -","- C32 H45 Cl O9 -","- C192 H270 Cl6 O54 -","6","1","","Othman, Abdullah; Harris, Robin K.; Hodgkinson, Paul; Christopher, Elizabeth A.; Lancaster, Robert W.","Structural characterisation of two pharmaceutically important steroids by solid-state NMR","New Journal of Chemistry","2008","32","10","1796","","10.1039/b803586e","","","0.71073","Mo-Kα","","0.0545","0.0499","","","0.1354","0.1393","","","","","","1.027","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7051974","15.3449","0.0019","9.6588","0.0012","26.538","0.003","90","","106.19","0.002","90","","3777.3","0.8","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C40 H40 N12 O -","- C40 H40 N12 O -","- C160 H160 N48 O4 -","4","1","","Sanz, Dionisia; Claramunt, Rosa M.; Alkorta, Ibon; Elguero, José; Thiel, Werner R.; Rüffer, Tobias","A theoretical and experimental NMR study of the tautomerism of two phenylene-bis-C-substituted pyrazoles","New Journal of Chemistry","2008","32","12","2225","","10.1039/b803855d","","","0.71073","MoKα","","0.2399","0.0666","","","0.112","0.144","","","","","","0.801","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051975","10.4886","0.0011","12.8375","0.0013","15.7298","0.0017","90","","101.024","0.002","90","","2078.9","0.4","183","","183","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 N4 -","- C12 H10 N4 -","- C96 H80 N32 -","8","1","","Sanz, Dionisia; Claramunt, Rosa M.; Alkorta, Ibon; Elguero, José; Thiel, Werner R.; Rüffer, Tobias","A theoretical and experimental NMR study of the tautomerism of two phenylene-bis-C-substituted pyrazoles","New Journal of Chemistry","2008","32","12","2225","","10.1039/b803855d","","","0.71073","MoKα","","0.0602","0.0423","","","0.1141","0.1195","","","","","","1.056","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051976","24.605","0.006","14.569","0.004","10.318","0.003","90","","91.82","0.02","90","","3696.8","1.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C37 H45 N O12 -","- C37 H45 N O12 -","- C148 H180 N4 O48 -","4","2","","Bacchi, Alessia; Carcelli, Mauro; Pelizzi, Giancarlo","Sampling rifamycin conformational variety by cruising through crystal forms: implications for polymorph screening and for biological models","New Journal of Chemistry","2008","32","10","1725","","10.1039/b804746d","","","1.54178","CuKα","","0.105","0.059","","","0.1557","0.2013","","","","","","1.063","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051977","24.618","0.005","14.588","0.005","10.278","0.005","90","","92.48","0.05","90","","3688","2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C37 H45 N O12 -","- C37 H45 N O12 -","- C148 H180 N4 O48 -","4","2","","Bacchi, Alessia; Carcelli, Mauro; Pelizzi, Giancarlo","Sampling rifamycin conformational variety by cruising through crystal forms: implications for polymorph screening and for biological models","New Journal of Chemistry","2008","32","10","1725","","10.1039/b804746d","","","1.54178","CuKα","","0.1339","0.0579","","","0.119","0.1494","","","","","","0.873","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051978","11.764","0.005","15.876","0.005","12.222","0.005","90","","112.34","0.05","90","","2111.3","1.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H50 Cl3 N O14 -","- C38 H50 Cl3 N O14 -","- C76 H100 Cl6 N2 O28 -","2","1","","Bacchi, Alessia; Carcelli, Mauro; Pelizzi, Giancarlo","Sampling rifamycin conformational variety by cruising through crystal forms: implications for polymorph screening and for biological models","New Journal of Chemistry","2008","32","10","1725","","10.1039/b804746d","","","1.54178","CuKα","","0.1252","0.076","","","0.189","0.2529","","","","","","0.917","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051979","13.842","0.0008","19.863","0.001","16.721","0.001","90","","91.709","0.001","90","","4595.3","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C43 H59 N3 O15 -","- C43 H59 N3 O15 -","- C172 H236 N12 O60 -","4","2","","Bacchi, Alessia; Carcelli, Mauro; Pelizzi, Giancarlo","Sampling rifamycin conformational variety by cruising through crystal forms: implications for polymorph screening and for biological models","New Journal of Chemistry","2008","32","10","1725","","10.1039/b804746d","","","0.71073","MoKα","","0.068","0.0547","","","0.1426","0.1522","","","","","","1.034","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051980","10.306","0.0019","7.4208","0.0015","36.756","0.007","90","","93.601","0.003","90","","2805.5","0.9","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H11 B Cl F15 -","- C33 H11 B Cl F15 -","- C132 H44 B4 Cl4 F60 -","4","1","","Cordoneanu, Adina; Drewitt, Mark J.; Bavarian, Neda; Baird, Michael C.","Synthesis and characterization of weakly coordinating anion salts of a new, stable carbocationic reagent, the dibenzosuberenyl (dibenzotropylium) ion","New Journal of Chemistry","2008","32","11","1890","","10.1039/b804868a","","","0.71073","MoKα","","0.0556","0.0414","","","0.0989","0.1061","","","","","","1.073","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051981","12.512","0.005","13.248","0.006","14.052","0.006","81.676","0.007","82.635","0.008","76.977","0.008","2234.4","1.7","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H14 B2 F30 O2 -","- C51 H14 B2 F30 O2 -","- C102 H28 B4 F60 O4 -","2","1","","Cordoneanu, Adina; Drewitt, Mark J.; Bavarian, Neda; Baird, Michael C.","Synthesis and characterization of weakly coordinating anion salts of a new, stable carbocationic reagent, the dibenzosuberenyl (dibenzotropylium) ion","New Journal of Chemistry","2008","32","11","1890","","10.1039/b804868a","","","0.71073","MoKα","","0.2552","0.0672","","","0.0821","0.1069","","","","","","0.723","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051982","9.779","0.002","22.098","0.005","15.386","0.004","90","","96.055","0.004","90","","3306.3","1.3","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C39 H11 B F20 -","- C39 H11 B F20 -","- C156 H44 B4 F80 -","4","1","","Cordoneanu, Adina; Drewitt, Mark J.; Bavarian, Neda; Baird, Michael C.","Synthesis and characterization of weakly coordinating anion salts of a new, stable carbocationic reagent, the dibenzosuberenyl (dibenzotropylium) ion","New Journal of Chemistry","2008","32","11","1890","","10.1039/b804868a","","","0.71073","MoKα","","0.0521","0.0322","","","0.0741","0.0802","","","","","","0.979","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051983","14.582","0.004","4.5004","0.0013","15.507","0.005","90","","107.569","0.004","90","","970.2","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","triiodophloroglucinol","triiodophloroglucinol","","- C6 H3 I3 O3 -","- C6 I3 O3 -","- C24 I12 O12 -","4","1","","Nath, Naba K.; Saha, Binoy K.; Nangia, Ashwini","Isostructural polymorphs of triiodophloroglucinol and triiodoresorcinol","New Journal of Chemistry","2008","32","10","1693","","10.1039/b804905j","","","0.71073","MoKα","","0.0544","0.0488","","","0.1115","0.1143","","","","","","1.187","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051984","4.6376","0.0004","13.5291","0.0011","15.3446","0.0012","90","","90","","90","","962.76","0.14","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","triiododphlorogluicinol","triiododphlorogluicinol","","- C6 H3 I3 O3 -","- C6 I3 O3 -","- C24 I12 O12 -","4","1","","Nath, Naba K.; Saha, Binoy K.; Nangia, Ashwini","Isostructural polymorphs of triiodophloroglucinol and triiodoresorcinol","New Journal of Chemistry","2008","32","10","1693","","10.1039/b804905j","","","0.71073","MoKα","","0.0242","0.0241","","","0.0602","0.0603","","","","","","1.108","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051985","4.3695","0.0005","14.694","0.0015","14.1839","0.0015","90","","90","","90","","910.68","0.17","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","triiodophenol","triiodophenol","","- C6 H3 I3 O -","- C6 H2 I3 O -","- C24 H8 I12 O4 -","4","1","","Nath, Naba K.; Saha, Binoy K.; Nangia, Ashwini","Isostructural polymorphs of triiodophloroglucinol and triiodoresorcinol","New Journal of Chemistry","2008","32","10","1693","","10.1039/b804905j","","","0.71073","MoKα","","0.0292","0.029","","","0.07","0.0701","","","","","","1.126","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7051986","4.4419","0.0003","14.3683","0.0009","14.573","0.0009","90","","90","","90","","930.09","0.1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","triiodophenol, triiodoresorcinol","triiodophenol, triiodoresorcinol","","- C6 H3 I3 O1.5 -","- C6 I3 O1.523 -","- C24 I12 O6.092 -","4","1","","Nath, Naba K.; Saha, Binoy K.; Nangia, Ashwini","Isostructural polymorphs of triiodophloroglucinol and triiodoresorcinol","New Journal of Chemistry","2008","32","10","1693","","10.1039/b804905j","","","0.71073","MoKα","","0.0217","0.0215","","","0.0535","0.0536","","","","","","1.197","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051987","14.8819","0.001","4.3317","0.0003","15.5848","0.0011","90","","108.495","0.001","90","","952.77","0.11","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Triiodoresorcinol","Triiodoresorcinol","","- C6 H3 I3 O2 -","- C6 I3 O2.01 -","- C24 I12 O8.04 -","4","1","","Nath, Naba K.; Saha, Binoy K.; Nangia, Ashwini","Isostructural polymorphs of triiodophloroglucinol and triiodoresorcinol","New Journal of Chemistry","2008","32","10","1693","","10.1039/b804905j","","","0.71073","MoKα","","0.0283","0.0277","","","0.0696","0.07","","","","","","1.187","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051988","4.4949","0.0007","13.958","0.002","15.036","0.002","90","","90","","90","","943.4","0.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Triiodoresorcinol","Triiodoresorcinol","","- C6 H3 I3 O2 -","- C6 I3 O2 -","- C24 I12 O8 -","4","1","","Nath, Naba K.; Saha, Binoy K.; Nangia, Ashwini","Isostructural polymorphs of triiodophloroglucinol and triiodoresorcinol","New Journal of Chemistry","2008","32","10","1693","","10.1039/b804905j","","","0.71073","MoKα","","0.0605","0.0582","","","0.1346","0.1357","","","","","","1.256","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051989","4.5607","0.0003","13.6484","0.0008","15.3485","0.0009","90","","90","","90","","955.39","0.1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","triiodoresorcinol, triiodophloroglucinol","triiodoresorcinol, triiodophloroglucinol","","- C6 H3 I3 O2.5 -","- C6 I3 O2.521 -","- C24 I12 O10.084 -","4","1","","Nath, Naba K.; Saha, Binoy K.; Nangia, Ashwini","Isostructural polymorphs of triiodophloroglucinol and triiodoresorcinol","New Journal of Chemistry","2008","32","10","1693","","10.1039/b804905j","","","0.71073","MoKα","","0.0226","0.0225","","","0.0544","0.0544","","","","","","1.178","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051990","8.8645","0.0002","8.5149","0.0001","49.0253","0.0009","90","","90","","90","","3700.45","0.12","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(dodecylammonium)tetraiodoplumbate(II)","","- C24 H56 I4 N2 Pb -","- C24 H56 I4 N2 Pb -","- C96 H224 I16 N8 Pb4 -","4","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0661","0.0551","","","0.1323","0.1362","","","","","","1.292","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051991","8.6882","0.0006","9.0031","0.0006","23.8647","0.0016","90","","92.847","0.002","90","","1864.4","0.2","319","2","319","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(dodecylammonium)tetraiodoplumbate(II)","","- C24 H56 I4 N2 Pb -","- C24 H56 I4 N2 Pb -","- C48 H112 I8 N4 Pb2 -","2","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0513","0.0348","","","0.0913","0.0998","","","","","","0.937","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051992","8.8474","0.0001","8.5167","0.0001","54.1561","0.0007","90","","90","","90","","4080.7","0.08","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(tetradecylammonium)tetraiodoplumbate(II)","","- C28 H64 I4 N2 Pb -","- C28 H64 I4 N2 Pb -","- C112 H256 I16 N8 Pb4 -","4","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0678","0.054","","","0.111","0.1147","","","","","","1.252","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051993","8.6774","0.0016","9.0143","0.0019","26.412","0.006","90","","92.492","0.013","90","","2064","0.7","335","2","335","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(tetradecylammonium)tetraiodoplumbate(II)","","- C28 H64 I4 N2 Pb -","- C28 H64 I4 N2 Pb -","- C56 H128 I8 N4 Pb2 -","2","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0814","0.0531","","","0.1411","0.1586","","","","","","1.095","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051994","8.8167","0.0001","8.5222","0.0001","59.2906","0.0009","90","","90","","90","","4454.96","0.1","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(hexadecylammonium)tetraiodoplumbate(II)","","- C32 H72 I4 N2 Pb -","- C32 H72 I4 N2 Pb -","- C128 H288 I16 N8 Pb4 -","4","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0663","0.0519","","","0.1245","0.1292","","","","","","1.209","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051995","8.673","0.002","9.012","0.003","28.846","0.008","90","","91.816","0.006","90","","2253.5","1.1","341","2","341","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(hexadecylammonium)tetraiodoplumbate(II)","","- C32 H72 I4 N2 Pb -","- C32 H72 I4 N2 Pb -","- C64 H144 I8 N4 Pb2 -","2","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0639","0.04","","","0.1045","0.117","","","","","","0.999","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051996","8.7825","0.0001","8.5401","0.0001","64.4472","0.0011","90","","90","","90","","4833.76","0.11","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","bis(octadecylammonium)tetraiodoplumbate(II)","","- C36 H80 I4 N2 Pb -","- C36 H80 I4 N2 Pb -","- C144 H320 I16 N8 Pb4 -","4","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0737","0.0556","","","0.1281","0.1346","","","","","","1.141","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051997","8.6917","0.0009","9.0456","0.001","31.424","0.004","90","","91.586","0.008","90","","2469.7","0.5","348","2","348","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","bis(octadecylammonium)tetraiodoplumbate(II)","","- C36 H80 I4 N2 Pb -","- C36 H80 I4 N2 Pb -","- C72 H160 I8 N4 Pb2 -","2","0.5","","Billing, David G.; Lemmerer, Andreas","Synthesis, characterization and phase transitions of the inorganic‒organic layered perovskite-type hybrids [(CnH2n+1NH3)2PbI4] (n = 12, 14, 16 and 18)","New Journal of Chemistry","2008","32","10","1736","","10.1039/b805417g","","","0.71073","MoKα","","0.0835","0.0412","","","0.0952","0.1085","","","","","","0.895","","","","has coordinates","180073","2020-10-21","18:00:00",""
"7051998","7.421","0.004","7.71","0.004","42.2","0.002","90","","90","","90","","2414.5","1.8","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","aprepitant, form I","","","- C23 H21 F7 N4 O3 -","- C23 H21 F7 N4 O3 -","- C92 H84 F28 N16 O12 -","4","1","","Braun, Doris E.; Gelbrich, Thomas; Kahlenberg, Volker; Laus, Gerhard; Wieser, Josef; Griesser, Ulrich J.","Packing polymorphism of a conformationally flexible molecule (aprepitant)","New Journal of Chemistry","2008","32","10","1677","","10.1039/b805438j","","","0.71073","MoKα","","0.0532","0.0482","","","0.1325","0.1389","","","","","","1.184","","","","has coordinates,has disorder","180073","2020-10-21","18:00:00",""
"7051999","7.7768","0.0016","7.4072","0.0011","21.297","0.005","90","","92.861","0.017","90","","1225.3","0.4","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","aprepitant, form II","","","- C23 H21 F7 N4 O3 -","- C23 H21 F7 N4 O3 -","- C46 H42 F14 N8 O6 -","2","1","","Braun, Doris E.; Gelbrich, Thomas; Kahlenberg, Volker; Laus, Gerhard; Wieser, Josef; Griesser, Ulrich J.","Packing polymorphism of a conformationally flexible molecule (aprepitant)","New Journal of Chemistry","2008","32","10","1677","","10.1039/b805438j","","","0.71069","MoKα","","0.1165","0.0903","","","0.1775","0.1911","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052000","9.579","0.003","11.979","0.004","12.141","0.004","91.773","0.004","102.912","0.004","110.758","0.002","1260.5","0.7","103","2","103","2","","","","","","","","4","P -1","-P 1","2","1 Se2S2","","","- C32 H22 S2 Se2 -","- C32 H22 S2 Se2 -","- C64 H44 S4 Se4 -","2","1","","Nakanishi, Waro; Hayashi, Satoko; Morinaka, Sayuri; Sasamori, Takahiro; Tokitoh, Norihiro","Extended hypervalent E′⋯E‒E⋯E′ 4c‒6e (E, E′ = Se, S) interactions: structure, stability and reactivity of 1-(8-PhE′C10H6)EE(C10H6E′Ph-8′)-1′","New Journal of Chemistry","2008","32","11","1881","","10.1039/b805678a","","","0.7107","MoKα","","0.0223","0.0204","","","0.0526","0.0532","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052001","25.3639","0.0005","11.9664","0.0004","19.4789","0.0006","90","","118.995","0.0012","90","","5171.1","0.3","103","2","103","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2_S2Se2","","","- C32 H22 S2 Se2 -","- C32 H22 S2 Se2 -","- C256 H176 S16 Se16 -","8","1","","Nakanishi, Waro; Hayashi, Satoko; Morinaka, Sayuri; Sasamori, Takahiro; Tokitoh, Norihiro","Extended hypervalent E′⋯E‒E⋯E′ 4c‒6e (E, E′ = Se, S) interactions: structure, stability and reactivity of 1-(8-PhE′C10H6)EE(C10H6E′Ph-8′)-1′","New Journal of Chemistry","2008","32","11","1881","","10.1039/b805678a","","","0.71069","MoKα","","0.0407","0.0263","","","0.0566","0.0603","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052002","16.8943","0.0003","7.2299","0.0001","14.9051","0.0002","90","","116.08","0.001","90","","1635.2","0.05","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","iodopentafluorobenzene-phenazine 1/1","iodopentafluorobenzene-phenazine 1/1","","- C18 H8 F5 I N2 -","- C18 H8 F5 I N2 -","- C72 H32 F20 I4 N8 -","4","1","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","A cocrystallisation-based strategy to construct isostructural solids","New Journal of Chemistry","2008","32","10","1776","","10.1039/b805816d","","","0.71073","MoKα","","0.0333","0.026","","","0.0554","0.0586","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052003","16.9525","0.0003","7.2187","0.0002","14.9464","0.0003","90","","116.246","0.001","90","","1640.5","0.06","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","iodopentafluorobenzene-acridine 1/1","iodopentafluorobenzene-acridine 1/1","","- C19 H9 F5 I N -","- C19 H9 F5 I N -","- C76 H36 F20 I4 N4 -","4","1","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","A cocrystallisation-based strategy to construct isostructural solids","New Journal of Chemistry","2008","32","10","1776","","10.1039/b805816d","","","0.71073","MoKα","","0.0295","0.0239","","","0.0565","0.0591","","","","","","1.027","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052004","17.0193","0.0007","7.2045","0.0002","14.7399","0.0003","90","","116.535","0.001","90","","1616.96","0.09","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","acridine-bromopentafluorobenzene 1/1","acridine-bromopentafluorobenzene 1/1","","- C19 H9 Br F5 N -","- C19 H9 Br F5 N -","- C76 H36 Br4 F20 N4 -","4","1","","Cinčić, Dominik; Friščić, Tomislav; Jones, William","A cocrystallisation-based strategy to construct isostructural solids","New Journal of Chemistry","2008","32","10","1776","","10.1039/b805816d","","","0.71073","MoKα","","0.0547","0.0365","","","0.0906","0.0996","","","","","","0.995","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052005","11.4609","0.0003","11.4609","0.0003","15.4443","0.0009","90","","90","","120","","1756.86","0.12","90","","90","","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C6 H31.44 Cl3 Cr N6 O3.72 -","- C6 H24 Cl3 Cr N6 O3.721 -","- C24 H96 Cl12 Cr4 N24 O14.884 -","4","0.333333","","Takamizawa, Satoshi; Kohbara, Masa-aki; Akatsuka, Takamasa; Miyake, Ryosuke","Gas-adsorbing ability of tris-ethylenediamine metal complexes (M = Co(iii), Cr(iii), Rh(iii), Ir(iii)) as transformable ionic single crystal hosts","New Journal of Chemistry","2008","32","10","1782","","10.1039/b806467a","","","0.71073","MoKα","","0.0429","0.0396","","","0.126","0.1288","","","","","","1.178","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052006","10.9745","0.0016","10.9745","0.0016","15.421","0.003","90","","90","","120","","1608.5","0.5","90","","90","","","","","","","","","5","P -3 c 1","-P 3 2""c","165","","","","- C6 H24 Cl3 Cr N6 -","- C6 H24 Cl3 Cr N6 -","- C24 H96 Cl12 Cr4 N24 -","4","0.333333","","Takamizawa, Satoshi; Kohbara, Masa-aki; Akatsuka, Takamasa; Miyake, Ryosuke","Gas-adsorbing ability of tris-ethylenediamine metal complexes (M = Co(iii), Cr(iii), Rh(iii), Ir(iii)) as transformable ionic single crystal hosts","New Journal of Chemistry","2008","32","10","1782","","10.1039/b806467a","","","0.71073","MoKα","","0.0301","0.0273","","","0.0724","0.0736","","","","","","1.129","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052007","10.9593","0.0005","10.9593","0.0005","15.3981","0.0014","90","","90","","120","","1601.63","0.18","90","","90","","","","","","","","","5","P -3 c 1","-P 3 2""c","165","","","","- C6 H24 Cl3 N6 Rh -","- C6 H24 Cl3 N6 Rh -","- C24 H96 Cl12 N24 Rh4 -","4","0.333333","","Takamizawa, Satoshi; Kohbara, Masa-aki; Akatsuka, Takamasa; Miyake, Ryosuke","Gas-adsorbing ability of tris-ethylenediamine metal complexes (M = Co(iii), Cr(iii), Rh(iii), Ir(iii)) as transformable ionic single crystal hosts","New Journal of Chemistry","2008","32","10","1782","","10.1039/b806467a","","","0.71073","MoKα","","0.088","0.0823","","","0.1557","0.1582","","","","","","1.379","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052008","11.4083","0.0006","11.4083","0.0006","15.3968","0.0016","90","","90","","120","","1735.4","0.2","90","","90","","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C6 H30.74 Cl3 N6 O3.37 Rh -","- C6 H24 Cl3 N6 O3.37 Rh -","- C24 H96 Cl12 N24 O13.48 Rh4 -","4","0.333333","","Takamizawa, Satoshi; Kohbara, Masa-aki; Akatsuka, Takamasa; Miyake, Ryosuke","Gas-adsorbing ability of tris-ethylenediamine metal complexes (M = Co(iii), Cr(iii), Rh(iii), Ir(iii)) as transformable ionic single crystal hosts","New Journal of Chemistry","2008","32","10","1782","","10.1039/b806467a","","","0.71073","MoKα","","0.0678","0.046","","","0.1051","0.1134","","","","","","1.074","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052009","3.9193","0.0018","5.754","0.003","14.366","0.007","100.027","0.007","96.109","0.007","92.374","0.008","316.6","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","5-Ethyluracil","","- C6 H8 N2 O2 -","- C6 H8 N2 O2 -","- C12 H16 N4 O4 -","2","1","","Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L.","The observed and energetically feasible crystal structures of 5-substituted uracils","New Journal of Chemistry","2008","32","10","1761","","10.1039/b806763e","","","0.71073","MoKα","","0.0915","0.0609","","","0.1342","0.1453","","","","","","0.931","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7052010","9.0098","0.0018","6.6035","0.0013","9.1805","0.0018","90","","98.124","0.003","90","","540.72","0.19","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Cyanouracil","","- C5 H3 N3 O2 -","- C5 H3 N3 O2 -","- C20 H12 N12 O8 -","4","1","","Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L.","The observed and energetically feasible crystal structures of 5-substituted uracils","New Journal of Chemistry","2008","32","10","1761","","10.1039/b806763e","","","0.71073","MoKα","","0.0429","0.0398","","","0.1091","0.1121","","","","","","1.043","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7052011","7.046","0.0007","24.035","0.002","6.864","0.0007","90","","116.554","0.002","90","","1039.8","0.17","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","C4 H3 F N2 O2, C7 H5 N","5-Fluorouracil Benzonitrile solvate (1/1)","","- C11 H8 F N3 O2 -","- C11 H8 F N3 O2 -","- C44 H32 F4 N12 O8 -","4","1","","Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L.","The observed and energetically feasible crystal structures of 5-substituted uracils","New Journal of Chemistry","2008","32","10","1761","","10.1039/b806763e","","","0.71073","MoKα","","0.0418","0.0366","","","0.1069","0.1119","","","","","","1.052","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052012","6.827","0.004","6.111","0.003","8.424","0.004","90","","90.313","0.008","90","","351.4","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","C4 H3 F N2 O2 , C H3 N O","5-Fluorouracil Formaide solvate (1/1)","","- C5 H6 F N3 O3 -","- C5 H6 F N3 O3 -","- C10 H12 F2 N6 O6 -","2","0.5","","Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L.","The observed and energetically feasible crystal structures of 5-substituted uracils","New Journal of Chemistry","2008","32","10","1761","","10.1039/b806763e","","","0.71073","MoKα","","0.0476","0.0407","","","0.1061","0.1108","","","","","","1.096","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052013","8.4393","0.001","6.8412","0.0008","9.3679","0.0012","90","","104.201","0.002","90","","524.33","0.11","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Chlorouracil","","- C4 H3 Cl N2 O2 -","- C4 H3 Cl N2 O2 -","- C16 H12 Cl4 N8 O8 -","4","1","","Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L.","The observed and energetically feasible crystal structures of 5-substituted uracils","New Journal of Chemistry","2008","32","10","1761","","10.1039/b806763e","","","0.71073","MoKα","","0.035","0.033","","","0.092","0.0941","","","","","","1.066","","","","has coordinates,has disorder","211196","2020-10-21","18:00:00",""
"7052014","8.568","0.0011","6.8823","0.0009","9.5715","0.0012","90","","103.44","0.002","90","","548.95","0.12","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5-Bromouracil","","- C4 H3 Br N2 O2 -","- C4 H3 Br N2 O2 -","- C16 H12 Br4 N8 O8 -","4","1","","Barnett, Sarah A.; Hulme, Ashley T.; Issa, Nizar; Lewis, Thomas C.; Price, Louise S.; Tocher, Derek A.; Price, Sarah L.","The observed and energetically feasible crystal structures of 5-substituted uracils","New Journal of Chemistry","2008","32","10","1761","","10.1039/b806763e","","","0.71073","MoKα","","0.0283","0.0254","","","0.0623","0.063","","","","","","1.112","","","","has coordinates,has disorder","211196","2020-10-21","18:00:00",""
"7052015","14.0788","0.0016","16.3324","0.0017","14.8509","0.0017","90","","99.069","0.007","90","","3372.1","0.7","103","2","100","2","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","","","","- C40 H53 N3 -","- C40 H53 N3 -","- C160 H212 N12 -","4","1","","Zheng, Zhanjiang; Elmkaddem, Mohammed Kamal; Fischmeister, Cédric; Roisnel, Thierry; Thomas, Christophe M.; Carpentier, Jean-François; Renaud, Jean-Luc","Synthesis of new dipyridinylamine and dipyridinylmethane ligands and their coordination chemistry with Mg(ii) and Zn(ii)","New Journal of Chemistry","2008","32","12","2150","","10.1039/b807258b","","x-ray","0.71073","MoKα","","0.1183","0.0622","","","0.1286","0.153","","","","","","1.034","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052016","13.1083","0.0002","13.113","0.0003","20.455","0.0004","89.958","0.001","89.993","0.001","89.977","0.001","3515.99","0.12","100","2","100","2","","","","","","","synthesis as described","4","P 1","P 1","1","","","","- C36 H48 N6 Zn -","- C36 H48 N6 Zn -","- C144 H192 N24 Zn4 -","4","4","","Zheng, Zhanjiang; Elmkaddem, Mohammed Kamal; Fischmeister, Cédric; Roisnel, Thierry; Thomas, Christophe M.; Carpentier, Jean-François; Renaud, Jean-Luc","Synthesis of new dipyridinylamine and dipyridinylmethane ligands and their coordination chemistry with Mg(ii) and Zn(ii)","New Journal of Chemistry","2008","32","12","2150","","10.1039/b807258b","","x-ray","0.71073","MoKα","","0.0845","0.0737","","","0.1805","0.1852","","","","","","1.303","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052017","25.716","0.0019","9.9469","0.0012","15.7295","0.0014","90","","96.67","","90","","3996.3","0.7","100","2","100","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C40 H58 N6 Zn2 -","- C40 H58 N6 Zn2 -","- C160 H232 N24 Zn8 -","4","0.5","","Zheng, Zhanjiang; Elmkaddem, Mohammed Kamal; Fischmeister, Cédric; Roisnel, Thierry; Thomas, Christophe M.; Carpentier, Jean-François; Renaud, Jean-Luc","Synthesis of new dipyridinylamine and dipyridinylmethane ligands and their coordination chemistry with Mg(ii) and Zn(ii)","New Journal of Chemistry","2008","32","12","2150","","10.1039/b807258b","","x-ray","0.71073","MoKα","","0.0443","0.0331","","","0.0904","0.0983","","","","","","1.011","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052018","12.6647","0.0008","14.9762","0.0008","15.2718","0.001","74.519","0.005","83.036","0.005","68.151","0.006","2590.2","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H45 Ag2 Cl2 N16 O8.5 -","- C48 H44 Ag2 Cl2 N16 O8.5 -","- C96 H88 Ag4 Cl4 N32 O17 -","2","1","","De, Senjuti; Drew, Michael G. B.; Rzepa, Henry S.; Datta, Dipankar","Linking number analysis of a self-assembled lemniscular Möbius-metallamacrocycle","New Journal of Chemistry","2008","32","11","1831","","10.1039/b808269n","","","0.71073","MoKα","","0.1124","0.074","","","0.1432","0.1598","","","","","","1.096","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052019","9.5751","0.0002","24.2068","0.0004","7.0087","0.0001","90","","105.154","0.0008","90","","1568.01","0.05","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 Cl2 N3 O2 Pd -","- C16 H11 Cl2 N3 O2 Pd -","- C64 H44 Cl8 N12 O8 Pd4 -","4","1","","Budzisz, Elzbieta; Lorenz, Ingo-Peter; Mayer, Peter; Paneth, Piotr; Szatkowski, Lukasz; Krajewska, Urszula; Rozalski, Marek; Miernicka, Magdalena","Synthesis, crystal structure, theoretical calculation and cytotoxic effect of new Pt(ii), Pd(ii) and Cu(ii) complexes with pyridine-pyrazoles derivatives","New Journal of Chemistry","2008","32","12","2238","","10.1039/b808301k","","","0.71073","MoKα","","0.047","0.0295","","","0.0714","0.0782","","","","","","1.064","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052020","8.4188","0.0004","9.2762","0.0004","10.6495","0.0005","83.019","0.002","87.266","0.002","70.3459","0.0016","777.39","0.06","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H22 Cl4 Cu2 N6 O4 -","- C32 H22 Cl4 Cu2 N6 O4 -","- C32 H22 Cl4 Cu2 N6 O4 -","1","0.5","","Budzisz, Elzbieta; Lorenz, Ingo-Peter; Mayer, Peter; Paneth, Piotr; Szatkowski, Lukasz; Krajewska, Urszula; Rozalski, Marek; Miernicka, Magdalena","Synthesis, crystal structure, theoretical calculation and cytotoxic effect of new Pt(ii), Pd(ii) and Cu(ii) complexes with pyridine-pyrazoles derivatives","New Journal of Chemistry","2008","32","12","2238","","10.1039/b808301k","","","0.71073","MoKα","","0.0589","0.0397","","","0.0898","0.0956","","","","","","1.051","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052021","9.5059","0.0007","12.397","0.0009","14.7096","0.0011","90","","102.928","0.002","90","","1689.5","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 N O -","- C20 H23 N O -","- C80 H92 N4 O4 -","4","1","","Yuan, Ling; Sumpter, Bobby G.; Abboud, Khalil A.; Castellano, Ronald K.","Links between through-bond interactions and assembly structure in simple piperidones","New Journal of Chemistry","2008","32","11","1924","","10.1039/b808818g","","","0.71073","MoKα","","0.0696","0.0333","","","0.0668","0.0708","","","","","","0.787","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052022","15.1125","0.0012","5.5285","0.0004","23.3378","0.0018","90","","91.899","0.002","90","","1948.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H25 N O -","- C25 H25 N O -","- C100 H100 N4 O4 -","4","1","","Yuan, Ling; Sumpter, Bobby G.; Abboud, Khalil A.; Castellano, Ronald K.","Links between through-bond interactions and assembly structure in simple piperidones","New Journal of Chemistry","2008","32","11","1924","","10.1039/b808818g","","","0.71073","MoKα","","0.0662","0.0379","","","0.089","0.0939","","","","","","0.919","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052023","6.78","0.001","8.097","0.0008","19.707","0.0016","95.732","0.008","96.607","0.009","92.151","0.006","1068","0.2","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H20 N6 O9 -","- C18 H20 N6 O9 -","- C36 H40 N12 O18 -","2","1","","Hofmann, Katja; Schreiter, Katja; Seifert, Andreas; Rüffer, Tobias; Lang, Heinrich; Spange, Stefan","Solvatochromism and linear solvation energy relationship of diol- and proline-functionalized azo dyes using the Kamlet‒Taft and Catalán solvent parameter sets","New Journal of Chemistry","2008","32","12","2180","","10.1039/b809055f","","","1.54184","CuKα","","0.0487","0.0343","","","0.0852","0.0917","","","","","","0.941","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052024","17.986","0.003","18.145","0.003","20.583","0.004","83.817","0.003","64.575","0.003","76.418","0.003","5897","1.8","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C134.5 H168 O10 -","- C134.42 H155.97 O10 -","- C268.84 H311.94 O20 -","2","1","","Dalgarno, Scott J.; Thallapally, Praveen K.; Tian, Jian; Atwood, Jerry L.","Pseudo-polymorphism in the toluene solvate of p-tert-butylcalix[5]arene: structural and gas sorption investigation","New Journal of Chemistry","2008","32","12","2095","","10.1039/b809457h","","","0.71073","MoKα","","0.1561","0.0931","","","0.2466","0.2916","","","","","","1.052","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052025","13.392","0.003","13.86","0.003","18.433","0.004","92.014","0.004","108.769","0.004","107.867","0.004","3049","1.2","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C69 H86 O5 -","- C69.25 H78 O5 -","- C138.5 H156 O10 -","2","1","","Dalgarno, Scott J.; Thallapally, Praveen K.; Tian, Jian; Atwood, Jerry L.","Pseudo-polymorphism in the toluene solvate of p-tert-butylcalix[5]arene: structural and gas sorption investigation","New Journal of Chemistry","2008","32","12","2095","","10.1039/b809457h","","","0.71073","MoKα","","0.2977","0.115","","","0.2346","0.2927","","","","","","1.046","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052026","6.2135","0.0002","13.7443","0.0004","7.8355","0.0002","90","","106.172","0.002","90","","642.67","0.03","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","[C2mim][NMes2]","3-ethyl-1-methylimidazolium bis(methanesulfonyl)amide","","- C8 H17 N3 O4 S2 -","- C8 H17 N3 O4 S2 -","- C16 H34 N6 O8 S4 -","2","1","","Dean, Pamela M.; Pringle, Jennifer M.; Forsyth, Craig M.; Scott, Janet L.; MacFarlane, Douglas R.","Interactions in bisamide ionic liquids—insights from a Hirshfeld surface analysis of their crystalline states","New Journal of Chemistry","2008","32","12","2121","","10.1039/b809606f","","","0.71073","MoKα","","0.0256","0.0248","","","0.0614","0.062","","","","","","1.099","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052027","13.7961","0.0007","10.955","0.006","20.8776","0.001","90","","90","","90","","3155.4","1.7","123","2","123","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","[C4mpyr][NMes2]","1-butyl-1-methyl pyrrolidinium bis(methanesulfonyl)amide","","- C11 H26 N2 O4 S2 -","- C11 H26 N2 O4 S2 -","- C88 H208 N16 O32 S16 -","8","1","","Dean, Pamela M.; Pringle, Jennifer M.; Forsyth, Craig M.; Scott, Janet L.; MacFarlane, Douglas R.","Interactions in bisamide ionic liquids—insights from a Hirshfeld surface analysis of their crystalline states","New Journal of Chemistry","2008","32","12","2121","","10.1039/b809606f","","","0.71073","MoKα","","0.0463","0.0407","","","0.0967","0.1","","","","","","1.136","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052028","11.3889","0.001","19.1696","0.0017","29.359","0.003","90","","90","","90","","6409.7","1","123","2","123","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C41 H65.5 Eu N Na2 O37.75 S5 -","- C41 H32 Eu N Na2 O33.8 S5 -","- C164 H128 Eu4 N4 Na8 O135.2 S20 -","4","1","","Dalgarno, Scott J.; Warren, John E.; Atwood, Jerry L.; Raston, Colin L.","Versatility of p-sulfonatocalix[5]arene in building up multicomponent bilayers","New Journal of Chemistry","2008","32","12","2100","","10.1039/b810229e","","","0.6903","Synchrotron","","0.0742","0.0542","","","0.138","0.1521","","","","","","1.031","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052029","19.1391","0.0003","21.8802","0.0003","29.514","0.0005","90","","90","","90","","12359.5","0.3","150","2","150","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C82 H153 Eu2 N2 Na2 O79.5 S10 -","- C82 H64 Eu2 N2 Na O79.5 S10 -","- C328 H256 Eu8 N8 Na4 O318 S40 -","4","0.5","","Dalgarno, Scott J.; Warren, John E.; Atwood, Jerry L.; Raston, Colin L.","Versatility of p-sulfonatocalix[5]arene in building up multicomponent bilayers","New Journal of Chemistry","2008","32","12","2100","","10.1039/b810229e","","","0.71073","MoKα","","0.1044","0.0686","","","0.1802","0.2144","","","","","","1.038","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44",""
"7052030","30.0333","0.0004","19.4301","0.0003","21.3461","0.0007","90","","92.94","0.001","90","","12440.1","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H60 Eu N Na0.5 O40 S5 -","- C45 H33 Eu N2 O39.5 S5 -","- C360 H264 Eu8 N16 O316 S40 -","8","2","","Dalgarno, Scott J.; Warren, John E.; Atwood, Jerry L.; Raston, Colin L.","Versatility of p-sulfonatocalix[5]arene in building up multicomponent bilayers","New Journal of Chemistry","2008","32","12","2100","","10.1039/b810229e","","","0.71073","MoKα","","0.1377","0.1115","","","0.258","0.2776","","","","","","1.169","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44",""
"7052031","11.8372","0.0004","12.2645","0.0004","15.167","0.0006","106.721","0.002","111.948","0.002","91.773","0.002","1932.05","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H94 N6 O34 S6 -","- C66 H94 N6 O33.92 S6 -","- C66 H94 N6 O33.92 S6 -","1","0.5","","Lazar, Adina N.; Danylyuk, Oksana; Suwinska, Kinga; Kassab, Rima; Coleman, Anthony W.","Stepped layers in the complexes of para-sulfonatocalix[6]arene with dimethylammonium and bis-6-aminohexylammonium cations","New Journal of Chemistry","2008","32","12","2116","","10.1039/b811130h","","","0.71073","MoKα","","0.1549","0.1345","","","0.3957","0.4148","","","","","","1.848","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052032","12.2408","0.0005","12.442","0.0005","12.8054","0.0005","87.975","0.002","70.696","0.002","75.688","0.002","1781.19","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H92 N8 O26 S6 -","- C60 H92 N8 O26 S6 -","- C60 H92 N8 O26 S6 -","1","0.5","","Lazar, Adina N.; Danylyuk, Oksana; Suwinska, Kinga; Kassab, Rima; Coleman, Anthony W.","Stepped layers in the complexes of para-sulfonatocalix[6]arene with dimethylammonium and bis-6-aminohexylammonium cations","New Journal of Chemistry","2008","32","12","2116","","10.1039/b811130h","","","0.71073","MoKα","","0.0786","0.0648","","","0.1413","0.1472","","","","","","1.148","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052033","10.29","0.0005","14.2102","0.0011","22.7217","0.0018","78.549","0.013","82.282","0.014","79.978","0.013","3189.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","PyC8TOV.(1.5(H!2$O))","","","- C33 H38 Br N5 O3.5 -","- C33 H38 Br N5 O3.5 -","- C132 H152 Br4 N20 O14 -","4","2","","Suzuki, Kentaro; Matsushita, Michio M.; Hayashi, Hiroyuki; Koga, Noboru; Sugawara, Tadashi","Association-mediated chromism of amphiphilic triphenyl-6-oxoverdazyl","New Journal of Chemistry","2008","32","12","2201","","10.1039/b811207j","","","0.7107","MoKα","","0.1703","0.0623","","","0.1279","0.16","","","","","","0.96","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052034","31.6107","0.0011","11.2967","0.0003","17.4711","0.0006","90","","96.688","0.002","90","","6196.4","0.3","100","2","100","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H49 N5 O Zn -","- C31 H49 N5 O Zn -","- C248 H392 N40 O8 Zn8 -","8","1","","Zheng, Zhanjiang; Zhao, Gang; Fablet, Rémy; Bouyahyi, Miloud; Thomas, Christophe M.; Roisnel, Thierry; Casagrande Jr, Osvaldo; Carpentier, Jean-François","Zinc and enolato-magnesium complexes based on bi-, tri- and tetradentate aminophenolate ligands","New Journal of Chemistry","2008","32","12","2279","","10.1039/b812754a","","x-ray","0.71073","MoKα","","0.0686","0.0414","","","0.1072","0.1196","","","","","","1.035","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052035","11.7495","0.0004","14.5448","0.0005","14.7216","0.0005","62.3027","0.0017","88.2672","0.0017","67.8521","0.0017","2030.69","0.13","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C35 H62 N6 O Si2 Zn -","- C35 H62 N6 O Si2 Zn -","- C70 H124 N12 O2 Si4 Zn2 -","2","1","","Zheng, Zhanjiang; Zhao, Gang; Fablet, Rémy; Bouyahyi, Miloud; Thomas, Christophe M.; Roisnel, Thierry; Casagrande Jr, Osvaldo; Carpentier, Jean-François","Zinc and enolato-magnesium complexes based on bi-, tri- and tetradentate aminophenolate ligands","New Journal of Chemistry","2008","32","12","2279","","10.1039/b812754a","","x-ray","0.71073","MoKα","","0.0583","0.041","","","0.097","0.1059","","","","","","1.008","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052036","13.9651","0.0002","17.5917","0.0002","21.1494","0.0003","76.899","0.001","79.383","0.001","67.288","0.001","4640.99","0.11","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C30 H40 N2 O Zn -","- C30 H40 N2 O Zn -","- C180 H240 N12 O6 Zn6 -","6","3","","Zheng, Zhanjiang; Zhao, Gang; Fablet, Rémy; Bouyahyi, Miloud; Thomas, Christophe M.; Roisnel, Thierry; Casagrande Jr, Osvaldo; Carpentier, Jean-François","Zinc and enolato-magnesium complexes based on bi-, tri- and tetradentate aminophenolate ligands","New Journal of Chemistry","2008","32","12","2279","","10.1039/b812754a","","x-ray","0.71073","MoKα","","0.1535","0.0913","","","0.2698","0.2911","","","","","","1.06","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052037","15.2406","0.0008","10.5921","0.0006","48.038","0.003","90","","90","","90","","7754.8","0.8","100","2","100","2","","","","","","","synthesis as described","6","P c a 21","P 2c -2ac","29","","","","- C34 H53 N3 O Si2 Zn -","- C34 H53 N3 O Si2 Zn -","- C272 H424 N24 O8 Si16 Zn8 -","8","2","","Zheng, Zhanjiang; Zhao, Gang; Fablet, Rémy; Bouyahyi, Miloud; Thomas, Christophe M.; Roisnel, Thierry; Casagrande Jr, Osvaldo; Carpentier, Jean-François","Zinc and enolato-magnesium complexes based on bi-, tri- and tetradentate aminophenolate ligands","New Journal of Chemistry","2008","32","12","2279","","10.1039/b812754a","","x-ray","0.71073","MoKα","","0.1008","0.0843","","","0.2289","0.2364","","","","","","1.179","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052038","10.646","0.002","14.508","0.003","16.75","0.004","85.05","0.01","75.882","0.01","80.339","0.01","2470.6","0.9","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C58 H72 N2 O2 Zn -","- C58 H72 N2 O2 Zn -","- C116 H144 N4 O4 Zn2 -","2","1","","Zheng, Zhanjiang; Zhao, Gang; Fablet, Rémy; Bouyahyi, Miloud; Thomas, Christophe M.; Roisnel, Thierry; Casagrande Jr, Osvaldo; Carpentier, Jean-François","Zinc and enolato-magnesium complexes based on bi-, tri- and tetradentate aminophenolate ligands","New Journal of Chemistry","2008","32","12","2279","","10.1039/b812754a","","x-ray","0.71073","MoKα","","0.0582","0.0391","","","0.0831","0.0914","","","","","","1.012","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052039","10.4793","0.0006","22.4925","0.0013","15.5746","0.0009","90","","108.702","0.004","90","","3477.2","0.4","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H47 Mg N3 O2 -","- C38 H47 Mg N3 O2 -","- C152 H188 Mg4 N12 O8 -","4","1","","Zheng, Zhanjiang; Zhao, Gang; Fablet, Rémy; Bouyahyi, Miloud; Thomas, Christophe M.; Roisnel, Thierry; Casagrande Jr, Osvaldo; Carpentier, Jean-François","Zinc and enolato-magnesium complexes based on bi-, tri- and tetradentate aminophenolate ligands","New Journal of Chemistry","2008","32","12","2279","","10.1039/b812754a","","x-ray","0.71073","MoKα","","0.1053","0.0542","","","0.1196","0.1402","","","","","","1.012","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052040","18.795","0.0009","18.795","0.0009","29.9286","0.0019","90","","90","","90","","10572.3","1","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C23 H45 Ce0.5 Cl N2 Na0.5 -","- C368 H720 Ce8 Cl16 N32 Na8 -","16","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0628","0.0333","","","0.0715","0.0798","","","","","","0.914","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052041","12.6251","0.0013","15.995","0.0013","24.079","0.004","90","","100.451","0.016","90","","4781.8","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H78 Cl2 Na O4 Sm -","- C42 H78 Cl2 Na O4 Sm -","- C168 H312 Cl8 Na4 O16 Sm4 -","4","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0787","0.0373","","","0.0656","0.0735","","","","","","0.82","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052042","12.6235","0.0007","18.0143","0.001","35.025","0.003","90","","90","","90","","7964.8","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C37 H67 Al Cl Nd -","- C37 H67 Al Cl Nd -","- C296 H536 Al8 Cl8 Nd8 -","8","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0686","0.0411","","","0.0955","0.1048","","","","","","1.041","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052043","13.2826","0.0008","11.7557","0.0005","34.576","0.003","90","","97.344","0.008","90","","5354.6","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H45 Cl2 O2 Yb -","- C25 H45 Cl2 O2 Yb -","- C200 H360 Cl16 O16 Yb8 -","8","2","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0536","0.04","","","0.0789","0.0825","","","","","","0.984","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052044","16.2836","0.0011","16.2836","0.0011","16.2836","0.0011","109.604","0.007","109.604","0.007","109.604","0.007","3307.3","0.6","293","2","293","2","","","","","","","","5","R -3 :R","-P 3*","148","","","","- C40 H72 Cl2 O4 Yb2 -","- C40 H72 Cl2 O4 Yb2 -","- C120 H216 Cl6 O12 Yb6 -","3","0.5","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0483","0.0422","","","0.0842","0.0871","","","","","","1.114","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052045","11.7891","0.0006","15.4829","0.0008","18.5865","0.001","90","","95.586","0.006","90","","3376.5","0.3","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H58 I Tm -","- C34 H58 I Tm -","- C136 H232 I4 Tm4 -","4","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.038","0.0244","","","0.0483","0.0502","","","","","","0.885","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052046","8.8947","0.0006","13.8338","0.0007","10.3037","0.0008","90","","105.603","0.008","90","","1221.12","0.15","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H39 Cl2 O2 Tm -","- C21 H39 Cl2 O2 Tm -","- C42 H78 Cl4 O4 Tm2 -","2","1","","Marc D. Walter; Dirk Bentz; Frank Weber; Oliver Schmitt; Gotthelf Wolmershäuser; Helmut Sitzmann","Cation size dependent reactivity of lanthanide trihalides with bulky alkylcyclopentadienyl anions","New Journal of Chemistry","2007","31","2","305","","10.1039/b603701a","","","0.71073","MoKα","","0.0569","0.0367","","","0.0702","0.0745","","","","","","0.901","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052047","16.33","0.06","11.47","0.07","21.45","0.06","90","","103.8","0.2","90","","3902","3","298","2","298","2","","","","","","","Synthesis","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 Mo8 N4 O26 -","- C24 H28 Mo8 N4 O26 -","- C96 H112 Mo32 N16 O104 -","4","0.5","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.0617","0.0452","","","0.1153","0.128","","","","","","1.138","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052048","10.716","0.002","11.128","0.002","11.666","0.002","68.08","0.03","85.5","0.03","76.19","0.03","1253.2","0.5","298","2","298","2","","","","","","","Synthesis","5","P -1","-P 1","2","","","","- C18 H20 Mo4 N3 O13 -","- C18 H20 Mo4 N3 O13 -","- C36 H40 Mo8 N6 O26 -","2","1","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.0444","0.0351","","","0.0867","0.0918","","","","","","1.042","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052049","11.581","0.003","17.146","0.007","12.875","0.003","90","","101.447","0.016","90","","2505.7","1.4","298","2","298","2","","","","","","","Synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Mo8 N6 O26 -","- C36 H40 Mo8 N6 O26 -","- C72 H80 Mo16 N12 O52 -","2","0.5","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.082","0.0426","","","0.088","0.103","","","","","","1.041","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052050","9.6894","0.0017","13.447","0.003","15.341","0.002","90","","100.614","0.013","90","","1964.6","0.6","273","2","273","2","","","","","","","Synthesis","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 Mo4 N2 O13 -","- C12 H14 Mo4 N2 O13 -","- C48 H56 Mo16 N8 O52 -","4","1","","Reinaldo Atencio; Alexander Briceño; Pedro Silva; José A. Rodríguez; Jonathan C. Hanson","Sequential transformations in assemblies based on octamolybdate clusters and 1,2-bis(4-pyridyl)ethane","New Journal of Chemistry","2007","31","1","33","","10.1039/b603996k","","","0.71073","MoKα","","0.051","0.0382","","","0.0939","0.1009","","","","","","1.067","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052051","9.432","0.001","27.584","0.002","9.901","0.001","90","","114.26","0.01","90","","2348.5","0.4","208","2","208","2","","","","","","","","3","C 1 c 1","C -2yc","9","Cryptant-S6-Me2","Cryptant-S6-Me2","","- C19 H36 S6 -","- C19 H36 S6 -","- C76 H144 S24 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","1.54184","CuKα","","0.0957","0.0754","","","0.1989","0.2235","","","","","","0.931","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052052","10.396","0.001","15.421","0.002","18.421","0.005","90","","90","","90","","2953.2","0.9","208","2","208","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","S6-Ethylenecagesilver(i) trifluoromethylsulfonate","S6-Ethylenecagesilver(I) trifluoromethylsulfonate","","- C21 H38 Ag F3 O3 S7 -","- C21 H38 Ag F3 O3 S7 -","- C84 H152 Ag4 F12 O12 S28 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.141","0.0675","","","0.1353","0.1668","","","","","","1.029","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052053","21.614","0.008","13.491","0.002","18.364","0.008","90","","109.7","0.02","90","","5041","3","208","2","208","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","[Ag2(3-S6-cage-3-NO2)(triflat)2] x 2 AN","","","- C35 H60 Ag2 F6 N4 O10 S8 -","- C35 H60 Ag2 F6 N4 O10 S8 -","- C140 H240 Ag8 F24 N16 O40 S32 -","4","0.5","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.1007","0.0476","","","0.1055","0.1235","","","","","","1.005","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052054","18.186","0.004","26.587","0.004","10.255","0.002","90","","101.16","0.01","90","","4864.6","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-S6-Hydroxy cage","","- C19 H36 O S6 -","- C19 H36 O S6 -","- C152 H288 O8 S48 -","8","2","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","1.54184","CuKα","","0.0899","0.0552","","","0.1378","0.1604","","","","","","0.997","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052055","10.707","0.004","17.737","0.004","19.081","0.008","90","","103.61","0.02","90","","3522","2","208","2","208","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(S6-Cage-C4-OH-CH3)(tosylato)silver(I)] polymer","","- C29 H49 Ag O4 S7 -","- C29 H49 Ag O4 S7 -","- C116 H196 Ag4 O16 S28 -","4","1","","Alberto, Roger; Angst, Daniela; Ortner, Kirstin; Abram, Ulrich; Schubiger, P. August; Kaden, Thomas A.","Syntheses of a series of S6 thioether cages and their coordination chemistry with Ag+","New Journal of Chemistry","2007","31","3","409","","10.1039/b606510b","","","0.71073","MoKα","","0.3303","0.0776","","","0.0755","0.1173","","","","","","0.956","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052056","19.785","0.001","11.7253","0.0004","19.6134","0.0007","90","","90","","90","","4550","0.3","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C38 H78 N4 O7 Ti2 -","- C38 H78 N4 O7 Ti2 -","- C152 H312 N16 O28 Ti8 -","4","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.1033","0.0607","","","0.1248","0.141","","","","","","1.008","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052057","10.762","0.002","12.115","0.002","15.963","0.003","76.68","0.03","72.59","0.03","68.58","0.03","1831.5","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H68 N4 O4 Zr -","- C32 H68 N4 O4 Zr -","- C64 H136 N8 O8 Zr2 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.0458","0.0373","","","0.0851","0.0886","","","","","","1.032","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052058","11.019","0.0005","14.3144","0.0006","15.7604","0.0008","70.24","0.003","88.145","0.002","71.787","0.002","2214.83","0.18","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H76 N2 O8 Ti2 -","- C35 H76 N2 O8 Ti2 -","- C70 H152 N4 O16 Ti4 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71073","MoKα","","0.1451","0.0684","","","0.1524","0.1758","","","","","","1.002","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052059","8.83","0.005","9.726","0.005","17.047","0.005","93.801","0.005","98.098","0.005","112.844","0.005","1323.9","1.1","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H48 N2 O4 Ti -","- C22 H48 N2 O4 Ti -","- C44 H96 N4 O8 Ti2 -","2","1","","Day, Joanna K.; Baghurst, Rebecca E.; Strevens, Robert R.; Light, Mark E.; Hursthouse, Michael B.; Stengel, Bruno F.; Fallis, Ian A.; Aldridge, Simon","Influence of ligand backbone flexibility in group 4 metal complexes of tetradentate mixed tertiary amine/alkoxide ligands","New Journal of Chemistry","2007","31","1","135","","10.1039/b608680b","","","0.71069","MoKα","","0.0538","0.0416","","","0.0881","0.0932","","","","","","1.03","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052060","15.2741","0.0008","23.8114","0.0011","21.7021","0.0014","90","","91.297","0.002","90","","7891","0.8","173","0.1","173","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C76 H107.5 Cl0.5 N O32 -","- C76 H107.5 Cl0.5 N O32 -","- C304 H430 Cl2 N4 O128 -","4","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.2813","0.1489","","","0.2742","0.3258","","","","","","1.036","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052061","13.9176","0.0007","15.1093","0.0009","18.6526","0.001","90","","109.008","0.003","90","","3708.5","0.4","173","0.1","173","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H50 Cl N O14 -","- C37 H50 Cl N O14 -","- C148 H200 Cl4 N4 O56 -","4","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.1739","0.0837","","","0.1243","0.1549","","","","","","1.095","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052062","21.2275","0.0011","25.3429","0.0013","17.9561","0.0005","90","","122.883","0.002","90","","8112.1","0.7","173","0.1","173","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H58 Cl N O14 -","- C41 H58 Cl N O14 -","- C328 H464 Cl8 N8 O112 -","8","1","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.153","0.1021","","","0.2296","0.2541","","","","","","1.111","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052063","28.6719","0.0006","14.5214","0.0005","20.4197","0.0006","90","","131.685","0.002","90","","6349.3","0.4","173","0.1","173","0.1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C70 H82 O27 -","- C70 H82 O27 -","- C280 H328 O108 -","4","0.5","","Antti Åhman; Minna Luostarinen; Kari Rissanen; Maija Nissinen","Complexation of C-methyl pyrogallarene with small quaternary and tertiary alkyl ammonium cations","New Journal of Chemistry","2007","31","1","169","","10.1039/b609117b","","","0.71073","MoKα","","0.1509","0.0942","","","0.2198","0.2677","","","","","","1.111","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052064","33.824","0.008","10.759","0.003","23.446","0.006","90","","100.613","0.004","90","","8386","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32.5 H33.5 Br2 Cl10.5 N4 Ni -","- C32.5 H33 Br2 Cl9.75 N4 Ni -","- C260 H264 Br16 Cl78 N32 Ni8 -","8","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.2232","0.1088","","","0.2653","0.325","","","","","","0.893","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052065","10.3842","0.0007","16.8912","0.0011","17.4972","0.0012","90","","96.166","0.001","90","","3051.3","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H29 Cl5 N4 Zn -","- C29 H29 Cl5 N4 Zn -","- C116 H116 Cl20 N16 Zn4 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0471","0.0367","","","0.0884","0.0919","","","","","","0.974","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052066","10.0666","0.0012","17.26","0.002","16.987","0.002","90","","96.542","0.002","90","","2932.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 Cl2 Fe N5 -","- C30 H31 Cl2 Fe N5 -","- C120 H124 Cl8 Fe4 N20 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0497","0.0408","","","0.1039","0.1089","","","","","","1.045","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052067","10.089","0.003","17.124","0.005","16.991","0.005","90","","96.459","0.005","90","","2916.8","1.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 Cl2 Co N5 -","- C30 H31 Cl2 Co N5 -","- C120 H124 Cl8 Co4 N20 -","4","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0409","0.0336","","","0.092","0.0947","","","","","","1.036","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052068","10.2739","0.0019","10.5553","0.0019","12.623","0.002","94.301","0.003","101.922","0.003","96.325","0.003","1324.5","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H30 Cl2 N4 Zn -","- C29 H30 Cl2 N4 Zn -","- C58 H60 Cl4 N8 Zn2 -","2","1","","Yohan D. M. Champouret; Jean-Didier Maréchal; Rajinder K. Chaggar; John Fawcett; Kuldip Singh; Feliu Maseras; Gregory A. Solan","Factors affecting imine coordination in (iminoterpyridine)MX2 (M = Fe, Co, Ni, Zn): synthesis, structures, DFT calculations and ethylene oligomerisation studies","New Journal of Chemistry","2007","31","1","75","","10.1039/b610562a","","","0.71073","MoKα","","0.0567","0.044","","","0.1004","0.1055","","","","","","1.003","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052069","16.936","0.003","15.203","0.003","21.457","0.004","90","","90","","90","","5524.7","1.8","120","2","120","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C52 H58 Cl2 Fe4 N8 O18 -","- C52 H58 Cl2 Fe4 N8 O18 -","- C208 H232 Cl8 Fe16 N32 O72 -","4","0.5","","Sujit K. Dutta; Meenakshi Ghosh; Papu Biswas; Ulrich Flörke; Cristoph Saal; Wolfgang Haase; Kamalaksha Nag","Formation of oxo-bridged tetrairon(iii) complexes mediated by oxygen activation. Structure, spectroscopy, magnetism and electrochemistry","New Journal of Chemistry","2007","31","1","93","","10.1039/b610649h","","","0.71073","MoKα","","0.2755","0.0583","","","0.0876","0.1355","","","","","","0.733","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052070","21.958","0.004","15.182","0.003","19.591","0.004","90","","91.61","0.02","90","","6528","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C62 H62 Cl2 Fe4 N8 O18 -","- C62 H62 Cl2 Fe4 N8 O18 -","- C248 H248 Cl8 Fe16 N32 O72 -","4","0.5","","Sujit K. Dutta; Meenakshi Ghosh; Papu Biswas; Ulrich Flörke; Cristoph Saal; Wolfgang Haase; Kamalaksha Nag","Formation of oxo-bridged tetrairon(iii) complexes mediated by oxygen activation. Structure, spectroscopy, magnetism and electrochemistry","New Journal of Chemistry","2007","31","1","93","","10.1039/b610649h","","","0.71073","MoKα","","0.1307","0.0597","","","0.1212","0.1511","","","","","","1.012","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052071","7.8781","0.0002","12.7652","0.0003","12.8795","0.0003","91.972","0.005","102.869","0.005","92.2","0.005","1260.54","0.06","173","","173","","","","","","","","","3","P -1","-P 1","2","","","","- C31 H32 O5 -","- C31 H32 O5 -","- C62 H64 O10 -","2","1","","Sergio Andrés Pérez Guarìn; Derek Tsang; W. G. Skene","Spectroscopic studies of a fluorescent fluoresceinophane formed via a practical synthetic route","New Journal of Chemistry","2007","31","2","210","","10.1039/b611060f","","","0.71073","Mo-Kα","","0.12","0.047","","0.232","","0.064","","","3.963","","","1.083","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052072","7.2136","0.0009","7.6191","0.0008","8.101","0.0011","102.96","0.01","106.797","0.01","111.387","0.009","368.76","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3-Fluoro-2-formyl-phenylboronic acid","3-Fluoro-2-formyl-phenylboronic acid","","- C7 H6 B F O3 -","- C7 H6 B F O3 -","- C14 H12 B2 F2 O6 -","2","1","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.037","0.0327","","","0.0874","0.0907","","","","","","1.066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052073","7.0559","0.0016","8.3747","0.0018","9.656","0.002","89.986","0.017","99.607","0.018","108.329","0.017","533.2","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3,5-Dibromo-2-formyl-phenylboronic acid monohydrate","3,5-Dibromo-2-formyl-phenylboronic acid monohydrate","","- C7 H7 B Br2 O4 -","- C7 H7 B Br2 O4 -","- C14 H14 B2 Br4 O8 -","2","1","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.0327","0.0253","","","0.0622","0.0652","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052074","11.159","0.003","11.116","0.002","29.383","0.007","90","","94.473","0.018","90","","3633.7","1.5","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","1,3-Dihydro-1,3-dihydroxy-4-bromo-2,1-benzoxaborole monohydrate","","- C7 H8 B Br O4 -","- C7 H6 B Br O4 -","- C112 H96 B16 Br16 O64 -","16","4","","Sergiusz Luliński; Izabela Madura; Janusz Serwatowski; Halina Szatyłowicz; Janusz Zachara","A tautomeric equilibrium between functionalized 2-formylphenylboronic acids and corresponding 1,3-dihydro-1,3-dihydroxybenzo[c][2,1]oxaboroles","New Journal of Chemistry","2007","31","1","144","","10.1039/b611195e","","","0.71073","MoKα","","0.0809","0.0593","","","0.1481","0.1617","","","","","","1.04","","","","has coordinates,has disorder","180074","2020-10-21","18:00:00",""
"7052075","7.0108","0.0002","11.0338","0.0003","16.912","0.0004","93.637","0.001","95.736","0.001","95.729","0.001","1291.62","0.06","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H18 Ag F6 N3 O3 Sb -","- C24 H18 Ag F6 N3 O3 Sb -","- C48 H36 Ag2 F12 N6 O6 Sb2 -","2","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.0286","0.022","","","0.0542","0.057","","","","","","1.041","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052076","9.123","0.0006","11.624","0.0006","12.477","0.0009","62.419","0.002","83.793","0.002","83.386","0.005","1162.71","0.13","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H20 Ag As F6 N2 O4 -","- C20 H12 Ag As F6 N2 O4 -","- C40 H24 Ag2 As2 F12 N4 O8 -","2","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.1316","0.0658","","","0.1597","0.1903","","","","","","1.054","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052077","11.768","0.0002","25.757","0.0006","8.587","0.0004","90","","96.92","0.0009","90","","2583.83","0.14","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Ag As F6 N2 O5 -","- C22 H24 Ag As F6 N2 O5 -","- C88 H96 Ag4 As4 F24 N8 O20 -","4","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.1806","0.0508","","","0.0709","0.092","","","","","","0.975","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052078","11.964","0.0001","25.717","0.0004","8.632","0.0002","90","","97.078","0.0006","90","","2635.64","0.08","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Ag F6 N2 O5 Sb -","- C22 H24 Ag F6 N2 O5 Sb -","- C88 H96 Ag4 F24 N8 O20 Sb4 -","4","1","","Bourlier, Julien; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: generation of 1-D interdigitated and 2-D interwoven helical silver coordination networks by oligoethylene glycol based tectons bearing two benzonitrile moieties","New Journal of Chemistry","2007","31","1","25","","10.1039/b611415f","","","0.71073","MoKα","","0.0874","0.0464","","","0.1151","0.1321","","","","","","1.035","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052079","6.6026","0.0001","12.932","0.0002","15.1197","0.0003","90","","102.109","0.0009","90","","1262.27","0.04","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N3 O -","- C13 H17 N3 O -","- C52 H68 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0491","0.0421","","","0.1146","0.1211","","","","","","1.07","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052080","10.2904","0.0002","8.7167","0.0002","14.0155","0.0003","90","","100.932","0.0009","90","","1234.36","0.05","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 N4 O3 -","- C12 H14 N4 O3 -","- C48 H56 N16 O12 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0466","0.0396","","","0.1107","0.1169","","","","","","1.078","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052081","6.9786","0.0002","14.2655","0.0005","13.2947","0.0006","90","","101.364","0.001","90","","1297.58","0.08","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N3 O2 -","- C13 H17 N3 O2 -","- C52 H68 N12 O8 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0625","0.0454","","","0.1151","0.1256","","","","","","1.028","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052082","8.1028","0.0002","10.4312","0.0002","10.4731","0.0002","67.932","0.001","76.578","0.001","71.72","0.001","772.36","0.03","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H19 N3 O -","- C18 H19 N3 O -","- C36 H38 N6 O2 -","2","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0555","0.0432","","","0.1144","0.1242","","","","","","1.052","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052083","7.7167","0.0001","10.8913","0.0001","18.8973","0.0003","90","","90","","90","","1588.22","0.04","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H19 N3 O -","- C18 H19 N3 O -","- C72 H76 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.7107","MoKα","","0.0421","0.0368","","","0.0894","0.0932","","","","","","1.022","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052084","8.0995","0.0001","9.5542","0.0002","20.4491","0.0004","90","","98.2804","0.0008","90","","1565.94","0.05","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N4 O3 -","- C17 H16 N4 O3 -","- C68 H64 N16 O12 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.7107","MoKα","","0.0747","0.0493","","","0.1141","0.1316","","","","","","1.037","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052085","13.6403","0.0002","9.6489","0.0002","24.3685","0.0005","90","","90","","90","","3207.23","0.1","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H19 N3 O2 -","- C18 H19 N3 O2 -","- C144 H152 N24 O16 -","8","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0533","0.0391","","","0.0952","0.1026","","","","","","1.038","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052086","8.6915","0.0002","17.1912","0.0004","13.2188","0.0003","90","","101.066","0.001","90","","1938.39","0.08","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C84 H100 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0674","0.0519","","","0.1335","0.1487","","","","","","1.014","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052087","8.5205","0.0002","12.6244","0.0003","18.1441","0.0004","90","","90","","90","","1951.69","0.08","295","","295","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H25 N3 O -","- C21 H25 N3 O -","- C84 H100 N12 O4 -","4","1","","Petr Šimůnek; Markéta Svobodová; Valerio Bertolasi; Loretta Pretto; Antonín Lyčka; Vladimír Macháček","Structure and tautomerism of azo coupling products from N-alkylenaminones derived from acetylacetone and benzoylacetone in solid phase and in solution","New Journal of Chemistry","2007","31","3","429","","10.1039/b613346k","","","0.71073","MoKα","","0.0605","0.044","","","0.1106","0.1213","","","","","","1.019","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052088","8.3729","0.0006","14.6999","0.001","9.1764","0.0006","90","","98.917","0.002","90","","1115.79","0.13","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N4 O2 -","- C12 H10 N4 O2 -","- C48 H40 N16 O8 -","4","1","","Tzeng, Biing-Chiau; Chen, Yen-Fei; Wu, Chia-Chin; Hu, Cho-Chun; Chang, Ya-Ting; Chen, Chang-Kai","Anion-recognition studies of a Re(i)-based square containing the dipyridyl-amide ligand","New Journal of Chemistry","2007","31","2","202","","10.1039/b613508k","","","0.71073","MoKα","","0.0618","0.0487","","","0.1121","0.1193","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052089","6.2667","0.0009","8.5979","0.0012","19.959","0.003","83.907","0.002","89.471","0.002","77.551","0.002","1044.1","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C27 H26 O2 -","- C27 H26 O2 -","- C54 H52 O4 -","2","1","","Han, Jie; Li, Yan-Xia; Pang, Mei-Li; Cheng, Kai-Ge; Wang, Yan-Mei; Ma, Yu-Xin; Meng, Ji-Ben","A novel photochromic liquid crystal system based on biindenylidenedione derivatives","New Journal of Chemistry","2007","31","4","543","","10.1039/b613549h","","","0.71073","MoKα","","0.1149","0.0529","","","0.1342","0.1626","","","","","","1.019","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052090","32.142","0.006","6.2276","0.0012","11.413","0.002","90","","101.7","0.03","90","","2237","0.8","150","2","150","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C29 H26 O3 -","- C29 H26 O3 -","- C116 H104 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.1474","0.0876","","","0.1387","0.1579","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052091","6.001","0.0012","18.79","0.004","20.595","0.004","90","","90","","90","","2322.3","0.8","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H28 O3 -","- C30 H28 O3 -","- C120 H112 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0698","0.05","","","0.0901","0.096","","","","","","1.086","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052092","20.793","0.004","6.122","0.0012","20.961","0.004","90","","114.24","0.03","90","","2433","1","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C31 H30 O3 -","- C31 H30 O3 -","- C124 H120 O12 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.1077","0.0554","","","0.1081","0.1247","","","","","","1.014","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052093","5.7983","0.0012","9.0444","0.0018","15.82","0.003","94.69","0.03","100","0.03","106.81","0.03","774.4","0.3","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H18 O -","- C21 H18 O -","- C42 H36 O2 -","2","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0907","0.0594","","","0.128","0.1413","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052094","9.0898","0.0018","19.066","0.004","20.516","0.004","90","","95.84","0.03","90","","3537.1","1.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Ga3 I5 O4 -","- C28 H20 Ga3 I5 O4 -","- C112 H80 Ga12 I20 O16 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0607","0.0399","","","0.0878","0.0955","","","","","","1.049","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052095","7.4458","0.0015","18.197","0.004","12.271","0.003","90","","94.13","0.03","90","","1658.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 Ga I3 O2 -","- C11 H12 Ga I3 O2 -","- C44 H48 Ga4 I12 O8 -","4","1","","Green, Shaun P.; Jones, Cameron; Stasch, Andreas; Rose, Richard P.","?GaI?: A new reagent for chemo- and diastereoselective C?C bond forming reactions","New Journal of Chemistry","2007","31","1","127","","10.1039/b613669a","","","0.71073","MoKα","","0.0852","0.0533","","","0.1217","0.1356","","","","","","1.021","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052096","12.2707","0.0013","13.5989","0.0015","15.4906","0.0017","71.1","0.002","73.3","0.002","72.169","0.002","2276.7","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H46 N6 O6 -","- C56 H46 N6 O6 -","- C112 H92 N12 O12 -","2","1","","Anas, S.; Krishnan, K. Syam; Sajisha, V. Sanjayan; Anju, K. Sasidharan; Radhakrishnan, K. V.; Suresh, Eringathodi; Suresh, Cherumuttathu H.","Interplay of dual reactivity in the reaction of pentafulvenes with 1,2,4-triazoline-3,5-diones: experimental and theoretical investigations","New Journal of Chemistry","2007","31","2","237","","10.1039/b614533g","","","0.71073","MoKα","","0.1444","0.0738","","","0.1924","0.235","","","","","","1.025","","","","has coordinates","180074","2020-10-21","18:00:00",""
"7052097","9.75","0.002","10.216","0.002","11.647","0.002","64.72","0.03","84.92","0.03","76.29","0.03","1019","0.4","123","","123","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H30 La2 O30 S8 -","- C24 H30 La2 O30 S8 -","- C24 H30 La2 O30 S8 -","1","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.038","0.029","","0.035","","0.033","","","1.013","","","1.024","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052098","7.6971","0.0015","34.283","0.007","8.5201","0.0017","90","","111.43","0.03","90","","2092.8","0.8","123","","123","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Ho2 O34 S6 -","- C18 H44 Ho2 O34 S6 -","- C36 H88 Ho4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.031","0.023","","0.15","","0.035","","","1.451","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052099","7.6711","0.0005","34.174","0.002","8.5082","0.0005","90","","111.555","0.001","90","","2074.5","0.2","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Yb2 -","- C18 H44 O34 S6 Yb2 -","- C36 H88 O68 S12 Yb4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.038","0.036","","0.065","","0.065","","","0.987","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052100","7.256","0.0005","12.7526","0.0008","19.514","0.001","90","","90","","90","","1805.69","0.19","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C6 H20 Cl La O14 S2 -","- C6 H20 Cl La O14 S2 -","- C24 H80 Cl4 La4 O56 S8 -","4","1","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.024","0.023","","0.03","","0.03","","","1.304","","","1.306","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052101","8.6666","0.0005","14.2258","0.0006","19.4202","0.0007","103.476","0.001","98.679","0.001","100.967","0.001","2237.55","0.18","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H48.5 O36.25 S6 Sm2 -","- C18 H38 O36.25 S6 Sm2 -","- C36 H76 O72.5 S12 Sm4 -","2","1","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.037","0.025","","0.037","","0.035","","","1.152","","","1.229","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052102","7.7426","0.0005","34.467","0.003","8.5532","0.0005","90","","111.174","0.001","90","","2128.4","0.3","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Eu2 O34 S6 -","- C18 H44 Eu2 O34 S6 -","- C36 H88 Eu4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.042","0.03","","0.103","","0.06","","","1.777","","","1.092","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052103","7.7246","0.0004","34.366","0.002","8.5388","0.0004","90","","111.327","0.001","90","","2111.51","0.19","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Tb2 -","- C18 H44 O34 S6 Tb2 -","- C36 H88 O68 S12 Tb4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.044","0.035","","0.054","","0.051","","","1.236","","","1.249","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052104","7.6984","0.0004","34.311","0.002","8.5293","0.0005","90","","111.463","0.001","90","","2096.7","0.2","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 O34 S6 Y2 -","- C18 H44 O34 S6 Y2 -","- C36 H88 O68 S12 Y4 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.052","0.039","","0.052","","0.05","","","1.203","","","1.249","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052105","7.664","0.0007","34.161","0.003","8.5009","0.0008","90","","111.641","0.001","90","","2068.7","0.3","150","","150","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C18 H44 Lu2 O34 S6 -","- C18 H44 Lu2 O34 S6 -","- C36 H88 Lu4 O68 S12 -","2","0.5","","Deacon, Glen B.; Harika, Rita; Junk, Peter C.; Skelton, Brian W.; White, Allan H.","Structural versatility in hydrated rare earth(iii) 1,2-benzenedisulfonates","New Journal of Chemistry","2007","31","5","634","","10.1039/b614681c","","","0.71073","MoKα","","0.025","0.025","","0.023","","0.023","","","1.298","","","1.353","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052106","6.491","0.001","18.388","0.004","7.23","0.001","90","","112.18","0.03","90","","799.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","guanidinium hydrogen succinate","Guanidinium hydrogen butanedicarboxylate'","","- C5 H11 N3 O4 -","- C5 H11 N3 O4 -","- C20 H44 N12 O16 -","4","1","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","0.0669","0.06","","","0.1716","0.1796","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052107","3.696","0.003","18.824","0.005","5.496","0.002","90","","94.76","0.04","90","","381.1","0.4","297","","297","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","guanidinium hydrogen fumarate","guanidinium hydrogen E-butenedicarboxylate","","- C5 H9 N3 O4 -","- C5 H9 N3 O4 -","- C10 H18 N6 O8 -","2","0.5","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","","0.053","","","","0.067","","","","","","2.17","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052108","5.284","0.002","8.501","0.003","10.466","0.004","69.1","0.03","77.91","0.03","89.42","0.03","428.4","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","guanidinium hydrogen adipate","Guanidinium hydrogen pentanedicarboxylate","","- C6 H13 N3 O4 -","- C6 H13 N3 O4 -","- C12 H26 N6 O8 -","2","1","","Veneta Videnova-Adrabinska; Elżbieta Obara; Tadeusz Lis","Two-dimensional hydrogen-bonded networks in guanidinium hydrogen dicarboxylates","New Journal of Chemistry","2007","31","2","287","","10.1039/b614843c","","","0.71073","MoKα","","0.0346","0.0305","","","0.0783","0.0809","","","","","","1.075","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052109","10.602","0.0003","10.9717","0.0003","12.6859","0.0004","90","","99.022","0.002","90","","1457.39","0.07","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 N O2 -","- C19 H17 N O2 -","- C76 H68 N4 O8 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0538","0.0434","","","0.1209","0.1262","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052110","10.702","0.0007","10.9624","0.0007","12.5151","0.0008","90","","98.443","0.003","90","","1452.35","0.16","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N2 O4 -","- C38 H34 N2 O4 -","- C76 H68 N4 O8 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0864","0.0648","","","0.1466","0.1558","","","","","","1.07","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052111","7.034","0.0005","21.0718","0.0014","14.6964","0.001","90","","94.305","0.001","90","","2172.1","0.3","120","0.2","120","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H25 Cl N O6 -","- C24 H25 Cl N O6 -","- C96 H100 Cl4 N4 O24 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0662","0.0443","","","0.122","0.1311","","","","","","0.983","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052112","14.135","0.004","7.983","0.002","25.02","0.007","90","","100.855","0.01","90","","2772.7","1.3","120","0.2","120","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 Cl2 N O7 -","- C28 H34 Cl2 N O7 -","- C112 H136 Cl8 N4 O28 -","4","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.339","0.1576","","","0.4168","0.4553","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052113","10.9855","0.0012","10.8828","0.0012","12.212","0.0013","90","","98.282","0.005","90","","1444.8","0.3","120","0.2","120","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N2 O4 -","- C38 H34 N2 O4 -","- C76 H68 N4 O8 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.1123","0.069","","","0.1333","0.1472","","","","","","1.054","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052114","11.4976","0.0005","12.2916","0.0006","13.5348","0.0006","93.589","0.002","110.545","0.002","92.542","0.002","1783.11","0.14","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H36 Cl2 N2 O12 -","- C38 H36 Cl2 N2 O12 -","- C76 H72 Cl4 N4 O24 -","2","1","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.1263","0.0614","","","0.135","0.1547","","","","","","0.938","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052115","7.7053","0.0009","20.304","0.002","14.3081","0.0015","90","","99.737","0.005","90","","2206.2","0.4","120","0.2","120","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H50 Cl2 N2 O12 -","- C48 H50 Cl2 N2 O11.2 -","- C96 H100 Cl4 N4 O22.4 -","2","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.2886","0.1495","","","0.3078","0.3606","","","","","","1.065","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052116","11.023","0.0004","11.2484","0.0004","12.5132","0.0005","82.944","0.002","76.649","0.002","61.394","0.002","1325.18","0.09","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H62 Cl2 N2 O12 -","- C60 H62 Cl2 N2 O12 -","- C60 H62 Cl2 N2 O12 -","1","0.5","","Lyudmila G. Kuz'mina; Artem I. Vedernikov; Natalia A. Lobova; Andrei V. Churakov; Judith A. K. Howard; Michael V. Alfimov; Sergey P. Gromov","4-Styrylquinolines: synthesis and study of [2 + 2]-photocycloaddition reactions in thin films and single crystals","New Journal of Chemistry","2007","31","6","980","","10.1039/b615056j","","","0.71073","MoKα","","0.0977","0.0523","","","0.1156","0.1283","","","","","","0.959","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052117","8.3685","0.0002","9.1253","0.0002","9.7248","0.0003","69.2894","0.001","82.1053","0.001","77.1832","0.0014","675.92","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","mar147","","","- C12 H14 F3 N O5 -","- C12 H14 F3 N O5 -","- C24 H28 F6 N2 O10 -","2","1","","Alberto Avenoza; Jesús H. Busto; Noelia Canal; José I. García; Gonzalo Jiménez-Osés; Jesús M. Peregrina; Marta Pérez-Fernández","Mechanistic study of the ring-size modulation in Michael?Dieckmann type reactions of 2-acylaminoacrylates with ketene diethyl acetal","New Journal of Chemistry","2007","31","2","224","","10.1039/b615220a","","","0.71073","MoKα","","0.0542","0.0385","","","0.09","0.0979","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052118","13.6418","0.0016","16.7","0.002","20.05","0.002","85.446","0.008","83.877","0.007","70.685","0.007","4281.3","0.9","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C78 H105 F12 N5 O27 P4 -","- C78 H105 F12 N5 O27 P4 -","- C156 H210 F24 N10 O54 P8 -","2","1","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.1011","0.0627","","","0.153","0.1777","","","","","","0.994","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052119","14.3358","0.0019","16.055","0.002","20.135","0.003","90","","101.999","0.009","90","","4533","1.1","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C80 H102 F24 N6 O18 P4 -","- C80 H102 F24 N6 O18 P4 -","- C160 H204 F48 N12 O36 P8 -","2","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0667","0.0436","","","0.1091","0.1192","","","","","","1.092","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052120","10.7969","0.0013","11.6598","0.0014","13.4326","0.0016","69.073","0.002","66.558","0.002","76","0.002","1439.2","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H66 F12 N2 O14 P2 -","- C54 H66 F12 N2 O14 P2 -","- C54 H66 F12 N2 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0438","0.0355","","","0.0956","0.102","","","","","","1.041","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052121","10.405","0.002","11.148","0.002","14.021","0.003","69.539","0.003","81.494","0.003","74.025","0.003","1462.5","0.5","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H66 F12 N2 O14 P2 -","- C55 H66 F12 N2 O14 P2 -","- C55 H66 F12 N2 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0748","0.0592","","","0.1653","0.1782","","","","","","1.02","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052122","11.7067","0.0011","12.1212","0.0011","13.9127","0.0013","94.769","0.006","110.295","0.006","109.052","0.006","1706.7","0.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H78 F12 N6 O14 P2 -","- C62 H78 F12 N6 O14 P2 -","- C62 H78 F12 N6 O14 P2 -","1","0.5","","Mezei, Gellert; Kampf, Jeff W.; Pecoraro, Vincent L.","Temperature-, molar ratio- and counterion-effects on the crystal growth of bipyridinium-bis(alkylcarboxylic acid)?crown ether pseudorotaxanes","New Journal of Chemistry","2007","31","3","439","","10.1039/b615273b","","","0.71073","MoKα","","0.0953","0.0508","","","0.1098","0.1261","","","","","","1.025","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052123","17.349","0.002","33.402","0.004","42.855","0.005","90","","93.069","0.002","90","","24798","5","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C212 H198 N20 O88 S16 -","- C212 H134 N20 O88 S16 -","- C848 H536 N80 O352 S64 -","4","0.5","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.3617","0.2234","","","0.4862","0.5783","","","","","","0.985","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052124","17.195","0.001","17.804","0.003","23.132","0.002","78.326","0.009","86.573","0.004","68.775","0.009","6464","1.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C116 H142 N12 O58 S8 -","- C116 H132 N12 O58 S8 -","- C232 H264 N24 O116 S16 -","2","1","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.2007","0.1382","","","0.3765","0.4013","","","","","","1.022","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052125","49.471","0.002","11.382","0.001","21.92","0.001","90","","115.321","0.004","90","","11156.9","1.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H53 N4 O24 S4 -","- C48 H37 N4 O23.97 S4 -","- C384 H296 N32 O191.76 S32 -","8","1","","Smith, Christopher B.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Solution and solid state interplay of isomeric 4?-(pyridyl)-3,2?:6?,3?-terpyridines with p-sulfonatocalix[4]arene","New Journal of Chemistry","2007","31","4","535","","10.1039/b615508a","","","0.71073","MoKα","","0.1444","0.1391","","","0.317","0.3218","","","","","","1.086","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052126","11.6399","0.0004","12.1551","0.0004","12.5581","0.0004","75.915","0.002","72.576","0.002","76.92","0.002","1621.52","0.1","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H31 Cl2 N5 O10 -","- C27 H29 N5 O10 -","- C54 H58 N10 O20 -","2","1","","Sessler, Jonathan L.; Barkey, Natalie M.; Pantos, G. Dan; Lynch, Vincent M.","Acyclic pyrrole-based anion receptors: design, synthesis, and anion-binding properties","New Journal of Chemistry","2007","31","5","646","","10.1039/b615673h","","","0.71073","MoKα","","0.1227","0.0735","","","0.1973","0.2147","","","","","","1.165","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052127","16.2474","0.0007","16.2674","0.0007","20.5931","0.0007","83.54","0.003","76.736","0.003","71.072","0.002","5006.9","0.4","173","0.1","173","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C90 H93.5 Cl3 N4.5 O16 S4 -","- C90 H93.5 Cl3 N4.5 O16 S4 -","- C180 H187 Cl6 N9 O32 S8 -","2","1","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.2545","0.1274","","","0.3377","0.3917","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052128","29.3447","0.0009","22.6903","0.0005","22.2725","0.0007","90","","109.033","0.001","90","","14019.2","0.7","173","0.2","173","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C142 H147.5 N9.5 O25 S8 -","- C142 H147.5 N9.5 O25 S8 -","- C568 H590 N38 O100 S32 -","4","0.5","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.22","0.0913","","","0.2217","0.2794","","","","","","1.044","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052129","8.218","0.0004","11.3823","0.0004","17.5254","0.0009","90","","101.113","0.002","90","","1608.58","0.13","173","0.2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 N O3 S -","- C18 H17 N O3 S -","- C72 H68 N4 O12 S4 -","4","1","","Ngong Kodiah Beyeh; Jukka Aumanen; Antti Åhman; Minna Luostarinen; Heidi Mansikkamäki; Maija Nissinen; Jouko Korppi-Tommola; Kari Rissanen","Dansylated resorcinarenes","New Journal of Chemistry","2007","31","3","370","","10.1039/b615772f","","","0.71073","MoKα","","0.0654","0.0399","","","0.0831","0.0918","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052130","8.2722","0.0011","11.2447","0.0016","37.776","0.005","90","","90","","90","","3513.9","0.8","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-[(1R,2S,5R)-(-)-menthoxymethyl]-3-methylimidazolium chloride hydrate","","- C15 H29 Cl N2 O2 -","- C15 H29 Cl N2 O2 -","- C120 H232 Cl8 N16 O16 -","8","2","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.0802","0.0486","","","0.0765","0.0838","","","","","","1.015","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052131","13.0143","0.0014","8.0671","0.0008","17.9287","0.0018","90","","103.636","0.002","90","","1829.2","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-[(1R,2S,5R)‒(‒)‒menthoxymethyl]-3-ethylimidazolium chloride hemihydrate","","- C16 H30 Cl N2 O1.5 -","- C16 H29 Cl N2 O1.5 -","- C64 H116 Cl4 N8 O6 -","4","2","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.0982","0.0569","","","0.1478","0.1668","","","","","","0.993","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052132","9.4408","0.001","34.119","0.004","12.1754","0.0013","90","","90.292","0.002","90","","3921.8","0.7","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-[(1R,2S,5R)‒(‒)‒menthoxymethyl]-3-propylimidazolium chloride hemihydrate","","- C17 H32 Cl N2 O1.5 -","- C17 H32 Cl N2 O1.5 -","- C136 H256 Cl8 N16 O12 -","8","4","","Juliusz Pernak; Joanna Feder-Kubis; Anna Cieniecka-Rosłonkiewicz; Cedric Fischmeister; Scott T. Griffin; Robin D. Rogers","Synthesis and properties of chiral imidazolium ionic liquids with a (1R,2S,5R)-(?)-menthoxymethyl substituent","New Journal of Chemistry","2007","31","6","879","","10.1039/b616215k","","","0.71073","MoKα","","0.1361","0.0651","","","0.1222","0.1471","","","","","","0.99","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052134","25.43","0.004","11.8649","0.0017","16.688","0.002","90","","90","","90","","5035.2","1.2","293","2","293","2","","","","","","","","5","P m c 21","P 2c -2","26","","","","- C40 H63 Cu2 N10 O16.5 -","- C40 H60 Cu2 N10 O16.5 -","- C160 H240 Cu8 N40 O66 -","4","1","","Boiocchi, Massimo; Bonizzoni, Marco; Moletti, Alberto; Pasini, Dario; Taglietti, Angelo","Linear recognition of dicarboxylates by ditopic macrocyclic complexes","New Journal of Chemistry","2007","31","3","352","","10.1039/b616492g","","","0.71073","MoKα","","0.0976","0.0574","","","0.1447","0.1708","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052135","16.0948","0.0001","26.2675","0.0001","19.298","0.0001","90","","90","","90","","8158.62","0.07","173","1","173","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C42 H56 N4 O2 S4 -","- C42 H56 N4 O2 S4 -","- C336 H448 N32 O16 S32 -","8","1","","Martin Valik; Vladimir Král; Eberhardt Herdtweck; Franz P. Schmidtchen","Sulfoniumcalixpyrrole: the decoration of a calix[4]pyrrole host with positive charges boosts affinity and selectivity of anion binding in DMSO solvent","New Journal of Chemistry","2007","31","5","703","","10.1039/b617465e","","","0.71073","MoKα","","0.0432","0.0354","","","0.0859","0.0908","","","","","","1.016","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052136","9.014","0.0008","14.873","0.002","16.749","0.002","77.96","0.01","83.05","0.01","77.57","0.01","2137.8","0.4","293","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C52 H56 N2 O2 -","- C52 H56 N2 O2 -","- C104 H112 N4 O4 -","2","1","","Stéphanie Leroy-Lhez; Magali Allain; Jean Oberlé; Frédéric Fages","Synthesis and zinc(ii) complexation modulated fluorescence emission properties of two pyrene-oligo(phenylene vinylene)-2,2?-bipyridine conjugated molecular rods","New Journal of Chemistry","2007","31","6","1013","","10.1039/b617497c","","x-ray","0.71073","MoKα","","","0.0471","","","","0.1413","","","","","","0.794","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052137","37.1517","0.0005","37.1517","0.0005","19.4231","0.0003","90","","90","","120","","23217","0.6","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C54 H58 Br2 N2 O4 -","- C54 H58 Br2 N2 O4 -","- C972 H1044 Br36 N36 O72 -","18","1","","van de Coevering, Rob; Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","Ionic core‒shell dendrimers with a polycationic core: structural aspects and host‒guest binding properties","New Journal of Chemistry","2007","31","7","1337","","10.1039/b617669k","","","0.71073","MoKα","","0.0758","0.0586","","","0.1749","0.1881","","","","","","1.082","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052138","9.9322","0.0002","13.9718","0.0002","19.304","0.0004","100.327","0.001","92.3451","0.0008","103.829","0.0009","2549.18","0.08","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C59 H61 N4 O5 S -","- C59 H61 N4 O5 S -","- C118 H122 N8 O10 S2 -","2","1","","van de Coevering, Rob; Bruijnincx, Pieter C. A.; Lutz, Martin; Spek, Anthony L.; van Koten, Gerard; Klein Gebbink, Robertus J. M.","Ionic core‒shell dendrimers with a polycationic core: structural aspects and host‒guest binding properties","New Journal of Chemistry","2007","31","7","1337","","10.1039/b617669k","","","0.71073","MoKα","","0.0604","0.0433","","","0.1055","0.1142","","","","","","1.026","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052139","8.907","0.0009","5.6894","0.0008","13.0599","0.0013","90","","90.588","0.012","90","","661.78","0.13","180","","180","","","","","","","","synthesis as described","3","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 N2 -","- C8 H8 N2 -","- C32 H32 N8 -","4","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.042","0.0368","","","0.091","0.0943","","","","","","1.063","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052140","12.5397","0.0018","12.5397","0.0018","4.3463","0.0009","90","","90","","120","","591.87","0.17","180","","180","","","","","","","","synthesis as described","4","P 32","P 32","145","","","","- C8 H5 F3 N2 -","- C8 H5 F3 N2 -","- C24 H15 F9 N6 -","3","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.1277","0.0885","","","0.1489","0.1687","","","","","","1.048","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052141","12.5382","0.0018","12.5382","0.0018","4.9499","0.001","90","","90","","120","","673.9","0.19","180","","180","","","","","","","","synthesis as described","4","P 32","P 32","145","","","","- C8 H F7 N2 -","- C8 H F7 N2 -","- C24 H3 F21 N6 -","3","1","","Johannes Teichert; Pascal Oulié; Kane Jacob; Laure Vendier; Michel Etienne; Rosa M. Claramunt; Concepción López; Carlos Pérez Medina; Ibon Alkorta; José Elguero","The structure of fluorinated indazoles: the effect of the replacement of a H by a F atom on the supramolecular structure of NH-indazoles","New Journal of Chemistry","2007","31","6","936","","10.1039/b617988f","","","0.71073","MoKα","","0.1385","0.0418","","","0.0713","0.0934","","","","","","0.92","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052142","9.3629","0.0013","10.7928","0.0009","12.9505","0.0016","68.589","0.008","83.856","0.009","85.975","0.007","1210.7","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","- C44.75 H53 B2 Cu3 F8 N6 O6.75 -","1","0.5","","Koval, Iryna A.; Akhideno, Hilda; Tanase, Stefania; Belle, Catherine; Duboc, Carole; Saint-Aman, Eric; Gamez, Patrick; Tooke, Duncan M.; Spek, Anthony L.; Pierre, Jean-Louis; Reedijk, Jan","Changes in magnetic properties from solid state to solution in a trinuclear linear copper(ii) complex","New Journal of Chemistry","2007","31","4","512","","10.1039/b618154f","","","0.71073","MoKα","","0.0378","0.0312","","","0.0826","0.0864","","","","","","1.048","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052143","6.5739","0.0013","11.597","0.002","12.604","0.003","90","","90.13","0.03","90","","960.9","0.3","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","piperazinediium bis(4-aminobenzoate) dihydrate","piperazinediium bis(4-aminobenzoate) dihydrate","","- C18 H28 N4 O6 -","- C18 H28 N4 O6 -","- C36 H56 N8 O12 -","2","0.5","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.042","0.0373","","","0.1039","0.1073","","","","","","1.005","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052144","19.0506","0.0013","12.12","0.0009","14.4397","0.001","90","","107.72","0.001","90","","3175.8","0.4","90","2","90","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","meso-(5S,12S)-5,7,7,12,14,14-hexamethyl-4,11-diaza-1,8- diazoniacyclotetradecane bis(4-aminobenzoate) hydrate","meso-(5S,12S)-5,7,7,12,14,14-hexamethyl-4,11-diaza-1,8-diazoniacyclotetradecane bis(4-aminobenzoate) hydrate","","- C30 H52 N6 O5 -","- C30 H52 N6 O5 -","- C120 H208 N24 O20 -","4","0.5","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","0.71073","MoKα","","0.0619","0.0484","","","0.1211","0.1283","","","","","","1.006","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052145","9.6004","0.0019","11.35","0.002","12.088","0.002","90","","111.91","0.03","90","","1222","0.5","90","2","90","2","","","","","","","","4","P 1 21 1","P 2yb","4","4,10-diaza-1,7-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","4,10-diaza-1,7-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","","- C22 H38 N6 O6 -","- C22 H38 N6 O6 -","- C44 H76 N12 O12 -","2","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.04","0.0366","","","0.0881","0.0906","","","","","","1.009","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052146","10.9044","0.0014","9.9475","0.0013","12.1429","0.0015","90","","114.267","0.002","90","","1200.8","0.3","90","2","90","2","","","","","","","","4","P 1 c 1","P -2yc","7","1,7-dioxa-4,10-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","1,7-dioxa-4,10-diazoniacyclododecane bis(4-aminobenzoate) dihydrate","","- C22 H36 N4 O8 -","- C22 H36 N4 O8 -","- C44 H72 N8 O16 -","2","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.0381","0.0349","","","0.08","0.0825","","","","","","1.004","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052147","24.784","0.004","9.6757","0.0017","10.0867","0.0018","90","","90","","90","","2418.8","0.7","90","2","90","2","","","","","","","","4","P c a 21","P 2c -2ac","29","1,4,7,10,13-pentaoxa-16-azoniacyclooctadecane 4-aminobenzoate trihydrate","1,4,7,10,13-pentaoxa-16-azoniacyclooctadecane 4-aminobenzoate trihydrate","","- C19 H38 N2 O10 -","- C19 H38 N2 O10 -","- C76 H152 N8 O40 -","4","1","","Moulton, Brian; Luisi, Brian S.; Fonari, Marina S.; Basok, Stepan S.; Ganin, Eduard V.; Kravtsov, Victor Ch.","Supramolecular associates of para-aminobenzoic acid with N- and N,O-heterocyclic molecules","New Journal of Chemistry","2007","31","4","561","","10.1039/b618207k","","","","MoKα","","0.0575","0.0424","","","0.0848","0.0913","","","","","","0.996","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052148","14.2714","0.0009","12.8482","0.001","39.425","0.003","90","","104.958","0.007","90","","6984.1","0.9","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 Cl4 Fe O2 S16 -","- C22 H12 Cl4 Fe O2 S16 -","- C176 H96 Cl32 Fe8 O16 S128 -","8","2","","Jean-Philippe Savy; Dominique de Caro; Christophe Faulmann; Lydie Valade; Manuel Almeida; Tadahiro Koike; Hideki Fujiwara; Toyonari Sugimoto; Jordi Fraxedas; Thierry Ondarçuhu; Claude Pasquier","Nanowires of molecule-based charge-transfer salts","New Journal of Chemistry","2007","31","4","519","","10.1039/b618241k","","","0.71073","MoKα","","0.1466","0.1038","","","0.2551","0.2693","","","","","","1.063","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052149","20.562","0.004","8.4423","0.0017","14.824","0.003","90","","106.93","0.03","90","","2461.8","0.9","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 N2 O Se -","- C12 H16 N2 O Se -","- C96 H128 N16 O8 Se8 -","8","1","","Bruce, Jocelyn C.; Revaprasadu, Neerish; Koch, Klaus R.","Cadmium(ii) complexes of N,N-diethyl-N′-benzoylthio(seleno)urea as single-source precursors for the preparation of CdS and CdSe nanoparticles","New Journal of Chemistry","2007","31","9","1647","","10.1039/b618254b","","","0.71073","MoKα","","0.0247","0.0228","","","0.0585","0.0592","","","","","","1.095","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052150","8.73","0.0013","13.374","0.002","17.707","0.003","90","","95.956","0.003","90","","2056.2","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1","","","- C19 H24 Cl2 Cu N4 O -","- C19 H24 Cl2 Cu N4 O -","- C76 H96 Cl8 Cu4 N16 O4 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.072","0.0521","","","0.1197","0.1284","","","","","","1.027","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052151","8.59","0.002","12.854","0.003","18.163","0.004","90","","91.596","0.004","90","","2004.7","0.8","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3","","","- C18 H21 Cl2 Cu N5 -","- C18 H21 Cl2 Cu N5 -","- C72 H84 Cl8 Cu4 N20 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1973","0.1044","","","0.1959","0.231","","","","","","1.084","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052152","12.8579","0.0011","14.746","0.0013","13.8823","0.0012","90","","98.669","0.002","90","","2602","0.4","303","2","303","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","10","","","- C22 H32 Cl2 Cu N6 O2 -","- C22 H32 Cl2 Cu N6 O2 -","- C88 H128 Cl8 Cu4 N24 O8 -","4","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1436","0.0837","","","0.1932","0.2273","","","","","","1.015","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052153","8.598","0.003","13.177","0.004","18.105","0.006","90","","95.181","0.006","90","","2042.8","1.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","3","","","- C34 H40 Cl8 Cu2 N8 -","- C34 H40 Cl8 Cu2 N8 -","- C68 H80 Cl16 Cu4 N16 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.12","0.062","","","0.1108","0.1307","","","","","","0.966","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052154","8.826","0.003","13.103","0.005","18.057","0.006","90","","95.838","0.007","90","","2077.4","1.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","4","","","- C40 H52 Cl4 Cu2 N8 O2 -","- C40 H52 Cl4 Cu2 N8 O2 -","- C80 H104 Cl8 Cu4 N16 O4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1549","0.0908","","","0.1486","0.1706","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052155","8.8822","0.0014","13.05","0.002","17.792","0.003","90","","95.486","0.003","90","","2052.9","0.6","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","5","","","- C36 H48 Cl4 Cu2 N8 O2 S2 -","- C36 H48 Cl4 Cu2 N8 O2 S2 -","- C72 H96 Cl8 Cu4 N16 O4 S4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.0757","0.0516","","","0.1074","0.1161","","","","","","1.033","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052156","8.4038","0.0015","12.927","0.002","18.195","0.003","90","","91.267","0.003","90","","1976.1","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","6","","","- C36 H44 Cl4 Cu2 N8 O2 -","- C36 H44 Cl4 Cu2 N8 O2 -","- C72 H88 Cl8 Cu4 N16 O4 -","2","0.5","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1056","0.0721","","","0.1311","0.1414","","","","","","1.153","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052157","15.7","0.013","21.205","0.018","8.132","0.007","90","","121.048","0.013","90","","2319","3","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","7","","","- C35 H39 Cl13 Cu2 N8 -","- C35 H39 Cl13 Cu2 N8 -","- C70 H78 Cl26 Cu4 N16 -","2","0.25","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1739","0.0824","","","0.1724","0.2169","","","","","","0.955","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052158","8.6006","0.0017","13.126","0.003","17.942","0.004","87.547","0.004","87.705","0.004","81.627","0.004","2000.9","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","8","","","- C38 H48 Cl4 Cu2 N8 O3 -","- C38 H48 Cl4 Cu2 N8 O3 -","- C76 H96 Cl8 Cu4 N16 O6 -","2","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1327","0.0879","","","0.1568","0.1733","","","","","","1.116","","","","has coordinates","212110","2020-10-21","18:00:00",""
"7052159","8.539","0.005","10.673","0.006","13.386","0.007","104.272","0.01","91.858","0.01","112.793","0.009","1078.7","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","9","","","- C18 H22 Cl4 Cu N4 -","- C18 H22 Cl4 Cu N4 -","- C36 H44 Cl8 Cu2 N8 -","2","1","","Liliana Dobrzańska; Gareth O. Lloyd; Leonard J. Barbour","The solvent-templating effect as the driving factor that influences the formation of crystalline materials based on the stacking of metallocycles","New Journal of Chemistry","2007","31","5","669","","10.1039/b618495m","","","0.71073","MoKα","","0.1259","0.0731","","","0.142","0.1655","","","","","","0.959","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052160","8.5803","0.0012","11.9991","0.0015","12.9458","0.0018","90","","92.406","0.017","90","","1331.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H13 Ni S4 -","- C11 H13 Ni S4 -","- C44 H52 Ni4 S16 -","4","1","","Mitsushiro Nomura; Marc Fourmigué","The contrasted structural and magnetic behaviour of two single-component paramagnetic dithiolene complexes","New Journal of Chemistry","2007","31","4","528","","10.1039/b700278e","","","0.71073","MoKα","","0.1075","0.0454","","","0.0744","0.089","","","","","","0.842","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052161","8.769","0.001","9.318","0.0012","10.3604","0.0015","87.844","0.016","83.577","0.015","62.422","0.013","745.55","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H13 Ni S4 -","- C15 H13 Ni S4 -","- C30 H26 Ni2 S8 -","2","1","","Mitsushiro Nomura; Marc Fourmigué","The contrasted structural and magnetic behaviour of two single-component paramagnetic dithiolene complexes","New Journal of Chemistry","2007","31","4","528","","10.1039/b700278e","","","0.71073","MoKα","","0.1208","0.0752","","","0.2006","0.2299","","","","","","0.98","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052162","14.1796","0.0013","14.1796","0.0013","25.007","0.002","90","","90","","120","","4354.3","0.7","293","2","293","2","","","","","","","","6","P 31 2 1","P 31 2""","152","bis(mu2-R,R-N,N'-(2-methyl-8-methoxyquinoline)-1,2-trans-cyclohexanedi-imine) -di-copper(i) diperchlorate","","","- C56 H56 Cl2 Cu2 N8 O12 -","- C56 H56 Cl2 Cu2 N8 O12 -","- C168 H168 Cl6 Cu6 N24 O36 -","3","0.5","","Pallavicini, Piersandro; Boiocchi, Massimo; Dacarro, Giacomo; Mangano, Carlo","Enhanced kinetic inertness in the electrochemical interconversion of Cu(i) double helical to Cu(ii) monomeric complexes","New Journal of Chemistry","2007","31","6","927","","10.1039/b700488e","","","0.71073","MoKα","","0.1557","0.089","","","0.2429","0.2853","","","","","","0.974","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052163","13.8593","0.0016","12.171","0.0019","20.914","0.002","90","","90","","90","","3527.8","0.8","293","2","293","2","","","","","","","","6","I 2 2 2","I 2 2","23","bis(mu2-R,R-N,N'-(2-methyl-8-buthoxyquinoline)-1,2-trans-cyclohexanedi-imine) -di-copper(i) diperchlorate","","","- C68 H80 Cl2 Cu2 N8 O12 -","- C68 H80 Cl2 Cu2 N8 O12 -","- C136 H160 Cl4 Cu4 N16 O24 -","2","0.25","","Pallavicini, Piersandro; Boiocchi, Massimo; Dacarro, Giacomo; Mangano, Carlo","Enhanced kinetic inertness in the electrochemical interconversion of Cu(i) double helical to Cu(ii) monomeric complexes","New Journal of Chemistry","2007","31","6","927","","10.1039/b700488e","","","0.71073","MoKα","","0.1482","0.0638","","","0.1369","0.1776","","","","","","0.992","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052164","13.409","0.003","14.202","0.003","15.345","0.003","109.09","0.03","99.73","0.03","99.82","0.03","2640.6","1.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H60 N4 O5 Zn2 -","- C61 H60 N4 O5 Zn2 -","- C122 H120 N8 O10 Zn4 -","2","1","","Dalla Cort, Antonella; Mandolini, Luigi; Pasquini, Chiara; Rissanen, Kari; Russo, Luca; Schiaffino, Luca","Zinc‒salophen complexes as selective receptors for tertiary amines","New Journal of Chemistry","2007","31","9","1633","","10.1039/b700723j","","","0.71073","MoKα","","0.127","0.0651","","","0.1263","0.1608","","","","","","1.032","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052165","21.55","0.004","11.749","0.002","30.5348","0.0006","90","","109.83","0.03","90","","7273","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37.78 H41.78 Cl2.34 N3 O2 Zn -","- C37.7805 H41 Cl2.3415 N3 O2 Zn -","- C302.244 H328 Cl18.732 N24 O16 Zn8 -","8","2","","Dalla Cort, Antonella; Mandolini, Luigi; Pasquini, Chiara; Rissanen, Kari; Russo, Luca; Schiaffino, Luca","Zinc‒salophen complexes as selective receptors for tertiary amines","New Journal of Chemistry","2007","31","9","1633","","10.1039/b700723j","","","0.71073","MoKα","","0.2408","0.1953","","","0.4063","0.4311","","","","","","1.124","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052166","23.3924","0.0017","9.5829","0.0007","19.3455","0.0014","90","","126.649","0.001","90","","3479.3","0.4","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 O2 -","- C26 H16 O2 -","- C208 H128 O16 -","8","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.0439","0.0356","","","0.0917","0.0944","","","","","","1.024","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052167","5.686","0.0015","10.21","0.003","14.072","0.004","97.506","0.004","92.789","0.004","90.58","0.004","808.9","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H12 O2 S2 -","- C22 H12 O2 S2 -","- C44 H24 O4 S4 -","2","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.0605","0.0428","","","0.0987","0.1085","","","","","","0.958","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052168","8.736","0.006","8.973","0.006","18.358","0.012","89.562","0.013","88.762","0.012","81.196","0.012","1421.7","1.7","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C72 H88 O2 -","- C72 H88 O2 -","- C72 H88 O2 -","1","0.5","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","2,6-Diaryl-9,10-anthraquinones as models for electron-accepting polymers","New Journal of Chemistry","2007","31","9","1585","","10.1039/b701257h","","","0.71073","MoKα","","0.1054","0.0556","","","0.1114","0.1261","","","","","","0.879","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052169","9.563","","12.095","","13.129","","73.31","","69.31","","88.65","","1355.62","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","((R/S)-EDT-TTF(SMe)-oxazoline)2(Mo6Cl14)","","","- C26 H26 Cl14 Mo6 N2 O2 S14 -","- C26 H26 Cl14 Mo6 N2 O2 S14 -","- C26 H26 Cl14 Mo6 N2 O2 S14 -","1","0.5","","Réthoré, Céline; Madalan, Augustin; Fourmigué, Marc; Canadell, Enric; Lopes, Elsa B.; Almeida, Manuel; Clérac, Rodolphe; Avarvari, Narcis","O⋯S vs. N⋯S intramolecular nonbonded interactions in neutral and radical cation salts of TTF-oxazoline derivatives: synthesis, theoretical investigations, crystalline structures, and physical properties","New Journal of Chemistry","2007","31","8","1468","","10.1039/b701617d","","","0.7107","MoKα","","0.162","0.06","","","0.0955","0.1181","","","","","","1.004","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052170","10.392","","13.868","","18.026","","91.19","","102.84","","107.28","","2408.03","","293","2","293","2","","","","","","","","7","P -1","-P 1","2","((R/S)-EDT-TTF(SMe)-oxazoline)4(Mo6Cl14)","","","- C52 H52 Cl14 Mo6 N4 O4 S28 -","- C52 H52 Cl14 Mo6 N4 O4 S28 -","- C52 H52 Cl14 Mo6 N4 O4 S28 -","1","0.5","","Réthoré, Céline; Madalan, Augustin; Fourmigué, Marc; Canadell, Enric; Lopes, Elsa B.; Almeida, Manuel; Clérac, Rodolphe; Avarvari, Narcis","O⋯S vs. N⋯S intramolecular nonbonded interactions in neutral and radical cation salts of TTF-oxazoline derivatives: synthesis, theoretical investigations, crystalline structures, and physical properties","New Journal of Chemistry","2007","31","8","1468","","10.1039/b701617d","","","0.71073","MoKα","","0.1425","0.0528","","","0.1095","0.1354","","","","","","1.012","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052171","10.3656","0.0004","14.7041","0.0006","11.0971","0.0004","90","","111.493","0.002","90","","1573.77","0.11","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H15 Ag Cl N6 O6 -","- C10 H13 Ag Cl N6 O6 -","- C40 H52 Ag4 Cl4 N24 O24 -","4","1","","Fabrice Pointillart; Cyrille Train; Patrick Herson; Jérôme Marrot; Michel Verdaguer","Verdazyl-based extended structures: synthesis, structures and magnetic properties of silver(i) one dimensional compounds","New Journal of Chemistry","2007","31","6","1001","","10.1039/b701686g","","","0.71073","MoKα","","0.0902","0.0523","","","0.131","0.1469","","","","","","1.04","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052172","12.2251","0.0007","15.406","0.009","19.7291","0.001","90","","90","","90","","3716","2","250","","250","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H19 Ag Cl N7 O5 -","- C12 H19 Ag Cl N7 O5 -","- C96 H152 Ag8 Cl8 N56 O40 -","8","1","","Fabrice Pointillart; Cyrille Train; Patrick Herson; Jérôme Marrot; Michel Verdaguer","Verdazyl-based extended structures: synthesis, structures and magnetic properties of silver(i) one dimensional compounds","New Journal of Chemistry","2007","31","6","1001","","10.1039/b701686g","","","0.71073","MoKα","","0.1999","0.1142","","0.1415","0.1095","0.1095","","","","","","1.0707","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052173","7.2707","0.0006","12.3313","0.001","28.699","0.002","90","","96.684","0.002","90","","2555.6","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H24 N2 Pt -","- C33 H24 N2 Pt -","- C132 H96 N8 Pt4 -","4","1","","Seneclauze, Julie Batcha; Retailleau, Pascal; Ziessel, Raymond","Design and preparation of neutral substituted fluorene- and carbazole-based platinum(ii)‒acetylide complexes","New Journal of Chemistry","2007","31","8","1412","","10.1039/b702374j","","","0.71073","MoKα","","0.0423","0.0399","","","0.1001","0.1008","","","","","","1.581","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052174","7.301","0.005","12.688","0.005","25.728","0.005","90","","90","","90","","2383.3","1.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H21 N3 Pt -","- C31 H21 N3 Pt -","- C124 H84 N12 Pt4 -","4","1","","Seneclauze, Julie Batcha; Retailleau, Pascal; Ziessel, Raymond","Design and preparation of neutral substituted fluorene- and carbazole-based platinum(ii)‒acetylide complexes","New Journal of Chemistry","2007","31","8","1412","","10.1039/b702374j","","","0.71069","MoKα","","0.0425","0.0307","","","0.0762","0.0901","","","","","","1.159","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052175","13.641","0.003","17.738","0.004","18.898","0.004","75.86","0.03","82.89","0.03","84.78","0.03","4391.2","1.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C78 H78 Cl4 N15 O28.5 S4 Zn2 -","- C78 H77 Cl4 N15 O28.5 S4 Zn2 -","- C156 H154 Cl8 N30 O57 S8 Zn4 -","2","1","","Baylies, Christian J.; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.; Riis-Johannessen, T.","Electrostatic control of the formation of heteroleptic transition metal helicates","New Journal of Chemistry","2007","31","8","1525","","10.1039/b702608k","","","0.71073","MoKα","","0.1106","0.056","","","0.1368","0.1612","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052176","16.9511","0.0003","18.4571","0.0003","20.1644","0.0004","108.458","0.001","103.302","0.001","110.497","0.001","5176.27","0.18","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C79 H80.5 Ba2 Cl8 N15.5 O45 S4 Zn2 -","- C79 H78.5 Ba2 Cl8 N15.5 O45 S4 Zn2 -","- C158 H157 Ba4 Cl16 N31 O90 S8 Zn4 -","2","1","","Baylies, Christian J.; Harding, Lindsay P.; Jeffery, John C.; Moon, Ryan; Rice, Craig R.; Riis-Johannessen, T.","Electrostatic control of the formation of heteroleptic transition metal helicates","New Journal of Chemistry","2007","31","8","1525","","10.1039/b702608k","","x-ray","1.54178","CuKα","","0.0771","0.0525","","","0.1281","0.1419","","","","","","0.996","","","","has coordinates","288091","2023-12-06","15:51:23",""
"7052177","6.35","0.0013","10.747","0.002","13.239","0.003","90","","92.69","0.03","90","","902.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C16 H33 Al N2 O -","- C16 H33 Al N2 O -","- C32 H66 Al2 N4 O2 -","2","0.5","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.1041","0.0679","","","0.1507","0.1679","","","","","","1.072","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052178","6.35","0.0013","10.729","0.002","13.273","0.003","90","","92.61","0.03","90","","903.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C16 H33 Ga N2 O -","- C16 H33 Ga N2 O -","- C32 H66 Ga2 N4 O2 -","2","0.5","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.0962","0.0897","","","0.2239","0.2302","","","","","","1.134","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052179","12.707","0.003","11.963","0.002","17.66","0.004","90","","95.14","0.03","90","","2673.8","1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H50 Al N3 O2 -","- C25 H50 Al N3 O2 -","- C100 H200 Al4 N12 O8 -","4","1","","Jones, Cameron; Rose, Richard P.","Synthesis and characterisation of tetramethylpiperidinyloxide (TEMPO) complexes of group 13 metal hydrides","New Journal of Chemistry","2007","31","8","1484","","10.1039/b702641b","","","0.71073","MoKα","","0.097","0.0599","","","0.1197","0.1356","","","","","","1.016","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052180","12.081","0.001","17.513","0.001","12.328","0.001","90","","118.022","0.001","90","","2302.5","0.3","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H29 P Si2 -","- C23 H29 P Si2 -","- C92 H116 P4 Si8 -","4","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.0573","0.041","","","0.1117","0.1197","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052181","6.24","0.001","12.986","0.001","27.663","0.001","90","","90","","90","","2241.6","0.4","150","0.1","150","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H21 P S -","- C29 H21 P S -","- C116 H84 P4 S4 -","4","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.0511","0.0384","","","0.0933","0.099","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052182","17.932","0.001","12.292","0.001","20.981","0.001","90","","90","","90","","4624.6","0.5","150","0.1","150","0.1","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C23 H29 P S Si2 -","- C23 H29 P S Si2 -","- C184 H232 P8 S8 Si16 -","8","1","","Moores, Audrey; Cantat, Thibault; Ricard, Louis; Mézailles, Nicolas; Le Floch, Pascal","Experimental and theoretical study of phosphinine sulfides","New Journal of Chemistry","2007","31","8","1493","","10.1039/b702851b","","","0.71069","MoKα","","0.043","0.0332","","","0.094","0.0998","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052183","9.273","0.002","9.672","0.002","21.274","0.004","97.75","0.03","91.62","0.03","117.78","0.03","1663.6","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Bis(n-tert-butyl-N'(diisopropoxyphosphoryl)-thiocaramido- N',S)nickel(ii)","Bis[n-tert-butyl-N'(diisopropoxyphosphoryl)- thiocaramido-N',S]nickel(II)","","- C22 H48 N4 Ni O6 P2 S2 -","- C22 H48 N4 Ni O6 P2 S2 -","- C44 H96 N8 Ni2 O12 P4 S4 -","2","1","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.0823","0.0483","","","0.1114","0.1233","","","","","","1.012","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052184","12.194","0.002","8.439","0.002","16.951","0.003","90","","91.55","0.03","90","","1743.7","0.6","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis(N-(diisopropoxyphosphoryl)-N'-(p-metoxyphenyl) thiocarbamido-N,S)nickel(ii)","Bis[N-(diisopropoxyphosphoryl)-N'-(p-metoxyphenyl) thiocarbamido-N,S]nickel(II)","","- C14 H44 N4 Ni O8 P2 S2 -","- C28 H44 N4 Ni O8 P2 S2 -","- C56 H88 N8 Ni2 O16 P4 S4 -","2","0.5","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.1451","0.061","","","0.0996","0.1148","","","","","","0.924","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052185","10.403","0.002","8.304","0.002","20.958","0.006","90","","105.78","0.03","90","","1742.3","0.8","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","Bis(N-(p-bromophenyl)-N'-(diisopropoxyphosphoryl) thiocarbamido-N',S)nickel(ii)","Bis[N-(p-bromophenyl)-N'-(diisopropoxyphosphoryl) thiocarbamido-N',S]nickel(II)","","- C26 H38 Br2 N4 Ni O6 P2 S2 -","- C26 H38 Br2 N4 Ni O6 P2 S2 -","- C52 H76 Br4 N8 Ni2 O12 P4 S4 -","2","0.5","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.126","0.0542","","","0.0894","0.1083","","","","","","0.997","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052186","18.981","0.004","9.764","0.002","16.498","0.003","90","","97.89","0.03","90","","3028.6","1.1","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Bis(N-(diisopropoxyphosphoryl)-N'-isopropylthiocarbamido- N,S)palladium(ii)","Bis[N-(diisopropoxyphosphoryl)-N'- isopropylthiocarbamido-N,S]palladium(II)","","- C20 H44 N4 O6 P2 Pd S2 -","- C20 H44 N4 O6 P2 Pd S2 -","- C80 H176 N16 O24 P8 Pd4 S8 -","4","1","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.1088","0.0524","","","0.0693","0.0777","","","","","","1.006","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052187","18.747","0.004","17.566","0.004","19.95","0.004","90","","100.046","0.005","90","","6469","2","153","2","153","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Bis(morpholine-N-yl-N`- (diisopropoxyphosphinyl)thiocarboxamide-O,S)palladium(ii)","Bis[morpholine-N-yl-N`- (diisopropoxyphosphinyl)thiocarboxamide-O,S]palladium(II)","","- C22 H44 N4 O8 P2 Pd S2 -","- C22 H44 N4 O8 P2 Pd S2 -","- C176 H352 N32 O64 P16 Pd8 S16 -","8","2","","Sokolov, Felix D.; Baranov, Sergey V.; Safin, Damir A.; Hahn, F. Ekkehardt; Kubiak, Maria; Pape, Tania; Babashkina, Maria G.; Zabirov, Nail G.; Galezowska, Joanna; Kozlowski, Henryk; Cherkasov, Rafael A.","The influence of the intramolecular hydrogen bond on the 1,3-N,S- and 1,5-O,S-coordination of N-phosphoryl-N′-(R)-thioureas with Ni(ii) and Pd(ii)","New Journal of Chemistry","2007","31","9","1661","","10.1039/b702896b","","","0.71073","MoKα","","0.0959","0.0555","","","0.0892","0.1","","","","","","1.036","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052188","9.6504","0.0007","11.4015","0.0008","9.651","0.0007","90","","100.871","0.001","90","","1042.83","0.13","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 N2 S2 -","- C10 H8 N2 S2 -","- C40 H32 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0418","0.0346","","","0.0912","0.0973","","","","","","0.994","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052189","4.5456","0.0002","26.9807","0.0013","10.0137","0.0005","90","","97.484","0.001","90","","1217.65","0.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Br2 N2 S2 -","- C10 H6 Br2 N2 S2 -","- C40 H24 Br8 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0416","0.0304","","","0.073","0.0779","","","","","","0.988","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052190","10.6766","0.0006","11.5253","0.0006","10.2713","0.0006","90","","96.797","0.001","90","","1255.01","0.12","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H6 Br2 N2 S2 -","- C10 H6 Br2 N2 S2 -","- C40 H24 Br8 N8 S8 -","4","1","","Ghazzali, Mohamed; Langer, Vratislav; Lopes, Cesar; Eriksson, Anders; Öhrström, Lars","Syntheses, crystal structures, optical limiting properties, and DFT calculations of three thiophene-2-aldazine Schiff base derivatives","New Journal of Chemistry","2007","31","10","1777","","10.1039/b704009a","","","0.71073","MoKα","","0.0854","0.049","","","0.1112","0.1259","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052191","14.294","0.001","14.848","0.001","16.671","0.007","65.42","0.02","86.24","0.02","84.8","0.01","3202.8","1.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H81 Cl2 O20 V5 -","- C45 H81 Cl2 O20 V5 -","- C90 H162 Cl4 O40 V10 -","2","1","","Sañudo, E. Carolina; Ribas, Joan; Winpenny, Richard E. P.","Solid state synthesis of [V5O2(Me3CCO2)9Cl2]","New Journal of Chemistry","2007","31","8","1421","","10.1039/b704191h","","","0.6933","synchrotron","","0.075","0.0478","","","0.1195","0.1349","","","","","","1.041","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052192","13.184","0.003","5.7697","0.001","18.696","0.004","90","","100.833","0.016","90","","1396.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 N2 O2 S -","- C14 H16 N2 O2 S -","- C56 H64 N8 O8 S4 -","4","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.5418","CuKα","","0.1395","0.0632","","","0.1731","0.2117","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052193","9.0457","0.0015","18.882","0.003","16.057","0.003","90","","105.144","0.003","90","","2647.3","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C112 H108 N12 O16 S8 -","4","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","0.71073","MoKα","","0.0832","0.0457","","","0.1168","0.1286","","","","","","1.033","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052194","8.797","0.005","10.788","0.004","14.713","0.008","100.53","0.05","101.7","0.05","100.23","0.06","1310.4","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C56 H54 N6 O8 S4 -","2","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.5418","CuKα","","0.0636","0.0522","","","0.1465","0.1561","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052195","10.2059","0.0006","10.7345","0.0005","12.8784","0.0005","97.962","0.004","95.36","0.005","108.697","0.005","1309.19","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H27 N3 O4 S2 -","- C28 H27 N3 O4 S2 -","- C56 H54 N6 O8 S4 -","2","1","","Sanmartín, Jesús; Novio, Fernando; García-Deibe, Ana M.; Fondo, Matilde; Bermejo, Manuel R.","Trimorphism of an asymmetric disulfonamide Schiff base","New Journal of Chemistry","2007","31","9","1605","","10.1039/b704195k","","","1.54184","CuKα","","0.0581","0.0555","","","0.1596","0.1627","","","","","","1.059","","","","has coordinates","296813","2024-12-10","08:13:15",""
"7052196","8.25","0.001","8.25","0.001","7.15","0.001","90","","90","","120","","421.45","0.09","293","2","293","2","","","","","","","","4","P 3 c 1","P 3 -2""c","158","","","","- C6 H11 N3 O3 -","- C6 H11.02 N3.01 O3 -","- C12 H22.04 N6.02 O6 -","2","0.333333","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.0503","0.0355","","","0.0926","0.1007","","","","","","1.103","","","","has coordinates,has disorder","180075","2020-10-21","18:00:00",""
"7052197","8.42266","0.00014","6.97215","0.000061","8.06305","0.00013","90","","98.6845","0.0014","90","","468.066","0.012","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","1,3-dimethylbarbiturate methylammonium","","- C7 H13 N3 O3 -","- C7 H13 N3 O3 -","- C14 H26 N6 O6 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","1.5406","CuKα","","","","","","","","","","1.23","","","","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052198","8.5","0.002","10.56","0.003","11.412","0.002","65.843","0.017","88.118","0.018","71.467","0.019","880.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H23 N5 O9 -","- C13 H23 N5 O9 -","- C26 H46 N10 O18 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.1382","0.0468","","","0.117","0.161","","","","","","0.918","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052199","11.29","0.005","19.761","0.006","8.3","0.003","90","","95.17","","90","","1844.2","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H24 N6 O6 -","- C14 H24 N6 O6 -","- C56 H96 N24 O24 -","4","0.5","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.1389","0.0583","","","0.1588","0.2106","","","","","","0.957","","","","has coordinates","180075","2020-10-21","18:00:00",""
"7052200","8.495","0.001","12.416","0.002","12.697","0.002","110.082","0.002","95.887","0.002","95.181","0.002","1239.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H31 N7 O9 -","- C20 H31 N7 O9 -","- C40 H62 N14 O18 -","2","1","","Braga, Dario; Cadoni, Marcella; Grepioni, Fabrizia; Maini, Lucia; van de Streek, Jacco","Solid‒gas reactions between 1,3-dimethylbarbituric acid and amines. A structural and spectroscopic study","New Journal of Chemistry","2007","31","11","1935","","10.1039/b704772j","","","0.71073","MoKα","","0.0643","0.0457","","","0.1309","0.1453","","","","","","0.834","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052201","5.691","0.001","9.359","0.001","41.058","0.001","90","","90","","90","","2186.8","0.5","223","2","223","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H20 Br2 O6 -","- C23 H20 Br2 O6 -","- C92 H80 Br8 O24 -","4","1","","Albrecht, Markus; Schmid, Sören; Dehn, Sabrina; Wickleder, Claudia; Zhang, Shuang; Bassett, Andrew P.; Pikramenou, Zoe; Fröhlich, Roland","Diastereoselective formation of luminescent dinuclear lanthanide(iii) helicates with enantiomerically pure tartaric acid derived bis(β-diketonate) ligands","New Journal of Chemistry","2007","31","10","1755","","10.1039/b705090a","","","0.71073","MoKα","","0.0741","0.0424","","","0.0809","0.0913","","","","","","1.013","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052202","19.0372","0.0007","22.9422","0.0007","30.2456","0.0013","90","","90","","90","","13209.9","0.8","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C71 H101 N O9 -","- C71 H101 N O9 -","- C568 H808 N8 O72 -","8","1","","Marcos, Paula M.; Félix, Sandra; Ascenso, José R.; Segurado, Manuel A. P.; Thuéry, Pierre; Mellah, Besma; Michel, Sylvia; Hubscher-Bruder, Véronique; Arnaud-Neu, Françoise","Complexation and transport of transition and heavy metal cations by p-tert-butyldihomooxacalix[4]arene tetraketones and X-ray crystal structure of the tert-butyl ketone derivative","New Journal of Chemistry","2007","31","12","2111","","10.1039/b705879a","","","0.71073","MoKα","","0.1381","0.0776","","","0.196","0.2175","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052203","9.884","0.014","11.444","0.014","12.684","0.017","74.4","0.01","77.902","0.01","66.15","0.01","1256","3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H24 N6 -","- C28 H24 N6 -","- C56 H48 N12 -","2","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1483","0.0695","","","0.1646","0.2038","","","","","","0.67","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052204","12.7999","0.0011","14.3093","0.0015","17.1281","0.0013","90","","103.118","0.007","90","","3055.3","0.5","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 F6 N6 O2 P Zn -","- C30 H27 F6 N6 O2 P Zn -","- C120 H108 F24 N24 O8 P4 Zn4 -","4","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1559","0.0776","","","0.1984","0.212","","","","","","0.872","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052205","10.263","0.011","15.745","0.017","21.37","0.02","90","","103.106","0.01","90","","3363","6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Cl2 N6 O10 Zn -","- C28 H26 Cl2 N6 O9.99 Zn -","- C112 H104 Cl8 N24 O39.96 Zn4 -","4","1","","Drew, Michael G. B.; Parui, Debarati; De, Senjuti; Chowdhury, Shubhamoy; Datta, Dipankar","A monoaqua zinc complex. Unique acid dissociation behaviour","New Journal of Chemistry","2007","31","10","1763","","10.1039/b706230n","","","0.71073","MoKα","","0.1091","0.0875","","","0.1637","0.1719","","","","","","1.226","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052206","17.8554","0.0009","15.7085","0.0009","17.7912","0.0009","90","","96.224","0.003","90","","4960.7","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H50 Mn4 N4 O24 P2 -","- C38 H50 Mn4 N4 O24 P2 -","- C152 H200 Mn16 N16 O96 P8 -","4","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.04","","","0.1101","0.1134","","","","","","1.004","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052207","10.08","0.003","11.084","0.003","11.559","0.003","64.798","0.005","81.789","0.007","82.715","0.006","1153.4","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H52 Mn4 N4 O23 P2 -","- C32 H50 Mn4 N4 O23 P2 -","- C32 H50 Mn4 N4 O23 P2 -","1","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0316","","","0.0855","0.0887","","","","","","0.997","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052208","11.4387","0.0014","11.485","0.0012","11.9747","0.0011","100.459","0.001","103.024","0.004","113.282","0.003","1342","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H54 Mn4 N4 O24 P2 -","- C38 H48 Mn4 N4 O24 P2 -","- C38 H48 Mn4 N4 O24 P2 -","1","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0558","","","0.1564","0.1726","","","","","","1.053","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052209","18.0431","0.0007","11.0649","0.0003","21.7461","0.0009","90","","91.002","0.002","90","","4340.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C86 H72 Mn4 N6 O24 P2 -","- C86 H66 Mn4 N6 O24 P2 -","- C172 H132 Mn8 N12 O48 P4 -","2","0.5","","Wang, Mei; Ma, Chengbing; Yuan, Daqiang; Hu, Mingqiang; Chen, Changneng; Liu, Qiutian","Synthesis and characterization of a family of tetranuclear manganese(iii) phosphonate complexes","New Journal of Chemistry","2007","31","12","2103","","10.1039/b706514k","","","0.71073","MoKα","","","0.0409","","","0.1143","0.1208","","","","","","1.005","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052210","27.766","0.0014","11.5247","0.0006","21.2342","0.001","90","","94.895","0.002","90","","6770.1","0.6","163.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H76 Na2 O50 S12 -","- C36 H18 Na2 O46.5 S12 -","- C144 H72 Na8 O186 S48 -","4","0.5","","Yamada, Manabu; Kondo, Yoshihiko; Akimoto, Kazuhiko; Kabuto, Chizuko; Hamada, Fumio","Supramolecular assembly based on p-sulfonatothiacalix[6]arene with sodium and water molecules","New Journal of Chemistry","2007","31","11","1874","","10.1039/b706891c","","","0.71069","MoKα","","","0.1034","","","","0.2714","","","","","","1.128","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052211","26.349","0.005","12.877","0.003","25.364","0.005","90","","111.33","0.05","90","","8016","4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C61 H79 Mn5 N15 Na2 O26 S4 -","- C61 H79 Mn5 N15 Na2 O26 S4 -","- C244 H316 Mn20 N60 Na8 O104 S16 -","4","1","","Beghidja, Chahrazed; Rogez, Guillaume; Welter, Richard","Synthesis, crystal structure and magnetic properties of a new mixed-valence [Mn4IIIMnII] pentanuclear complex","New Journal of Chemistry","2007","31","8","1403","","10.1039/b707170a","","","0.71069","MoKα","","0.153","0.0847","","","0.1264","0.1569","","","","","","1.114","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052212","17.118","0.004","11.668","0.003","18.793","0.005","90","","99.925","0.006","90","","3697.4","1.6","298","2","298","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C36.5 H41 F6 Fe N2 Ni O2 P Ru -","- C33 H37 F6 Fe N2 Ni O2 P Ru -","- C132 H148 F24 Fe4 N8 Ni4 O8 P4 Ru4 -","4","1","","Fuentealba, Mauricio; Hamon, Jean-René; Carrillo, David; Manzur, Carolina","Trinuclear π-conjugated chromophores formed by a neutral ferrocenyl group and a cationic mixed ruthenium sandwich linked through an unsymmetrical Schiff-base complex spacer","New Journal of Chemistry","2007","31","10","1815","","10.1039/b707934f","","","0.71073","MoKα","","0.2755","0.0844","","","0.1926","0.2538","","","","","","0.801","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052213","11.0723","0.001","9.9509","0.0009","18.5611","0.0017","90","","106.637","0.001","90","","1959.4","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Fe N2 Ni O2 -","- C23 H22 Fe N2 Ni O2 -","- C92 H88 Fe4 N8 Ni4 O8 -","4","1","","Fuentealba, Mauricio; Hamon, Jean-René; Carrillo, David; Manzur, Carolina","Trinuclear π-conjugated chromophores formed by a neutral ferrocenyl group and a cationic mixed ruthenium sandwich linked through an unsymmetrical Schiff-base complex spacer","New Journal of Chemistry","2007","31","10","1815","","10.1039/b707934f","","","0.71073","MoKα","","0.0573","0.0438","","","0.109","0.117","","","","","","1.043","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052214","7.4291","0.0004","9.8933","0.0006","11.8779","0.0007","73.116","0.003","78.757","0.003","86.088","0.004","819.28","0.08","100","2","100","2","","","","","","","synthesis as described","6","P -1","-P 1","2","Compound X","","","- C11 H11 Fe2 N O7 S2 -","- C11 H11 Fe2 N O7 S2 -","- C22 H22 Fe4 N2 O14 S4 -","2","1","","Capon, Jean-François; Ezzaher, Salah; Gloaguen, Frédéric; Pétillon, François Y.; Schollhammer, Philippe; Talarmin, Jean; Davin, Thomas J.; McGrady, John E.; Muir, Kenneth W.","Electrochemical and theoretical investigations of the reduction of [Fe2(CO)5L{µ-SCH2XCH2S}] complexes related to [FeFe] hydrogenase","New Journal of Chemistry","2007","31","12","2052","","10.1039/b709273c","","x-ray","0.71073","MoKα","","0.0386","0.0299","","","0.0747","0.0799","","","","","","1.091","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052215","44.988","0.018","9.206","0.004","16.552","0.006","90","","108.938","0.007","90","","6484","5","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H45 Fe N O11 -","- C31 H45 Fe N O11 -","- C248 H360 Fe8 N8 O88 -","8","1","","McKeogh, Ian; Hill, Jonathan P.; Collins, Emily S.; McCabe, Thomas; Powell, Annie K.; Schmitt, Wolfgang","Self-assembly of FeIII complexes via hydrogen bonded water molecules into supramolecular coordination networks","New Journal of Chemistry","2007","31","11","1882","","10.1039/b711185a","","","0.71073","MoKα","","0.0518","0.0393","","","0.1042","0.1143","","","","","","1.097","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052216","9.25","0.002","12.011","0.003","14.326","0.004","90","","92.618","0.003","90","","1590","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15.5 Cd1.5 N5 O5.75 -","- C11 H14 Cd1.5 N5 O5.75 -","- C44 H56 Cd6 N20 O23 -","4","1","","Yang, En-Cui; Zhao, Hong-Kun; Ding, Bin; Wang, Xiu-Guang; Zhao, Xiao-Jun","The first 2D trinuclear Cd(ii)-complex with adenine nucleobase: hydrothermal synthesis, crystal structure and fluorescent properties","New Journal of Chemistry","2007","31","11","1887","","10.1039/b712387f","","","0.71073","MoKα","","0.0511","0.0362","","","0.0836","0.0918","","","","","","1.034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052217","21.66","0.004","4.7544","0.0009","9.9321","0.0019","90","","93.912","0.003","90","","1020.4","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-((1-pyrazolyl)methyl)benzamide","4-[(1-pyrazolyl)methyl]benzamide","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C44 H44 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.1042","0.0522","","","0.1146","0.1342","","","","","","0.974","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052218","8.4005","0.0007","8.0671","0.0007","18.0477","0.0018","90","","102.621","0.006","90","","1193.5","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","4-((3,5-dimethylpyrazol-1-yl)methyl)benzamide","4-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H15 N3 O -","- C13 H15 N3 O -","- C52 H60 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0892","0.0491","","","0.1184","0.1309","","","","","","0.934","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052219","12.437","0.003","8.8195","0.0017","12.468","0.002","90","","114.488","0.006","90","","1244.6","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","BS-3-93-3G 3-((4-bromo-3,5-dimethylpyrazol-1- yl)methyl)benzamide, succinic acid","BS-3-93-3G 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]benzamide, succinic acid","","- C13 H14 Br N3 O -","- C13 H14 Br N3 O -","- C52 H56 Br4 N12 O4 -","4","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0319","0.0234","","","0.0588","0.0622","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052220","7.7873","0.0005","8.113","0.0006","8.84","0.0006","77.6614","0.0013","74.4604","0.0013","68.3976","0.0012","496.14","0.06","100","2","100","2","","","","","","","","4","P -1","-P 1","2","3-((1-pyrazolyl)methyl)benzamide","3-[(1-pyrazolyl)methyl]benzamide","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C22 H22 N6 O2 -","2","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0489","0.0449","","","0.1249","0.1292","","","","","","1.081","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052221","8.0162","0.0004","8.0603","0.0004","10.4542","0.0005","97.253","0.002","106.06","0.002","109.335","0.002","594.57","0.05","100","2","100","2","","","","","","","","4","P -1","-P 1","2","BS-3-92-4 3-((3,5-dimethylpyrazol-1-yl)methyl)benzamide","BS-3-92-4 3-[(3,5-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H15 N3 O -","- C13 H15 N3 O -","- C26 H30 N6 O2 -","2","1","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.0556","0.0434","","","0.1205","0.1299","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052222","8.9062","0.0012","11.6933","0.0018","14.146","0.002","73.396","0.01","74.274","0.009","70.553","0.009","1305.8","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","BS-3-93-4f 3-((3-bromo-2,4-dimethylpyrazol-1- yl)methyl)benzamide","BS-3-93-4f 3-[(3-bromo-2,4-dimethylpyrazol-1-yl)methyl]benzamide","","- C13 H14 Br N3 O -","- C13 H14 Br N3 O -","- C52 H56 Br4 N12 O4 -","4","2","","Aakeröy, Christer B.; Scott, Benjamin M. T.; Desper, John","How robust is the hydrogen-bonded amide ‘ladder’ motif?","New Journal of Chemistry","2007","31","12","2044","","10.1039/b715610c","","","0.71073","MoKα","","0.145","0.0704","","","0.1928","0.2376","","","","","","1.033","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052223","34.86","0.04","14.79","0.017","40.64","0.04","90","","97.108","0.01","90","","20792","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C81 H115 N27 O20.5 Y2 -","- C81 H105 N27 O20.5 Y2 -","- C648 H840 N216 O164 Y16 -","8","1","","Michael J. Hudson; Carole E. Boucher; Damien Braekers; Jean F. Desreux; Michael G. B. Drew; Mark R. St J. Foreman; Laurence M. Harwood; Clément Hill; Charles Madic; Frank Marken; Tristan G. A. Youngs","New bis(triazinyl) pyridines for selective extraction of americium(<small>III</small>)","New Journal of Chemistry","2006","30","8","1171","","10.1039/b514108g","","","0.71073","MoKα","","0.2879","0.094","","","0.2028","0.2678","","","","","","0.841","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052224","14.496","0.015","11.318","0.012","16.793","0.018","90","","102.403","0.01","90","","2691","5","293","2","293","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C27 H35 N7 -","- C27 H35 N7 -","- C108 H140 N28 -","4","1","","Michael J. Hudson; Carole E. Boucher; Damien Braekers; Jean F. Desreux; Michael G. B. Drew; Mark R. St J. Foreman; Laurence M. Harwood; Clément Hill; Charles Madic; Frank Marken; Tristan G. A. Youngs","New bis(triazinyl) pyridines for selective extraction of americium(<small>III</small>)","New Journal of Chemistry","2006","30","8","1171","","10.1039/b514108g","","","0.71073","MoKα","","0.1778","0.0874","","","0.2086","0.2422","","","","","","0.937","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052225","9.4608","0.0012","17.042","0.002","20.513","0.003","90","","98.124","0.002","90","","3274.1","0.7","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H43 N4 O6 P -","- C32 H43 N4 O6 P -","- C128 H172 N16 O24 P4 -","4","1","","Kumar, K. V. P. Pavan; Kumar, N. Satish; Kumara Swamy, K. C.","Structurally diverse penta- and hexacoordinate phosphorus compounds from the reaction of diethyl or diisopropyl azodicarboxylates with phosphorus(iii) compounds","New Journal of Chemistry","2006","30","5","717","","10.1039/b514839a","","","0.71073","MoKα","","0.0646","0.0473","","","0.1333","0.1431","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052226","17.235","0.003","18.659","0.004","13.113","0.003","90","","90","","90","","4217","1.5","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C41 H55 N4 O6 P -","- C41 H55 N4 O6 P -","- C164 H220 N16 O24 P4 -","4","0.5","","Kumar, K. V. P. Pavan; Kumar, N. Satish; Kumara Swamy, K. C.","Structurally diverse penta- and hexacoordinate phosphorus compounds from the reaction of diethyl or diisopropyl azodicarboxylates with phosphorus(iii) compounds","New Journal of Chemistry","2006","30","5","717","","10.1039/b514839a","","","0.71073","MoKα","","0.1132","0.0487","","","0.13","0.164","","","","","","0.989","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052227","16.7166","0.0011","15.0867","0.0019","19.0574","0.0014","90","","106.401","0.013","90","","4610.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C47 H58 N3 O7 P -","- C47 H58 N3 O7 P -","- C188 H232 N12 O28 P4 -","4","1","","Kumar, K. V. P. Pavan; Kumar, N. Satish; Kumara Swamy, K. C.","Structurally diverse penta- and hexacoordinate phosphorus compounds from the reaction of diethyl or diisopropyl azodicarboxylates with phosphorus(iii) compounds","New Journal of Chemistry","2006","30","5","717","","10.1039/b514839a","","","0.71073","MoKα","","0.2268","0.0724","","","0.1616","0.2228","","","","","","1.018","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052228","11.9655","0.0009","22.0001","0.0017","13.987","0.0011","90","","94.257","0.001","90","","3671.8","0.5","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H50 N3 O6 P S -","- C33 H50 N3 O6 P S -","- C132 H200 N12 O24 P4 S4 -","4","1","","Kumar, K. V. P. Pavan; Kumar, N. Satish; Kumara Swamy, K. C.","Structurally diverse penta- and hexacoordinate phosphorus compounds from the reaction of diethyl or diisopropyl azodicarboxylates with phosphorus(iii) compounds","New Journal of Chemistry","2006","30","5","717","","10.1039/b514839a","","","0.71073","MoKα","","0.0566","0.0404","","","0.1047","0.1163","","","","","","1.014","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052229","10.4788","0.0007","10.866","0.0007","16.3413","0.0011","92.567","0.001","103.112","0.001","111.997","0.001","1662.8","0.19","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H42 Cl N2 O6 P S -","- C30 H42 Cl N2 O6 P S -","- C60 H84 Cl2 N4 O12 P2 S2 -","2","1","","Kumar, K. V. P. Pavan; Kumar, N. Satish; Kumara Swamy, K. C.","Structurally diverse penta- and hexacoordinate phosphorus compounds from the reaction of diethyl or diisopropyl azodicarboxylates with phosphorus(iii) compounds","New Journal of Chemistry","2006","30","5","717","","10.1039/b514839a","","","0.71073","MoKα","","0.0607","0.0418","","","0.1051","0.1125","","","","","","0.962","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052230","9.274","0.002","17.798","0.003","24.057","0.007","90","","96.367","0.015","90","","3946.3","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H50 N3 O6 P S -","- C38 H50 N3 O6 P S -","- C152 H200 N12 O24 P4 S4 -","4","1","","Kumar, K. V. P. Pavan; Kumar, N. Satish; Kumara Swamy, K. C.","Structurally diverse penta- and hexacoordinate phosphorus compounds from the reaction of diethyl or diisopropyl azodicarboxylates with phosphorus(iii) compounds","New Journal of Chemistry","2006","30","5","717","","10.1039/b514839a","","","0.71073","MoKα","","0.1382","0.0575","","","0.1373","0.1938","","","","","","1.046","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052231","19.6085","0.0011","19.8928","0.0011","19.3009","0.0011","90","","111.853","0.001","90","","6987.7","0.7","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H45 N4 O6 P S -","- C33 H45 N4 O6 P S -","- C264 H360 N32 O48 P8 S8 -","8","2","","Kumar, K. V. P. Pavan; Kumar, N. Satish; Kumara Swamy, K. C.","Structurally diverse penta- and hexacoordinate phosphorus compounds from the reaction of diethyl or diisopropyl azodicarboxylates with phosphorus(iii) compounds","New Journal of Chemistry","2006","30","5","717","","10.1039/b514839a","","","0.71073","MoKα","","0.0686","0.0484","","","0.1352","0.1445","","","","","","1.031","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052232","10.6859","0.0004","10.7325","0.0004","14.5858","0.0005","73.297","0.003","74.559","0.003","77.321","0.003","1525.75","0.1","295","2","295","2","","","","","","","","3","P -1","-P 1","2","2,3-bis(4-benzyloxy-3-methoxy-benzilidene)-succinic acid methanol solvate","2,3-bis(4-benzyloxy-3-methoxy-benzilidene)-succinic acid methanol solvate","","- C35 H34 O9 -","- C35 H34 O9 -","- C70 H68 O18 -","2","1","","Giannellini, Valerio; Bambagiotti-Alberti, Massimo; Bruni, Bruno; Di Vaira, Massimo","Structural and conformational study of two solvates of a fulgenic acid derivative","New Journal of Chemistry","2006","30","4","647","","10.1039/b515266f","","","1.5418","CuKα","","0.0455","0.0369","","","0.0954","0.0991","","","","","","0.958","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052233","10.929","0.001","11.708","0.001","15.385","0.002","101.68","0.01","106.69","0.01","96.91","0.01","1812.9","0.4","295","2","295","2","","","","","","","","3","P -1","-P 1","2","2,3-bis(4-benzyloxy-3-methoxy-benzilidene)-succinic acid buthanol solvate","2,3-bis(4-benzyloxy-3-methoxy-benzilidene)-succinic acid buthanol solvate","","- C38 H40 O9 -","- C38 H40 O9 -","- C76 H80 O18 -","2","1","","Giannellini, Valerio; Bambagiotti-Alberti, Massimo; Bruni, Bruno; Di Vaira, Massimo","Structural and conformational study of two solvates of a fulgenic acid derivative","New Journal of Chemistry","2006","30","4","647","","10.1039/b515266f","","","1.5418","CuKα","","0.1054","0.0577","","","0.1575","0.1774","","","","","","0.787","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052234","10.54","0.001","11.616","0.001","18.944","0.006","101.42","0.01","104.02","0.01","98.35","0.01","2159.7","0.8","178","2","178","2","","","","","","","","3","P -1","-P 1","2","","","","- C49 H72 O3.5 -","- C49 H33.5 O3.5 -","- C98 H67 O7 -","2","1","","Torsten Müller; Wilhelm Seichter; Edwin Weber","Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions","New Journal of Chemistry","2006","30","5","751","","10.1039/b516244k","","","1.5418","CuKα","","0.1134","0.0993","","0.2778","0.2639","","","","1.205","1.303","1.303","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052235","6.401","0.003","9.533","0.003","11.538","0.003","103.85","0.03","92.84","0.03","105.71","0.03","653.1","0.4","133","2","133","2","","","","","","","","2","P -1","-P 1","2","","","","- C36 H38 -","- C36 H38 -","- C36 H38 -","1","0.5","","Torsten Müller; Wilhelm Seichter; Edwin Weber","Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions","New Journal of Chemistry","2006","30","5","751","","10.1039/b516244k","","","1.5418","CuKα","","0.0487","0.0385","","0.1163","0.105","","","","0.994","1.027","1.027","","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052236","6.662","0.0002","10.16","0.0003","11.1284","0.0003","114.744","0.002","92.734","0.002","101.36","0.002","663.47","0.04","93","2","93","2","","","","","","","","2","P -1","-P 1","2","","","","- C38 H38 -","- C38 H38 -","- C38 H38 -","1","0.5","","Torsten Müller; Wilhelm Seichter; Edwin Weber","Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions","New Journal of Chemistry","2006","30","5","751","","10.1039/b516244k","","","0.71073","MoKα","","0.0698","0.0448","","","0.1158","0.1457","","","","","","0.967","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052237","6.853","0.003","25.898","0.003","37.211","0.003","90","0.03","95.29","0.03","90","0.03","6576","3","183","2","183","2","","","","","","","","2","C 1 c 1","C -2yc","9","","","","- C42 H48 -","- C42 H48 -","- C336 H384 -","8","2","","Torsten Müller; Wilhelm Seichter; Edwin Weber","Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions","New Journal of Chemistry","2006","30","5","751","","10.1039/b516244k","","","1.5418","CuKα","","0.0955","0.0696","","0.2077","0.1852","","","","1.079","1.089","1.089","","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052238","21.7567","0.0007","12.5555","0.0004","19.2403","0.0006","90","","109.834","0.002","90","","4944","0.3","93","2","93","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C64 H76 O2 -","- C64 H76 O2 -","- C256 H304 O8 -","4","1","","Torsten Müller; Wilhelm Seichter; Edwin Weber","Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions","New Journal of Chemistry","2006","30","5","751","","10.1039/b516244k","","","0.71073","MoKα","","0.0988","0.0613","","","0.1422","0.1703","","","","","","0.921","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052239","10.7534","0.0006","11.5581","0.0006","19.0689","0.0011","98.037","0.003","105.183","0.003","99.764","0.003","2211.5","0.2","93","2","93","2","","","","","","","","3","P -1","-P 1","2","","","","- C57 H62.5 N2.5 -","- C57 H62 N2.5 -","- C114 H124 N5 -","2","1","","Torsten Müller; Wilhelm Seichter; Edwin Weber","Synthesis, crystalline inclusion and structural study of bulkily stoppered and rigid framework molecular constructions","New Journal of Chemistry","2006","30","5","751","","10.1039/b516244k","","","0.71073","MoKα","","0.0811","0.047","","","0.0678","0.0705","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052240","11.987","","36.016","","8.417","","90","","105.49","","90","","3501.83","","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H35 Cl Cu N4 O11 Pd -","- C33 H35 Cl Cu N4 O11 Pd -","- C132 H140 Cl4 Cu4 N16 O44 Pd4 -","4","1","","Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius","Metal complexes as second-sphere ligands","New Journal of Chemistry","2006","30","4","521","","10.1039/b517989k","","","0.7107","MoKα","","0.1762","0.067","","","0.1201","0.1481","","","","","","1.005","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052241","12.543","","35.525","","8.437","","90","","105.64","","90","","3620.25","","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H33 Cl Cu N4 O11 Pd -","- C35 H33 Cl Cu N4 O11 Pd -","- C140 H132 Cl4 Cu4 N16 O44 Pd4 -","4","1","","Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius","Metal complexes as second-sphere ligands","New Journal of Chemistry","2006","30","4","521","","10.1039/b517989k","","","0.7107","MoKα","","0.2402","0.0706","","","0.1094","0.1501","","","","","","0.945","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052242","12.6386","0.0012","35.11","0.002","8.4367","0.0006","90","","106.723","0.01","90","","3585.4","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H35 Cl Cu N4 Ni O11 -","- C35 H35 Cl Cu N4 Ni O11 -","- C140 H140 Cl4 Cu4 N16 Ni4 O44 -","4","1","","Madalan, Augustin M.; Avarvari, Narcis; Andruh, Marius","Metal complexes as second-sphere ligands","New Journal of Chemistry","2006","30","4","521","","10.1039/b517989k","","","0.71073","MoKα","","0.136","0.0382","","","0.0545","0.0721","","","","","","0.757","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052243","11.587","0.002","18.303","0.004","21.919","0.004","90","","90","","90","","4648.5","1.5","200","2","200","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C21 H20 Co Cu N4 O4 S2 -","- C21 H20 Co Cu N4 O4 S2 -","- C168 H160 Co8 Cu8 N32 O32 S16 -","8","1","","Costes, Jean-Pierre; Gheorghe, Ruxandra; Andruh, Marius; Shova, Sergiu; Clemente Juan, Juan-Modesto","An original 1D Cu‒Co heterometallic compound: synthesis, structure and magnetic properties","New Journal of Chemistry","2006","30","4","572","","10.1039/b518029e","","","0.71073","MoKα","","0.1352","0.0555","","","0.0735","0.0937","","","","","","0.993","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052244","17.771","0.004","24.755","0.003","12.338","0.004","90","","90","","90","","5428","2","293","2","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H23 Fe2 N O5 W -","- C28 H23 Fe2 N O5 W -","- C224 H184 Fe16 N8 O40 W8 -","8","1","","Konrad Kowalski; Janusz Zakrzewski; Marcin Palusiak; Sławomir Domagała","Aryl (ferrocenyl)-capped ethenylazaferrocenes: synthesis, structure and electrochemistry","New Journal of Chemistry","2006","30","6","901","","10.1039/b600022c","","","0.71073","MoKα","","","0.0671","","","","0.1969","","","","","","0.93","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052245","8.2271","0.0002","14.3223","0.0003","15.7025","0.0004","76.877","0.004","89.004","0.004","82.816","0.004","1787.66","0.08","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H36 Cu2 N4 O12 S2 -","- C30 H36 Cu2 N4 O12 S2 -","- C60 H72 Cu4 N8 O24 S4 -","2","1","","Jérôme Pansanel; Abdelaziz Jouaiti; Sylvie Ferlay; Mir Wais Hosseini; Jean-Marc Planeix; Nathalie Kyritsakas","Molecular tectonics: generation of 1- and 2-D copper coordination networks by positional isomeric tectons based on a phenylenediamine backbone bearing two isonicotinoyl moieties","New Journal of Chemistry","2006","30","5","683","","10.1039/b600193a","","","0.71073","Mo-Kα","","0.124","0.076","","0.192","","0.095","","","2.438","","","1.149","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052246","33.799","0.001","12.7452","0.0005","8.5671","0.0005","90","","95.297","0.005","90","","3674.7","0.3","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H34 Cu2 N4 O12 -","- C27 H25 Cu2 N4 O12 -","- C108 H100 Cu8 N16 O48 -","4","0.5","","Jérôme Pansanel; Abdelaziz Jouaiti; Sylvie Ferlay; Mir Wais Hosseini; Jean-Marc Planeix; Nathalie Kyritsakas","Molecular tectonics: generation of 1- and 2-D copper coordination networks by positional isomeric tectons based on a phenylenediamine backbone bearing two isonicotinoyl moieties","New Journal of Chemistry","2006","30","5","683","","10.1039/b600193a","","","0.71073","Mo-Kα","","0.188","0.105","","0.29","","0.134","","","1.902","","","1.252","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052247","13.6671","0.0013","11.5908","0.0008","14.1521","0.0016","90","","117.785","0.003","90","","1983.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 Cu N4 O6 -","- C22 H20 Cu N4 O6 -","- C88 H80 Cu4 N16 O24 -","4","1","","Jérôme Pansanel; Abdelaziz Jouaiti; Sylvie Ferlay; Mir Wais Hosseini; Jean-Marc Planeix; Nathalie Kyritsakas","Molecular tectonics: generation of 1- and 2-D copper coordination networks by positional isomeric tectons based on a phenylenediamine backbone bearing two isonicotinoyl moieties","New Journal of Chemistry","2006","30","5","683","","10.1039/b600193a","","","0.71073","MoKα","","0.044","0.0349","","","0.0872","0.0911","","","","","","1.025","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052248","8.761","0.0002","9.762","0.0003","27.257","0.0013","93.675","0.0013","96.278","0.0012","95.237","0.004","2301.03","0.14","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H37 Br N2 O -","- C23 H37 Br N2 O -","- C92 H148 Br4 N8 O4 -","4","2","","Dobbs, William; Douce, Laurent; Allouche, Lionel; Louati, Alain; Malbosc, François; Welter, Richard","New ionic liquid crystals based on imidazolium salts","New Journal of Chemistry","2006","30","4","528","","10.1039/b600279j","","","0.71073","MoKα","","0.0798","0.0438","","","0.0953","0.1147","","","","","","1.073","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052249","10.272","0.003","9.579","0.002","34.807","0.007","90","","90.868","0.01","90","","3424.5","1.4","300","2","300","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(nitrato-O)bis(triphenylphosphine oxide-O)beryllium(II)","","- C36 H30 Be N2 O8 P2 -","- C36 H30 Be N2 O8 P2 -","- C144 H120 Be4 N8 O32 P8 -","4","1","","Davis, Martin F.; Levason, William; Ratnani, Raju; Reid, Gillian; Webster, Michael","Synthesis, spectroscopic studies and structural systematics of phosphine oxide complexes with Group II metal (beryllium?barium) nitrates","New Journal of Chemistry","2006","30","5","782","","10.1039/b600301j","","","0.71073","MoKα","","0.2107","0.0733","","","0.1146","0.1523","","","","","","1.009","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052250","15.343","0.003","13.705","0.002","17.202","0.003","90","","96.971","0.004","90","","3590.4","1.1","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(nitrato-O,O')bis(triphenylphosphine oxide-O)magnesium(II)","","- C36 H30 Mg N2 O8 P2 -","- C36 H30 Mg N2 O8 P2 -","- C144 H120 Mg4 N8 O32 P8 -","4","0.5","","Davis, Martin F.; Levason, William; Ratnani, Raju; Reid, Gillian; Webster, Michael","Synthesis, spectroscopic studies and structural systematics of phosphine oxide complexes with Group II metal (beryllium?barium) nitrates","New Journal of Chemistry","2006","30","5","782","","10.1039/b600301j","","","0.71073","MoKα","","0.0842","0.0488","","","0.1176","0.135","","","","","","1","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052251","21.771","0.004","10.699","0.001","24.074","0.004","90","","104.394","0.005","90","","5431.5","1.4","120","2","120","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","Bis(nitrato-O,O')bis(1,2-bis(diphenylphosphinoyl)benzene)Calcium(II)","","- C60 H48 Ca N2 O10 P4 -","- C60 H48 Ca N2 O10 P4 -","- C240 H192 Ca4 N8 O40 P16 -","4","1","","Davis, Martin F.; Levason, William; Ratnani, Raju; Reid, Gillian; Webster, Michael","Synthesis, spectroscopic studies and structural systematics of phosphine oxide complexes with Group II metal (beryllium?barium) nitrates","New Journal of Chemistry","2006","30","5","782","","10.1039/b600301j","","","0.71073","MoKα","","0.1278","0.055","","","0.1156","0.1401","","","","","","0.966","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052252","20.4255","0.0016","11.3207","0.001","22.212","0.0015","90","","90","","90","","5136.1","0.7","120","2","120","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","Bis(nitrato-O,O')bis(bis(diphenylphosphinoyl)methane)calcium(II)","","- C50 H44 Ca N2 O10 P4 -","- C50 H44 Ca N2 O10 P4 -","- C200 H176 Ca4 N8 O40 P16 -","4","1","","Davis, Martin F.; Levason, William; Ratnani, Raju; Reid, Gillian; Webster, Michael","Synthesis, spectroscopic studies and structural systematics of phosphine oxide complexes with Group II metal (beryllium?barium) nitrates","New Journal of Chemistry","2006","30","5","782","","10.1039/b600301j","","","0.71073","MoKα","","0.1165","0.0843","","","0.2133","0.2361","","","","","","1.041","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052253","16.6833","0.0002","16.9265","0.0002","20.0193","0.0002","90","","106.219","0.001","90","","5428.25","0.11","123","2","123","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C60 H48 La2 N18 -","- C60 H48 La2 N18 -","- C240 H192 La8 N72 -","4","1","","Deacon, Glen B.; Forsyth, Craig M.; Junk, Peter C.; Leary, Stuart G.","A rare earth alloy as a synthetic reagent: contrasting homometallic rare earth and heterobimetallic outcomes","New Journal of Chemistry","2006","30","4","592","","10.1039/b600868b","","","0.71073","MoKα","","0.0433","0.0279","","","0.0597","0.0665","","","","","","1.039","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052254","10.5878","0.0001","15.3676","0.0002","16.5439","0.0002","90","","101.688","0.001","90","","2636.03","0.05","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","ladpyabs","tetrakis(2,2'-dipyridylamido)bis(mu-2,2'dipyridylamido)dilanthanum(III)","","- C30 H24 La N9 -","- C30 H24 La N9 -","- C120 H96 La4 N36 -","4","1","","Deacon, Glen B.; Forsyth, Craig M.; Junk, Peter C.; Leary, Stuart G.","A rare earth alloy as a synthetic reagent: contrasting homometallic rare earth and heterobimetallic outcomes","New Journal of Chemistry","2006","30","4","592","","10.1039/b600868b","","","0.71073","MoKα","","0.042","0.0327","","","0.0851","0.0896","","","","","","1.051","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052255","15.499","0.003","19.15","0.004","17.485","0.004","90","","90.67","0.03","90","","5189.3","1.9","123","2","123","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Ni2La(8OQ)7","hexakis(mu-(O)-8-quinolinolato)(8-quinolinolato-kappa:N,O(La) dinickel(II)lanthanum(III) (NiLaNi)","","- C63 H36 La N7 Ni2 O7 -","- C63 H36 La N7 Ni2 O7 -","- C252 H144 La4 N28 Ni8 O28 -","4","0.5","","Deacon, Glen B.; Forsyth, Craig M.; Junk, Peter C.; Leary, Stuart G.","A rare earth alloy as a synthetic reagent: contrasting homometallic rare earth and heterobimetallic outcomes","New Journal of Chemistry","2006","30","4","592","","10.1039/b600868b","","","0.71073","MoKα","","0.1692","0.0595","","","0.0949","0.1279","","","","","","1.02","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052256","14.368","0.009","6.132","0.004","3.778","0.002","87.46","0.05","100.5","0.04","92.94","0.04","326.6","0.3","298","1","298","1","","","","","","","","4","P -1","-P 1","2","4-Chlorobenzoic acid","4-Chlorobenzoic acid","","- C7 H5 Cl O2 -","- C7 H5 Cl O2 -","- C14 H10 Cl2 O4 -","2","1","","Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman","Temperature dependence of proton transfer in 4-chlorobenzoic acid","New Journal of Chemistry","2006","30","7","979","","10.1039/b601123c","","neutron","","neutron","","0.088","","","0.063","","","","","","","","3.92","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052257","14.21","0.006","6.072","0.002","3.747","0.001","87.68","0.03","100.32","0.03","93","0.03","317.48","0.19","100","1","100","1","","","","","","","","4","P -1","-P 1","2","4-Chlorobenzoic acid","4-Chlorobenzoic acid","","- C7 H5 Cl O2 -","- C7 H5 Cl O2 -","- C14 H10 Cl2 O4 -","2","1","","Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman","Temperature dependence of proton transfer in 4-chlorobenzoic acid","New Journal of Chemistry","2006","30","7","979","","10.1039/b601123c","","neutron","","neutron","","0.083","","","0.064","","","","","","","","3.12","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052258","14.22","0.006","6.087","0.002","3.766","0.001","87.91","0.04","100.22","0.03","92.97","0.03","320.25","0.19","133","1","133","1","","","","","","","","4","P -1","-P 1","2","4-Chlorobenzoic acid","4-Chlorobenzoic acid","","- C7 H5 Cl O2 -","- C7 H5 Cl O2 -","- C14 H10 Cl2 O4 -","2","1","","Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman","Temperature dependence of proton transfer in 4-chlorobenzoic acid","New Journal of Chemistry","2006","30","7","979","","10.1039/b601123c","","neutron","","neutron","","0.078","","","0.06","","","","","","","","2.58","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052259","14.209","0.007","6.12","0.002","3.794","0.001","88.31","0.04","100.19","0.04","93.03","0.03","324.2","0.2","200","1","200","1","","","","","","","","4","P -1","-P 1","2","4-Chlorobenzoic acid","4-Chlorobenzoic acid","","- C7 H5 Cl O2 -","- C7 H5 Cl O2 -","- C14 H10 Cl2 O4 -","2","1","","Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman","Temperature dependence of proton transfer in 4-chlorobenzoic acid","New Journal of Chemistry","2006","30","7","979","","10.1039/b601123c","","neutron","","neutron","","0.077","","","0.054","","","","","","","","2.42","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052260","14.272","0.008","6.141","0.003","3.813","0.002","88.53","0.04","100.11","0.04","93.18","0.03","328.4","0.3","250","1","250","1","","","","","","","","4","P -1","-P 1","2","4-Chlorobenzoic acid","4-Chlorobenzoic acid","","- C7 H5 Cl O2 -","- C7 H5 Cl O2 -","- C14 H10 Cl2 O4 -","2","1","","Wilson, Chick C.; Xu, Xuelian; Florence, Alastair J.; Shankland, Norman","Temperature dependence of proton transfer in 4-chlorobenzoic acid","New Journal of Chemistry","2006","30","7","979","","10.1039/b601123c","","neutron","","neutron","","0.086","","","0.061","","","","","","","","2.84","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052261","11.1301","0.0014","19.875","0.002","16.4137","0.0016","90","","109.858","0.01","90","","3415","0.7","180","","180","","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H30 B Cl2 N6 Nb -","- C33 H30 B Cl2 N6 Nb -","- C132 H120 B4 Cl8 N24 Nb4 -","4","1","","Pascal Oulié; Johannes Teichert; Laure Vendier; Céline Dablemont; Michel Etienne","Aromatic interactions in hydrotris(3-methylindazolyl)borate organoniobium complexes: control of an alkyne ligand orientation in the crystal","New Journal of Chemistry","2006","30","5","679","","10.1039/b601652a","","","0.71073","MoKα","","0.0894","0.0475","","","0.0983","0.1105","","","","","","0.877","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052262","14.075","0.0013","8.841","0.0008","14.3377","0.0013","90","","119.052","0.001","90","","1559.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H44 Cl2 N4 Pd -","- C30 H44 Cl2 N4 Pd -","- C60 H88 Cl4 N8 Pd2 -","2","0.5","","Zou, Gang; Huang, Wen; Xiao, Yuanjing; Tang, Jie","Heck reaction catalysed by palladium supported with an electron-rich benzimidazolylidene generated in situ: remarkable ligand electronic effects and controllable mono- and di-arylation","New Journal of Chemistry","2006","30","5","803","","10.1039/b601833e","","","0.71073","MoKα","","0.0886","0.0719","","","0.2101","0.2252","","","","","","0.974","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052263","8.6005","0.0014","13.217","0.002","18.918","0.003","90","","91.575","0.004","90","","2149.6","0.6","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H23 F6 N2 P Pd -","- C22 H23 F6 N2 P Pd -","- C88 H92 F24 N8 P4 Pd4 -","4","1","","Ragaini, Fabio; Gasperini, Michela; Parma, Paolo; Gallo, Emma; Casati, Nicola; Macchi, Piero","Stability-inducing strain: application to the synthesis of alkyl-BIAN ligands (alkyl-BIAN = bis(alkyl)acenaphthenequinonediimine)","New Journal of Chemistry","2006","30","7","1046","","10.1039/b602257j","","","0.71073","MoKα","","0.0695","0.0467","","","0.1179","0.1347","","","","","","1.09","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052264","7.2312","0.0008","16.2043","0.0018","15.9806","0.0018","90","","91.2048","0.0019","90","","1872.1","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 Cl2 N2 Zn -","- C20 H20 Cl2 N2 Zn -","- C80 H80 Cl8 N8 Zn4 -","4","1","","Ragaini, Fabio; Gasperini, Michela; Parma, Paolo; Gallo, Emma; Casati, Nicola; Macchi, Piero","Stability-inducing strain: application to the synthesis of alkyl-BIAN ligands (alkyl-BIAN = bis(alkyl)acenaphthenequinonediimine)","New Journal of Chemistry","2006","30","7","1046","","10.1039/b602257j","","x-ray","0.71069","MoKα","","0.0816","0.0377","","","0.076","0.0889","","","","","","1.002","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052265","9.3088","0.0006","15.438","0.0009","15.9947","0.0009","90","","99.803","0.002","90","","2265","0.2","298","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 Cl2 N2 Zn -","- C26 H28 Cl2 N2 Zn -","- C104 H112 Cl8 N8 Zn4 -","4","1","","Ragaini, Fabio; Gasperini, Michela; Parma, Paolo; Gallo, Emma; Casati, Nicola; Macchi, Piero","Stability-inducing strain: application to the synthesis of alkyl-BIAN ligands (alkyl-BIAN = bis(alkyl)acenaphthenequinonediimine)","New Journal of Chemistry","2006","30","7","1046","","10.1039/b602257j","","","0.71069","MoKα","","0.1076","0.0486","","","0.11","0.145","","","","","","1.06","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052266","11.3215","0.001","11.7432","0.0011","13.7576","0.0012","103.925","0.002","108.377","0.002","108.885","0.002","1518","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H38 Br2 Cl2 N2 Ni -","- C33 H38 Br2 Cl2 N2 Ni -","- C66 H76 Br4 Cl4 N4 Ni2 -","2","1","","Ragaini, Fabio; Gasperini, Michela; Parma, Paolo; Gallo, Emma; Casati, Nicola; Macchi, Piero","Stability-inducing strain: application to the synthesis of alkyl-BIAN ligands (alkyl-BIAN = bis(alkyl)acenaphthenequinonediimine)","New Journal of Chemistry","2006","30","7","1046","","10.1039/b602257j","","","0.71069","MoKα","","0.0855","0.0469","","","0.108","0.1243","","","","","","1.022","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052267","16.64","0.001","13.269","0.001","18.77","0.001","90","","90","","90","","4144.3","0.5","200","","","","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C18 H20 Cl4 Mn N4 -","- C18 H20 Cl4 Mn N4 -","- C144 H160 Cl32 Mn8 N32 -","8","","","Anita Kübel-Pollak; Craig J. Matthews; Simon Verdan; Bernard Bocquet; Xavier Melich; Alan F. Williams; Francine Lavergnat; Pierre-Yves Morgantini; Gérald Bernardinelli","Conformational effects in molecular tectons containing protonated benzimidazole cations","New Journal of Chemistry","2006","30","6","851","","10.1039/b602468h","","","1.5418","CuKα","","","0.046","","","","0.044","","","","","","1.58","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052268","15.483","0.003","12.705","0.001","23.177","0.002","90","","90.971","0.008","90","","4558.5","1","200","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H55 Cl4 N9 -","- C46 H55 Cl4 N9 -","- C184 H220 Cl16 N36 -","4","1","","Anita Kübel-Pollak; Craig J. Matthews; Simon Verdan; Bernard Bocquet; Xavier Melich; Alan F. Williams; Francine Lavergnat; Pierre-Yves Morgantini; Gérald Bernardinelli","Conformational effects in molecular tectons containing protonated benzimidazole cations","New Journal of Chemistry","2006","30","6","851","","10.1039/b602468h","","","1.54183","CuKα","","","0.066","","","","0.062","","","","","","1.25","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052269","9.5492","0.0008","9.8088","0.0009","14.7179","0.0013","84.185","0.01","86.801","0.01","65.969","0.009","1252.4","0.2","200","","","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H28 Cl4 Mn N4 O -","- C22 H28 Cl4 Mn N4 O -","- C44 H56 Cl8 Mn2 N8 O2 -","2","1","","Anita Kübel-Pollak; Craig J. Matthews; Simon Verdan; Bernard Bocquet; Xavier Melich; Alan F. Williams; Francine Lavergnat; Pierre-Yves Morgantini; Gérald Bernardinelli","Conformational effects in molecular tectons containing protonated benzimidazole cations","New Journal of Chemistry","2006","30","6","851","","10.1039/b602468h","","","0.71073","MoKα","","","0.029","","","","0.03","","","","","","1.17","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052270","8.5221","0.0007","11.804","0.001","14.884","0.001","90","","95.929","0.007","90","","1489.2","0.2","200","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H35 Cl3 N6 O2 -","- C29 H35 Cl3 N6 O2 -","- C58 H70 Cl6 N12 O4 -","2","1","","Anita Kübel-Pollak; Craig J. Matthews; Simon Verdan; Bernard Bocquet; Xavier Melich; Alan F. Williams; Francine Lavergnat; Pierre-Yves Morgantini; Gérald Bernardinelli","Conformational effects in molecular tectons containing protonated benzimidazole cations","New Journal of Chemistry","2006","30","6","851","","10.1039/b602468h","","","1.54183","CuKα","","","0.051","","","","0.049","","","","","","2.47","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052271","16.6939","0.0009","16.6939","0.0009","20.5208","0.0011","90","","90","","120","","4952.7","0.5","200","","","","","","","","","","","5","R -3 :H","-R 3","148","","","","- C30 H41 Br3 N6 O4 -","- C30 H41 Br3 N6 O3.99999 -","- C180 H246 Br18 N36 O23.9999 -","6","0.333333","","Anita Kübel-Pollak; Craig J. Matthews; Simon Verdan; Bernard Bocquet; Xavier Melich; Alan F. Williams; Francine Lavergnat; Pierre-Yves Morgantini; Gérald Bernardinelli","Conformational effects in molecular tectons containing protonated benzimidazole cations","New Journal of Chemistry","2006","30","6","851","","10.1039/b602468h","","","0.71073","MoKα","","","0.028","","","","0.028","","","","","","1.12","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052272","11.4172","0.0013","11.5432","0.0013","16.4193","0.0018","107.72","0.002","90.261","0.002","107.884","0.002","1950.1","0.4","136","2","136","2","","","","","","","","4","P -1","-P 1","2","","","","- C93 H88 Ce2 N16 -","- C93 H88 Ce2 N16 -","- C93 H88 Ce2 N16 -","1","0.5","","Walter, Marc D.; Fandos, Rosa; Andersen, Richard A.","Synthesis and magnetic properties of cerium macrocyclic complexes with tetramethyldibenzotetraaza[14]annulene, tmtaaH2","New Journal of Chemistry","2006","30","7","1065","","10.1039/b602644c","","","0.71073","MoKα","","0.0524","0.0468","","","0.1238","0.1288","","","","","","1.046","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052273","9.227","0.004","10.155","0.004","10.156","0.004","90","","106.496","0.007","90","","912.5","0.6","296","2","296","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C14 H17 N4 O6 Re -","- C14 H17 N4 O6 Re -","- C28 H34 N8 O12 Re2 -","2","0.5","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel","Non-covalent interactions between anions and a cationic rhenium diamine complex: structural characterization of the supramolecular adducts","New Journal of Chemistry","2006","30","6","838","","10.1039/b602907h","","","0.71073","MoKα","","0.0457","0.0412","","","0.1078","0.1102","","","","","","1.057","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052274","10.16","0.007","12.354","0.009","15.993","0.012","90","","90","","90","","2007","3","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H17 Cl N3 O7 Re -","- C14 H17 Cl N3 O7 Re -","- C56 H68 Cl4 N12 O28 Re4 -","4","1","","Sonia Nieto; Julio Pérez; Lucía Riera; Víctor Riera; Daniel Miguel","Non-covalent interactions between anions and a cationic rhenium diamine complex: structural characterization of the supramolecular adducts","New Journal of Chemistry","2006","30","6","838","","10.1039/b602907h","","","0.71073","MoKα","","0.0499","0.0452","","","0.1085","0.1131","","","","","","1.053","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052275","14.243","0.005","17.34","0.005","10.36","0.005","90.99","0.005","102.51","0.005","98.44","0.005","2467.7","1.6","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H62 O7 W -","- C53 H62 O7 W -","- C106 H124 O14 W2 -","2","1","","Arduini, Arturo; Massera, Chiara; Pochini, Andrea; Secchi, Andrea; Ugozzoli, Franco","Organic guests inclusion by tungsten-calix[4]arene hosts","New Journal of Chemistry","2006","30","6","952","","10.1039/b603006h","","","0.71069","MoKα","","0.125","0.0825","","","0.2014","0.2154","","","","","","0.913","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052276","8.789","0.005","17.6","0.005","16.397","0.005","90","","94.94","0.005","90","","2527","1.8","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H27 N O6 W -","- C31 H27 N O6 W -","- C124 H108 N4 O24 W4 -","4","1","","Arduini, Arturo; Massera, Chiara; Pochini, Andrea; Secchi, Andrea; Ugozzoli, Franco","Organic guests inclusion by tungsten-calix[4]arene hosts","New Journal of Chemistry","2006","30","6","952","","10.1039/b603006h","","","0.71069","MoKα","","0.1169","0.067","","","0.1629","0.1801","","","","","","0.857","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052277","13.292","0.005","13.292","0.005","13.743","0.005","90","","90","","90","","2428.1","1.6","295","2","293","2","","","","","","","","5","P 4/n :2","-P 4a","85","","","","- C13.5 H14 N0.25 O1.25 W0.25 -","- C13.5 H14.75 N0.25 O1.25 W0.25 -","- C108 H118 N2 O10 W2 -","8","1","","Arduini, Arturo; Massera, Chiara; Pochini, Andrea; Secchi, Andrea; Ugozzoli, Franco","Organic guests inclusion by tungsten-calix[4]arene hosts","New Journal of Chemistry","2006","30","6","952","","10.1039/b603006h","","","0.71069","MoKα","","0.0668","0.0402","","","0.0908","0.0995","","","","","","0.78","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052278","11.302","0.005","14.802","0.005","17.226","0.005","90","","91.05","0.005","90","","2881.3","1.8","295","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 O8 W -","- C32 H30 O8 W -","- C128 H120 O32 W4 -","4","1","","Arduini, Arturo; Massera, Chiara; Pochini, Andrea; Secchi, Andrea; Ugozzoli, Franco","Organic guests inclusion by tungsten-calix[4]arene hosts","New Journal of Chemistry","2006","30","6","952","","10.1039/b603006h","","","0.71069","MoKα","","0.0664","0.0303","","","0.0643","0.0689","","","","","","0.843","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052279","31.1616","0.0011","10.9342","0.0004","8.3276","0.0003","90","","104.131","0.002","90","","2751.58","0.17","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H27 N7 O4 -","- C32 H27 N7 O4 -","- C128 H108 N28 O16 -","4","0.5","","Evans, Louise S.; Gale, Philip A.; Light, Mark E.; Quesada, Roberto","Pyrrolylamidourea based anion receptors","New Journal of Chemistry","2006","30","7","1019","","10.1039/b603223k","","","0.71073","MoKα","","0.0695","0.0481","","","0.1073","0.1168","","","","","","1.046","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052280","16.0263","0.0005","22.3943","0.0007","19.782","0.0008","90","","112.759","0.001","90","","6546.9","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C138 H176 Cu8 N4 O6 S12 -","- C138 H160 Cu8 N4 O6 S12 -","- C276 H320 Cu16 N8 O12 S24 -","2","0.5","","Stéphane A. Baudron; Mir Wais Hosseini; Nathalie Kyritsakas","Octanuclear Cu(<small>I</small>) cubic complex decorated with six peripheral chelates","New Journal of Chemistry","2006","30","7","1083","","10.1039/b603733j","","","0.71073","MoKα","","0.137","0.0674","","","0.1757","0.2115","","","","","","1.039","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052281","39.0401","0.0013","17.3267","0.0006","24.2754","0.0008","90","","124.138","0.002","90","","13591.3","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C116 H152 Cu8 N16 O6 S18 -","- C116 H128 Cu8 N16 O6 S18 -","- C464 H512 Cu32 N64 O24 S72 -","4","0.5","","Stéphane A. Baudron; Mir Wais Hosseini; Nathalie Kyritsakas","Octanuclear Cu(<small>I</small>) cubic complex decorated with six peripheral chelates","New Journal of Chemistry","2006","30","7","1083","","10.1039/b603733j","","","0.71073","MoKα","","0.1233","0.0666","","","0.2064","0.2466","","","","","","1.068","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052282","18.6672","0.0007","8.7381","0.0003","18.9133","0.0007","90","","101.396","0.002","90","","3024.24","0.19","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H90 Cu N8 S4 -","- C60 H90 Cu N8 S4 -","- C120 H180 Cu2 N16 S8 -","2","0.5","","Stéphane A. Baudron; Mir Wais Hosseini; Nathalie Kyritsakas","Octanuclear Cu(<small>I</small>) cubic complex decorated with six peripheral chelates","New Journal of Chemistry","2006","30","7","1083","","10.1039/b603733j","","","0.71073","MoKα","","0.104","0.0584","","","0.15","0.1727","","","","","","1.044","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052283","17.805","0.004","21.759","0.004","36.438","0.007","90","","96.34","0.03","90","","14030","5","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C128 H184 Ag8 N16 O8 S8 -","- C128 H40 Ag8 N16 O8 S8 -","- C512 H160 Ag32 N64 O32 S32 -","4","1","","Habtu, Michael M.; Bourne, Susan A.; Koch, Klaus R.; Luckay, Robert C.","Competitive bulk liquid membrane transport and solvent extraction of some transition and post-transition metal ions using acylthiourea ligands as ionophores","New Journal of Chemistry","2006","30","8","1155","","10.1039/b603802f","","","0.71073","MoKα","","0.0918","0.0537","","","0.1438","0.1689","","","","","","1.03","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052284","10.3953","0.0019","6.5823","0.0012","43.283","0.008","90","","93.228","0.005","90","","2956.9","0.9","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 N6 Na2 O6 S6 -","- C22 H20 N6 Na2 O6 S6 -","- C88 H80 N24 Na8 O24 S24 -","4","1","","Zhu, Qin-Yu; Lin, Hai-Hong; Dai, Jie; Bian, Guo-Qing; Zhang, Yong; Lu, Wen","A supramolecular system of tetrathiafulvalene, assembled by hydrogen bonding, ionic coordination bonding and topological cooperation","New Journal of Chemistry","2006","30","8","1140","","10.1039/b604258a","","","0.71073","MoKα","","0.0531","0.0451","","","0.0891","0.0921","","","","","","1.182","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052285","32.197","0.005","32.197","0.005","71.112","0.014","90","","90","","120","","63842","19","153","2","153","2","","","","","","","","8","R -3 c :H","-R 3 2""c","167","","","","- C92 H90 Co N6 Na O45 S8 Yb0.33 -","- C92 H56 Co N6 Na O44.94 S8 Yb0.333333 -","- C1656 H1008 Co18 N108 Na18 O808.92 S144 Yb6 -","18","0.5","","Smith, Christopher B.; Barbour, Leonard J.; Makha, Mohamed; Raston, Colin L.; Sobolev, Alexandre N.","Unlocking the elusive binding cavity in p-sulfonatocalix[8]arene","New Journal of Chemistry","2006","30","7","991","","10.1039/b604513h","","","0.71073","MoKα","","0.3762","0.1801","","","0.4213","0.5215","","","","","","1.178","","","","has coordinates,has disorder","180076","2020-10-21","18:00:00",""
"7052286","18.026","0.006","29.133","0.005","30.927","0.008","63.44","0.02","78.13","0.03","72.37","0.03","13798","7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C252 H108 Cu9 F108 N18 O36 -","- C252 H108 Cu9 F108 N18 O36 -","- C504 H216 Cu18 F216 N36 O72 -","2","1","","Silke Winter; Edwin Weber; Lars Eriksson; Ingeborg Csöregh","New coordination polymer networks based on copper(<small>II</small>) hexafluoroacetylacetonate and pyridine containing building blocks: synthesis and structural study","New Journal of Chemistry","2006","30","12","1808","","10.1039/b604591j","","","0.71073","MoKα","","0.23","0.0722","","","0.16","0.2214","","","","","","0.842","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052287","7.2518","0.0008","7.4685","0.0009","20.571","0.002","94.368","0.002","94.193","0.002","92.638","0.002","1106.4","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H18 B2 N2 Ni O10 S4 -","- C14 H18 B2 N2 Ni O10 S4 -","- C28 H36 B4 N4 Ni2 O20 S8 -","2","1","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.0357","0.0266","","","0.0702","0.0747","","","","","","1.041","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052288","7.482","0.0015","7.4948","0.0015","20.573","0.004","94.45","0.03","95.44","0.03","92.08","0.03","1143.9","0.4","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H18 B2 N2 O10 Pd S4 -","- C14 H18 B2 N2 O10 Pd S4 -","- C28 H36 B4 N4 O20 Pd2 S8 -","2","1","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.0538","0.0413","","","0.0885","0.0986","","","","","","1.002","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052289","7.4202","0.0008","7.4598","0.0008","20.396","0.002","94.419","0.002","96.48","0.002","92.585","0.002","1116.8","0.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H18 B2 N2 O10 Pt S4 -","- C14 H18 B2 N2 O10 Pt S4 -","- C28 H36 B4 N4 O20 Pt2 S8 -","2","1","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.0507","0.0363","","","0.0793","0.0853","","","","","","1.035","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052290","3.6754","0.0006","10.5135","0.0017","12.215","0.002","102.091","0.002","96.403","0.003","98.557","0.002","451.4","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H14 B2 N2 O12 Pt -","- C14 H14 B2 N2 O12 Pt -","- C14 H14 B2 N2 O12 Pt -","1","0.5","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.0218","0.0218","","","0.0467","0.0468","","","","","","1.043","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052291","3.8956","0.0008","10.119","0.002","13.447","0.003","100.74","0.03","94.97","0.03","97.65","0.03","512.8","0.2","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H14 B2 Cu N2 O8 S4 -","- C14 H14 B2 Cu N2 O8 S4 -","- C14 H14 B2 Cu N2 O8 S4 -","1","0.5","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.1017","0.059","","","0.1328","0.1662","","","","","","0.966","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052292","3.905","0.0008","10.22","0.002","13.302","0.003","101.79","0.03","95.13","0.03","98.09","0.03","510.7","0.2","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H14 B2 N2 Ni O8 S4 -","- C14 H14 B2 N2 Ni O8 S4 -","- C14 H14 B2 N2 Ni O8 S4 -","1","0.5","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.0416","0.0328","","","0.078","0.1013","","","","","","1.051","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052293","3.9415","0.0008","10.164","0.002","13.431","0.003","100.46","0.03","94.77","0.03","98.41","0.03","520.1","0.2","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H14 B2 N2 O8 Pd S4 -","- C14 H14 B2 N2 O8 Pd S4 -","- C14 H14 B2 N2 O8 Pd S4 -","1","0.5","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.0333","0.0278","","","0.0699","0.092","","","","","","1.148","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052294","3.659","0.0007","10.172","0.002","12.576","0.003","103.24","0.03","96.89","0.03","98.1","0.03","445.42","0.18","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H14 B2 N2 O12 Pt -","- C14 H14 B2 N2 O12 Pt -","- C14 H14 B2 N2 O12 Pt -","1","0.5","","Kara, Hulya; Adams, Christopher J.; Orpen, A. Guy; Podesta, Thomas J.","Pyridinium boronic acid salts in crystal synthesis","New Journal of Chemistry","2006","30","10","1461","","10.1039/b604729g","","","0.71073","MoKα","","0.0151","0.0151","","","0.0375","0.0375","","","","","","1.083","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052295","5.4044","0.0006","10.4485","0.0011","17.4481","0.0019","90","","91.73","0.009","90","","984.81","0.19","170","2","170","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H8 Fe N10 O4 -","- C16 H8 Fe N10 O4 -","- C32 H16 Fe2 N20 O8 -","2","0.5","","Emeric Lefebvre; Françoise Conan; Nathalie Cosquer; Jean-Michel Kerbaol; Mathieu Marchivie; Jean Sala-Pala; Marek M. Kubicki; Estelle Vigier; Carlos J. Gomez Garcia","Syntheses, structural characterisation and magnetic properties of Fe(<small>II</small>) and Mn(<small>II</small>) compounds with the pentacyanopropenido ligand; structural characterisation of a substituted pyrazolo[1,5-<i>a</i>]pyrimidine","New Journal of Chemistry","2006","30","8","1197","","10.1039/b605030a","","","0.71073","MoKα","","0.0492","0.0363","","","0.0941","0.099","","","","","","1.052","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052296","5.4059","0.0002","10.5483","0.0003","17.5513","0.0007","90","","91.522","0.002","90","","1000.48","0.06","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H8 Mn N10 O4 -","- C16 H8 Mn N10 O4 -","- C32 H16 Mn2 N20 O8 -","2","0.5","","Emeric Lefebvre; Françoise Conan; Nathalie Cosquer; Jean-Michel Kerbaol; Mathieu Marchivie; Jean Sala-Pala; Marek M. Kubicki; Estelle Vigier; Carlos J. Gomez Garcia","Syntheses, structural characterisation and magnetic properties of Fe(<small>II</small>) and Mn(<small>II</small>) compounds with the pentacyanopropenido ligand; structural characterisation of a substituted pyrazolo[1,5-<i>a</i>]pyrimidine","New Journal of Chemistry","2006","30","8","1197","","10.1039/b605030a","","","0.71073","MoKα","","0.0643","0.0392","","","0.0842","0.0959","","","","","","1.034","","","","has coordinates","180076","2020-10-21","18:00:00",""
"7052297","11.14","0.003","11.497","0.003","16.854","0.004","90","0.018","90","0.019","90","0.019","2158.6","1","170","2","170","2","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","","","","- C17.5 H0 Fe N10 O0.5 -","- C17.5 Fe N10 O0.5 -","- C70 Fe4 N40 O2 -","4","0.5","","Emeric Lefebvre; Françoise Conan; Nathalie Cosquer; Jean-Michel Kerbaol; Mathieu Marchivie; Jean Sala-Pala; Marek M. Kubicki; Estelle Vigier; Carlos J. Gomez Garcia","Syntheses, structural characterisation and magnetic properties of Fe(<small>II</small>) and Mn(<small>II</small>) compounds with the pentacyanopropenido ligand; structural characterisation of a substituted pyrazolo[1,5-<i>a</i>]pyrimidine","New Journal of Chemistry","2006","30","8","1197","","10.1039/b605030a","","x-ray","0.71073","MoKα","","0.147","0.1222","","","0.2384","0.2524","","","","","","1.362","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052298","8.8515","0.0019","6.5515","0.0018","19.107","0.005","90","","96.48","0.02","90","","1100.9","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H2 N8 -","- C10 H2 N8 -","- C40 H8 N32 -","4","1","","Emeric Lefebvre; Françoise Conan; Nathalie Cosquer; Jean-Michel Kerbaol; Mathieu Marchivie; Jean Sala-Pala; Marek M. Kubicki; Estelle Vigier; Carlos J. Gomez Garcia","Syntheses, structural characterisation and magnetic properties of Fe(<small>II</small>) and Mn(<small>II</small>) compounds with the pentacyanopropenido ligand; structural characterisation of a substituted pyrazolo[1,5-<i>a</i>]pyrimidine","New Journal of Chemistry","2006","30","8","1197","","10.1039/b605030a","","","0.71073","MoKα","","0.0677","0.0492","","","0.1122","0.1229","","","","","","1.066","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052299","6.3523","0.0013","13.906","0.003","16.582","0.003","90","","90","","90","","1464.8","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H8 N8 O -","- C13 H8 N8 O -","- C52 H32 N32 O4 -","4","1","","Emeric Lefebvre; Françoise Conan; Nathalie Cosquer; Jean-Michel Kerbaol; Mathieu Marchivie; Jean Sala-Pala; Marek M. Kubicki; Estelle Vigier; Carlos J. Gomez Garcia","Syntheses, structural characterisation and magnetic properties of Fe(<small>II</small>) and Mn(<small>II</small>) compounds with the pentacyanopropenido ligand; structural characterisation of a substituted pyrazolo[1,5-<i>a</i>]pyrimidine","New Journal of Chemistry","2006","30","8","1197","","10.1039/b605030a","","","0.71073","MoKα","","0.0809","0.04","","","0.0549","0.0611","","","","","","0.929","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052300","15.323","0.003","9.3464","0.0015","17.451","0.003","90","","104.854","0.003","90","","2415.7","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H22 N4 O4 -","- C30 H22 N4 O4 -","- C120 H88 N16 O16 -","4","1","","Zhao, Yong-gang; Zhang, Bing-guang; Duan, Chun-ying; Lin, Zhi-hua; Meng, Qing-jin","A highly selective fluorescent sensor for fluoride through ESPT signaling transduction","New Journal of Chemistry","2006","30","8","1207","","10.1039/b605087e","","","0.71073","MoKα","","0.1129","0.0505","","","0.0659","0.076","","","","","","0.958","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052301","18.72","0.004","15.11","0.003","8.5745","0.0018","90","","94.249","0.004","90","","2418.7","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H21 N5 O4 -","- C29 H21 N5 O4 -","- C116 H84 N20 O16 -","4","0.5","","Zhao, Yong-gang; Zhang, Bing-guang; Duan, Chun-ying; Lin, Zhi-hua; Meng, Qing-jin","A highly selective fluorescent sensor for fluoride through ESPT signaling transduction","New Journal of Chemistry","2006","30","8","1207","","10.1039/b605087e","","","0.71073","MoKα","","0.0724","0.0617","","","0.1593","0.1688","","","","","","1.103","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052302","21.554","0.001","11.479","0.0005","8.9428","0.0004","90","","101.235","0.002","90","","2170.21","0.17","373","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","?","- C16 Br2 Fe N6 O3 S2 -","- C64 Br8 Fe4 N24 O12 S8 -","4","1","","Sébastien Floquet; Nathalie Guillou; Philippe Négrier; Eric Rivière; Marie-Laure Boillot","The crystallographic phase transition for a ferric thiosemicarbazone spin crossover complex studied by X-ray powder diffraction","New Journal of Chemistry","2006","30","11","1621","","10.1039/b605326b","powder diffraction","","","X-ray","","","","","","","","","8.2288","","","","","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052303","20.715","0.002","11.397","0.001","8.8804","0.0007","90","","90.258","0.002","90","","2096.5","0.3","150","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","?","- C16 Br2 Fe N6 O3 S2 -","- C64 Br8 Fe4 N24 O12 S8 -","4","1","","Sébastien Floquet; Nathalie Guillou; Philippe Négrier; Eric Rivière; Marie-Laure Boillot","The crystallographic phase transition for a ferric thiosemicarbazone spin crossover complex studied by X-ray powder diffraction","New Journal of Chemistry","2006","30","11","1621","","10.1039/b605326b","powder diffraction","","","X-ray","","","","","","","","","9.4009","","","","","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052304","18.0981","0.0011","9.9666","0.0006","16.1701","0.0009","90","","112.87","0.001","90","","2687.4","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H42 N4 O2 P2 -","- C20 H42 N4 O2 P2 -","- C80 H168 N16 O8 P8 -","4","1","","Bhuvan Kumar, N. N.; Chakravarty, Manab; Kumara Swamy, K. C.","Structure and reactivity of tautomeric forms of zwitterionic species from the reaction of phosphorus(iii) compounds with electron deficient alkenes and alkynes","New Journal of Chemistry","2006","30","11","1614","","10.1039/b605430g","","","0.71073","MoKα","","0.0842","0.0629","","","0.1824","0.2011","","","","","","1.064","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052305","9.516","0.0006","16.5945","0.0011","15.9106","0.001","90","","91.692","0.001","90","","2511.4","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H41 N5 P2 -","- C19 H41 N5 P2 -","- C76 H164 N20 P8 -","4","1","","Bhuvan Kumar, N. N.; Chakravarty, Manab; Kumara Swamy, K. C.","Structure and reactivity of tautomeric forms of zwitterionic species from the reaction of phosphorus(iii) compounds with electron deficient alkenes and alkynes","New Journal of Chemistry","2006","30","11","1614","","10.1039/b605430g","","","0.71073","MoKα","","0.0636","0.0536","","","0.1549","0.1647","","","","","","1.038","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052306","17.7038","0.0018","9.5956","0.001","17.7697","0.0018","90","","106.53","0.002","90","","2893.9","0.5","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C22 H44 N4 O4 P2 -","- C22 H44 N4 O4 P2 -","- C88 H176 N16 O16 P8 -","4","1","","Bhuvan Kumar, N. N.; Chakravarty, Manab; Kumara Swamy, K. C.","Structure and reactivity of tautomeric forms of zwitterionic species from the reaction of phosphorus(iii) compounds with electron deficient alkenes and alkynes","New Journal of Chemistry","2006","30","11","1614","","10.1039/b605430g","","","0.71073","MoKα","","0.0697","0.0647","","","0.1817","0.188","","","","","","1.053","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052307","9.7355","0.0006","11.2481","0.0006","17.0595","0.001","92.455","0.001","105.381","0.001","93.314","0.001","1794.91","0.18","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H53 N5 O2 P2 -","- C31 H53 N5 O2 P2 -","- C62 H106 N10 O4 P4 -","2","1","","Bhuvan Kumar, N. N.; Chakravarty, Manab; Kumara Swamy, K. C.","Structure and reactivity of tautomeric forms of zwitterionic species from the reaction of phosphorus(iii) compounds with electron deficient alkenes and alkynes","New Journal of Chemistry","2006","30","11","1614","","10.1039/b605430g","","","0.71073","MoKα","","0.0746","0.0602","","","0.1772","0.1905","","","","","","1.065","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052308","9.5994","0.0004","15.8414","0.0007","21.0477","0.0009","90","","91.5","0.001","90","","3199.6","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H48 N6 O5 P2 -","- C26 H48 N6 O5 P2 -","- C104 H192 N24 O20 P8 -","4","1","","Bhuvan Kumar, N. N.; Chakravarty, Manab; Kumara Swamy, K. C.","Structure and reactivity of tautomeric forms of zwitterionic species from the reaction of phosphorus(iii) compounds with electron deficient alkenes and alkynes","New Journal of Chemistry","2006","30","11","1614","","10.1039/b605430g","","","0.71073","MoKα","","0.0683","0.0585","","","0.1397","0.1458","","","","","","1.09","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052309","19.157","0.004","25.897","0.006","9.9046","0.0015","90","","90","","90","","4913.8","1.7","296","2","296","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C27 H30 N O2 P -","- C27 H30 N O2 P -","- C216 H240 N8 O16 P8 -","8","1","","Bhuvan Kumar, N. N.; Chakravarty, Manab; Kumara Swamy, K. C.","Structure and reactivity of tautomeric forms of zwitterionic species from the reaction of phosphorus(iii) compounds with electron deficient alkenes and alkynes","New Journal of Chemistry","2006","30","11","1614","","10.1039/b605430g","","","0.71073","MoKα","","0.0712","0.0498","","","0.1232","0.1325","","","","","","0.926","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052310","8.8437","0.0012","8.7562","0.0011","13.5885","0.0018","90","","102.355","0.003","90","","1027.9","0.2","297","2","297","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H30 Cl2 Cu N6 O8 -","- C12 H30 Cl2 Cu N6 O8 -","- C24 H60 Cl4 Cu2 N12 O16 -","2","0.5","","Zhang, Bing; Ni, Zhong-Hai; Cui, Ai-Li; Kou, Hui-Zhong","Heterometallic trinuclear CuIIMIII2 (M = Fe or Cr) complexes with novel bridges and unusual magnetic properties","New Journal of Chemistry","2006","30","9","1327","","10.1039/b605521d","","","0.71073","MoKα","","0.0931","0.0698","","","0.1809","0.1921","","","","","","1.099","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052311","15.74","0.003","13.5539","0.0016","13.4949","0.0014","90","","90.108","0.01","90","","2879","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 Cu Fe2 N18 O8 -","- C52 H62 Cu Fe2 N18 O8 -","- C104 H124 Cu2 Fe4 N36 O16 -","2","0.5","","Zhang, Bing; Ni, Zhong-Hai; Cui, Ai-Li; Kou, Hui-Zhong","Heterometallic trinuclear CuIIMIII2 (M = Fe or Cr) complexes with novel bridges and unusual magnetic properties","New Journal of Chemistry","2006","30","9","1327","","10.1039/b605521d","","","0.71073","MoKα","","0.17","0.0621","","","0.1136","0.161","","","","","","0.977","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052312","15.969","0.004","13.5984","0.0015","13.4235","0.0011","90","","90.115","0.012","90","","2914.9","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 Cr2 Cu N18 O8 -","- C52 H62 Cr2 Cu N18 O8 -","- C104 H124 Cr4 Cu2 N36 O16 -","2","0.5","","Zhang, Bing; Ni, Zhong-Hai; Cui, Ai-Li; Kou, Hui-Zhong","Heterometallic trinuclear CuIIMIII2 (M = Fe or Cr) complexes with novel bridges and unusual magnetic properties","New Journal of Chemistry","2006","30","9","1327","","10.1039/b605521d","","","0.71073","MoKα","","0.1571","0.069","","","0.1564","0.2004","","","","","","0.964","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052313","10.761","0.002","15.6358","0.0019","14.1161","0.0018","90","","94.63","0.012","90","","2367.4","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H48 Cu Fe2 N16 O6 -","- C46 H44 Cu Fe2 N16 O6 -","- C92 H88 Cu2 Fe4 N32 O12 -","2","0.5","","Zhang, Bing; Ni, Zhong-Hai; Cui, Ai-Li; Kou, Hui-Zhong","Heterometallic trinuclear CuIIMIII2 (M = Fe or Cr) complexes with novel bridges and unusual magnetic properties","New Journal of Chemistry","2006","30","9","1327","","10.1039/b605521d","","","0.71073","MoKα","","0.0555","0.0374","","","0.0958","0.1178","","","","","","1.105","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052314","6.1825","0.0008","18.9953","0.0015","16.605","0.002","90","","90.93","0.004","90","","1949.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","1alpha,2alpha,3beta,4beta-1,3-bis(2,3,5,6-tetrafluoro-4-iodo- phenyl)-2,4-bis(4-phenyl-dimethylamine)cyclobutane","","","- C34 H26 Cl6 F8 I2 N2 -","- C34 H26 Cl6 F8 I2 N2 -","- C68 H52 Cl12 F16 I4 N4 -","2","0.5","","Marras, Giovanni; Metrangolo, Pierangelo; Meyer, Franck; Pilati, Tullio; Resnati, Giuseppe; Vij, Ashwani","Solid state synthesis under supramolecular control of a 2D heterotetratopic self-complementary tecton tailored to halogen bonding","New Journal of Chemistry","2006","30","10","1397","","10.1039/b605958a","","","0.71073","MoKα","","0.0327","0.0281","","","0.077","0.0801","","","","","","1.045","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052315","10.174","0.002","11.671","0.002","13.043","0.004","90","","103.26","0.03","90","","1507.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","dimethyl-(4-(2-(2,3,5,6-tetrafluoro-4-iodo-phenyl)-vinyl)- phenyl)-amine","","","- C16 H12 F4 I N -","- C16 H12 F4 I N -","- C64 H48 F16 I4 N4 -","4","1","","Marras, Giovanni; Metrangolo, Pierangelo; Meyer, Franck; Pilati, Tullio; Resnati, Giuseppe; Vij, Ashwani","Solid state synthesis under supramolecular control of a 2D heterotetratopic self-complementary tecton tailored to halogen bonding","New Journal of Chemistry","2006","30","10","1397","","10.1039/b605958a","","","0.71073","MoKα","","0.0423","0.0361","","","0.0996","0.1048","","","","","","1.006","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052316","11.8168","0.0005","12.6942","0.0007","12.9752","0.0007","86.737","0.002","65.501","0.003","79.661","0.004","1742.02","0.16","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H88 Cl4 N4 O8 U2 -","- C72 H88 Cl4 N4 O8 U2 -","- C72 H88 Cl4 N4 O8 U2 -","1","0.5","","Lionel Salmon; Pierre Thuéry; Eric Rivière; Shinpei Miyamoto; Takehiko Yamato; Michel Ephritikhine","Synthesis, structure and magnetic behaviour of dinuclear uranium(<small>IV</small>) complexes with a ‘calixsalophen’ type macrocycle","New Journal of Chemistry","2006","30","8","1220","","10.1039/b606035h","","","0.71073","MoKα","","0.0443","0.033","","","0.0685","0.0717","","","","","","1.04","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052317","14.2822","0.0009","12.0928","0.0003","21.8206","0.0012","90","","91.604","0.003","90","","3767.2","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C81 H81 Cl4 N9 O4 U2 -","- C82 H76 Cl4 N8 O4 U2 -","- C164 H152 Cl8 N16 O8 U4 -","2","0.5","","Lionel Salmon; Pierre Thuéry; Eric Rivière; Shinpei Miyamoto; Takehiko Yamato; Michel Ephritikhine","Synthesis, structure and magnetic behaviour of dinuclear uranium(<small>IV</small>) complexes with a ‘calixsalophen’ type macrocycle","New Journal of Chemistry","2006","30","8","1220","","10.1039/b606035h","","","0.71073","MoKα","","0.055","0.0409","","","0.1104","0.116","","","","","","1.102","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052318","16.2734","0.0004","29.7951","0.001","20.3134","0.0005","90","","111.161","0.002","90","","9185.2","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C96 H124 N4 O17 U2 -","- C96 H124 N4 O17 U2 -","- C384 H496 N16 O68 U8 -","4","1","","Lionel Salmon; Pierre Thuéry; Eric Rivière; Shinpei Miyamoto; Takehiko Yamato; Michel Ephritikhine","Synthesis, structure and magnetic behaviour of dinuclear uranium(<small>IV</small>) complexes with a ‘calixsalophen’ type macrocycle","New Journal of Chemistry","2006","30","8","1220","","10.1039/b606035h","","","0.71073","MoKα","","0.0796","0.0486","","","0.0971","0.1086","","","","","","1.009","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052319","15.5199","0.0004","16.7753","0.0006","18.1932","0.0008","77.591","0.002","81.494","0.003","68.004","0.002","4277.3","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C91 H102 N6 O14 U2 -","- C91 H102 N6 O14 U2 -","- C182 H204 N12 O28 U4 -","2","1","","Lionel Salmon; Pierre Thuéry; Eric Rivière; Shinpei Miyamoto; Takehiko Yamato; Michel Ephritikhine","Synthesis, structure and magnetic behaviour of dinuclear uranium(<small>IV</small>) complexes with a ‘calixsalophen’ type macrocycle","New Journal of Chemistry","2006","30","8","1220","","10.1039/b606035h","","","0.71073","MoKα","","0.0456","0.0309","","","0.0687","0.0739","","","","","","1.014","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052320","9.6797","0.0003","12.6462","0.0004","17.6494","0.0006","87.281","0.002","75.648","0.002","87.824","0.002","2089.94","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C86 H62 I4 N12 O3 Zn4 -","- C86 H52 I4 N12 O3 Zn4 -","- C86 H52 I4 N12 O3 Zn4 -","1","0.5","","Emmanuel Deiters; Véronique Bulach; Mir Wais Hosseini","Porphyrin based metallamacrocycles","New Journal of Chemistry","2006","30","9","1289","","10.1039/b606041m","","","0.71073","MoKα","","0.0942","0.0566","","","0.1754","0.1961","","","","","","1.1","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052321","9.8032","0.0003","12.5002","0.0004","17.7426","0.0005","86.91","0.002","75.738","0.001","86.087","0.002","2100.74","0.11","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C86 H58 Cd2 Cl6 I4 N12 -","- C86 H58 Cd2 Cl6 I4 N12 -","- C86 H58 Cd2 Cl6 I4 N12 -","1","0.5","","Emmanuel Deiters; Véronique Bulach; Mir Wais Hosseini","Porphyrin based metallamacrocycles","New Journal of Chemistry","2006","30","9","1289","","10.1039/b606041m","","","0.71073","MoKα","","0.061","0.0452","","","0.1442","0.155","","","","","","1.045","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052322","9.8204","0.0003","12.4299","0.0003","17.7025","0.0005","86.592","0.001","75.992","0.001","85.872","0.001","2089.21","0.1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C86 H58 Cl6 Hg2 I4 N12 -","- C86 H58 Cl6 Hg2 I4 N12 -","- C86 H58 Cl6 Hg2 I4 N12 -","1","0.5","","Emmanuel Deiters; Véronique Bulach; Mir Wais Hosseini","Porphyrin based metallamacrocycles","New Journal of Chemistry","2006","30","9","1289","","10.1039/b606041m","","","0.71073","MoKα","","0.0685","0.0461","","","0.114","0.1209","","","","","","1.08","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052323","9.7586","0.0005","12.4722","0.0005","17.6672","0.0007","87.06","0.002","75.477","0.002","85.986","0.002","2075.21","0.16","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C86 H54 Cd2 Cl6 Cu2 I4 N12 -","- C86 H54 Cd2 Cl6 Cu2 I4 N12 -","- C86 H54 Cd2 Cl6 Cu2 I4 N12 -","1","0.5","","Emmanuel Deiters; Véronique Bulach; Mir Wais Hosseini","Porphyrin based metallamacrocycles","New Journal of Chemistry","2006","30","9","1289","","10.1039/b606041m","","","0.71073","MoKα","","0.1048","0.0508","","","0.1026","0.1253","","","","","","1.011","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052324","9.5541","0.0004","12.5202","0.0005","17.6342","0.0006","86.332","0.002","76.009","0.002","87.361","0.002","2041.6","0.14","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C86 H54 Br4 Cl6 Cu2 Hg2 N12 -","- C86 H54 Br4 Cl6 Cu2 Hg2 N12 -","- C86 H54 Br4 Cl6 Cu2 Hg2 N12 -","1","0.5","","Emmanuel Deiters; Véronique Bulach; Mir Wais Hosseini","Porphyrin based metallamacrocycles","New Journal of Chemistry","2006","30","9","1289","","10.1039/b606041m","","","0.71073","MoKα","","0.0801","0.0509","","","0.1125","0.1234","","","","","","1.058","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052325","8.7969","0.0006","17.9832","0.0013","17.5198","0.0012","90","","90.364","0.001","90","","2771.5","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Cl2 Cu N8 O12 -","- C22 H24 Cl2 Cu N8 O12 -","- C88 H96 Cl8 Cu4 N32 O48 -","4","1","","Krishna Kumar, D.; Das, Amitava; Dastidar, Parthasarathi","Exploring conformationally flexible hydrogen-bond-functionalized ligand and counter anions in metal?organic frameworks of Cu(ii)","New Journal of Chemistry","2006","30","9","1267","","10.1039/b606150h","","","0.71073","MoKα","","0.0575","0.0406","","","0.097","0.1042","","","","","","1.026","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052326","9.0522","0.0006","18.0988","0.0012","19.5538","0.0013","90","","95.286","0.001","90","","3190","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 Cu F6 N8 O10 S2 -","- C24 H24 Cu F6 N8 O10 S2 -","- C96 H96 Cu4 F24 N32 O40 S8 -","4","1","","Krishna Kumar, D.; Das, Amitava; Dastidar, Parthasarathi","Exploring conformationally flexible hydrogen-bond-functionalized ligand and counter anions in metal?organic frameworks of Cu(ii)","New Journal of Chemistry","2006","30","9","1267","","10.1039/b606150h","","","0.71073","MoKα","","0.0632","0.0427","","","0.097","0.1053","","","","","","1.021","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052327","21.398","0.002","17.9035","0.0017","17.4386","0.0017","90","","105.302","0.002","90","","6443.9","1.1","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C23 H24 Cu F6 N8 O5 Si -","- C23 H24 Cu F6 N8 O5 Si -","- C184 H192 Cu8 F48 N64 O40 Si8 -","8","1","","Krishna Kumar, D.; Das, Amitava; Dastidar, Parthasarathi","Exploring conformationally flexible hydrogen-bond-functionalized ligand and counter anions in metal?organic frameworks of Cu(ii)","New Journal of Chemistry","2006","30","9","1267","","10.1039/b606150h","","","0.71073","MoKα","","0.1446","0.0726","","","0.1677","0.1931","","","","","","0.921","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052328","21.2107","0.0014","17.9344","0.0012","17.5455","0.0012","90","","104.877","0.001","90","","6450.6","0.8","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H24 Cu F6 N8 O4.5 Si -","- C22 H24 Cu F6 N8 O4.5 Si -","- C176 H192 Cu8 F48 N64 O36 Si8 -","8","1","","Krishna Kumar, D.; Das, Amitava; Dastidar, Parthasarathi","Exploring conformationally flexible hydrogen-bond-functionalized ligand and counter anions in metal?organic frameworks of Cu(ii)","New Journal of Chemistry","2006","30","9","1267","","10.1039/b606150h","","","0.71073","MoKα","","0.0442","0.0403","","","0.1124","0.1162","","","","","","1.064","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052329","7.704","0.004","21.708","0.011","12.165","0.005","90","","122.77","0.02","90","","1710.7","1.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 Cu N4 O8 S -","- C12 H18 Cu N4 O8 S -","- C48 H72 Cu4 N16 O32 S4 -","4","1","","Krishna Kumar, D.; Das, Amitava; Dastidar, Parthasarathi","Exploring conformationally flexible hydrogen-bond-functionalized ligand and counter anions in metal?organic frameworks of Cu(ii)","New Journal of Chemistry","2006","30","9","1267","","10.1039/b606150h","","","0.71073","MoKα","","0.0942","0.0472","","","0.106","0.123","","","","","","0.902","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052330","8.3292","0.0007","9.7989","0.0008","13.155","0.001","80.124","0.001","74.892","0.001","88.202","0.001","1021.1","0.14","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H16 Cu N6 O10 -","- C11 H16 Cu N6 O10 -","- C22 H32 Cu2 N12 O20 -","2","1","","Krishna Kumar, D.; Das, Amitava; Dastidar, Parthasarathi","Exploring conformationally flexible hydrogen-bond-functionalized ligand and counter anions in metal?organic frameworks of Cu(ii)","New Journal of Chemistry","2006","30","9","1267","","10.1039/b606150h","","","0.71073","MoKα","","0.0495","0.0428","","","0.1307","0.1394","","","","","","1.108","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052331","17.8434","0.0006","17.8434","0.0006","8.654","0.0006","90","","90","","120","","2386.2","0.2","173","2","173","2","","","","","","","","4","P -3","-P 3","147","","","","- C90 H132 Co2 N24 -","- C90 H132 Co2 N24 -","- C90 H132 Co2 N24 -","1","0.166667","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.105","0.0566","","","0.1313","0.1479","","","","","","1.019","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052332","18.1638","0.0014","18.1638","0.0014","8.5506","0.0012","90","","90","","120","","2443.1","0.4","173","2","173","2","","","","","","","","4","P -3","-P 3","147","","","","- C90 H132 Cr2 N24 -","- C90 H132 Cr2 N24 -","- C90 H132 Cr2 N24 -","1","0.166667","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.1019","0.0512","","","0.1299","0.1619","","","","","","1.072","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052333","17.9242","0.0004","17.9242","0.0004","8.614","0.0004","90","","90","","120","","2396.71","0.13","173","2","173","2","","","","","","","","4","P -3","-P 3","147","","","","- C90 H132 Fe2 N24 -","- C90 H132 Fe2 N24 -","- C90 H132 Fe2 N24 -","1","0.166667","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.0747","0.0435","","","0.1083","0.1304","","","","","","1.056","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052334","17.9242","0.0004","17.9242","0.0004","8.614","0.0004","90","","90","","120","","2396.71","0.13","173","2","173","2","","","","","","","","4","P -3","-P 3","147","","","","- C90 H132 Fe2 N24 -","- C90 H132 Fe2 N24 -","- C90 H132 Fe2 N24 -","1","0.166667","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.0747","0.0435","","","0.1083","0.1304","","","","","","1.056","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052335","9.1738","0.0006","9.4718","0.0006","17.6898","0.0013","100.914","0.003","92.932","0.004","103.963","0.004","1457.13","0.17","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H48 Cl2 N4 O2 -","- C26 H48 Cl2 N4 O2 -","- C52 H96 Cl4 N8 O4 -","2","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.1199","0.0545","","","0.1036","0.1238","","","","","","1.017","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052336","8.202","0.0002","9.5615","0.0002","10.9335","0.0003","68.098","0.002","84.437","0.001","84.412","0.001","790.07","0.04","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H44 N8 Ni -","- C30 H44 N8 Ni -","- C30 H44 N8 Ni -","1","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.0432","0.0346","","","0.0868","0.0901","","","","","","1.048","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052337","8.27","0.0017","9.5086","0.0019","10.937","0.002","70.1","0.03","85.07","0.03","85.64","0.03","804.7","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H44 N8 Pd -","- C30 H44 N8 Pd -","- C30 H44 N8 Pd -","1","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.0323","0.0299","","","0.0768","0.0848","","","","","","1.086","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052338","8.2909","0.0002","9.4857","0.0002","10.9177","0.0002","70.191","0.001","84.936","0.001","85.713","0.001","803.74","0.03","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H44 N8 Pt -","- C30 H44 N8 Pt -","- C30 H44 N8 Pt -","1","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: control of packing of hybrid 1-D and 2-D H-bonded molecular networks formed between bisamidinium dication and cyanometallate anions","New Journal of Chemistry","2006","30","10","1403","","10.1039/b606265m","","","0.71073","MoKα","","0.0175","0.0175","","","0.0427","0.0427","","","","","","1.088","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052339","10.9846","0.0003","11.4743","0.0004","17.4918","0.0008","81.101","0.001","89.017","0.001","65.707","0.002","1982.62","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H48 N4 O2 Si -","- C44 H48 N4 O2 Si -","- C88 H96 N8 O4 Si2 -","2","1","","Nans Roques; Philippe Gerbier; Yoshio Teki; Sylvie Choua; Petra Lesniakovà; Jean-Pascal Sutter; Philippe Guionneau; Christian Guérin","Towards a better understanding of photo-excited spin alignment processes using silole diradicals","New Journal of Chemistry","2006","30","9","1319","","10.1039/b606593g","","","0.71073","MoKα","","0.149","0.0691","","","0.1477","0.1823","","","","","","0.986","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052340","22.247","0.004","10.04","0.002","20.632","0.004","90","","95.89","0.03","90","","4584","1.5","180","","180","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C45 H47 Cl5 N O3 P3 Ru -","- C45 H47 Cl5 N O3 P3 Ru -","- C180 H188 Cl20 N4 O12 P12 Ru4 -","4","1","","Alba E. Díaz-Álvarez; Pascale Crochet; Maria Zablocka; Victorio Cadierno; Carine Duhayon; José Gimeno; Jean-Pierre Majoral","Imination reactions of free and coordinated 2-diphenylphosphino-1-phenyl-phospholane: Access to regioisomeric ruthenium(<small>II</small>) complexes containing novel iminophosphorane‒phosphine ligands","New Journal of Chemistry","2006","30","9","1295","","10.1039/b606781f","","","0.71073","MoKα","","0.0884","0.0417","","0.0519","0.0493","0.0493","","","","","","1.1191","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052341","9.2949","0.0018","12.576","0.003","18.412","0.003","101.298","0.017","90.983","0.015","95.652","0.017","2098.8","0.7","180","","180","","","","","","","","","8","P -1","-P 1","2","","","","- C78 H72 Cl2 F20 N4 P4 Ru2 Sb2 -","- C78 H72 Cl2 F20 N4 P4 Ru2 Sb2 -","- C78 H72 Cl2 F20 N4 P4 Ru2 Sb2 -","1","0.5","","Alba E. Díaz-Álvarez; Pascale Crochet; Maria Zablocka; Victorio Cadierno; Carine Duhayon; José Gimeno; Jean-Pierre Majoral","Imination reactions of free and coordinated 2-diphenylphosphino-1-phenyl-phospholane: Access to regioisomeric ruthenium(<small>II</small>) complexes containing novel iminophosphorane‒phosphine ligands","New Journal of Chemistry","2006","30","9","1295","","10.1039/b606781f","","","0.71073","MoKα","","0.3028","0.0831","","0.1228","0.0848","0.0848","","","","","","1.121","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052342","15.457","0.001","14.693","0.0008","20.184","0.0011","90","","99.75","0.005","90","","4517.8","0.5","180","","180","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C86 H92 Cl2 F20 N4 O2 P4 Ru2 Sb2 -","- C86 H92 Cl2 F20 N4 O2 P4 Ru2 Sb2 -","- C172 H184 Cl4 F40 N8 O4 P8 Ru4 Sb4 -","2","0.5","","Alba E. Díaz-Álvarez; Pascale Crochet; Maria Zablocka; Victorio Cadierno; Carine Duhayon; José Gimeno; Jean-Pierre Majoral","Imination reactions of free and coordinated 2-diphenylphosphino-1-phenyl-phospholane: Access to regioisomeric ruthenium(<small>II</small>) complexes containing novel iminophosphorane‒phosphine ligands","New Journal of Chemistry","2006","30","9","1295","","10.1039/b606781f","","","0.71073","MoKα","","0.1657","0.0637","","0.0828","0.0675","0.0675","","","","","","1.1485","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052343","13.8941","0.0017","19.078","0.004","10.2235","0.0014","90","","128.293","0.005","90","","2126.9","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H36 I N4 O4 Re -","- C12 H32 I N4 O4 Re -","- C48 H128 I4 N16 O16 Re4 -","4","0.5","","Jorge S. Gancheff; Carlos Kremer; Oscar N. Ventura; Sixto Domínguez; Carla Bazzicalupi; Antonio Bianchi; Leopoldo Suescun; Alvaro W. Mombrú","ReO<small><sub>2</sub></small><small><sup>+</sup></small> chelates with aliphatic diamines. Structural and proton transfer properties","New Journal of Chemistry","2006","30","11","1650","","10.1039/b606797b","","","0.71069","MoKα","","0.0554","0.043","","","0.126","0.1335","","","","","","1.102","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052344","8.513","0.005","15.322","0.005","16.926","0.005","90","","90","","90","","2207.8","1.6","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H33 Cl2 N4 O10 Re -","- C12 H32 Cl2 N4 O10 Re -","- C48 H128 Cl8 N16 O40 Re4 -","4","0.5","","Jorge S. Gancheff; Carlos Kremer; Oscar N. Ventura; Sixto Domínguez; Carla Bazzicalupi; Antonio Bianchi; Leopoldo Suescun; Alvaro W. Mombrú","ReO<small><sub>2</sub></small><small><sup>+</sup></small> chelates with aliphatic diamines. Structural and proton transfer properties","New Journal of Chemistry","2006","30","11","1650","","10.1039/b606797b","","","0.71069","MoKα","","0.0782","0.0422","","","0.0834","0.0965","","","","","","1.044","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052345","8.9398","0.0003","9.4924","0.0003","10.0886","0.0003","90","","90","","90","","856.12","0.05","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","p-bromophenyl methyl sulfoxide","p-bromophenyl methyl sulfoxide","","- C7 H7 Br O S -","- C7 H7 Br O S -","- C28 H28 Br4 O4 S4 -","4","1","","Naso, Francesco; Cardellicchio, Cosimo; Capozzi, Maria Annunziata M.; Capitelli, Francesco; Bertolasi, Valerio","Self-assemblies of chiral p-haloaryl sulfoxides through C?H?O short contacts and halogen involving interactions","New Journal of Chemistry","2006","30","12","1782","","10.1039/b607545b","","","0.71073","MoKα","","0.04","0.0319","","","0.0777","0.081","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052346","9.4483","0.0004","10.3257","0.0005","10.9739","0.0006","90","","90","","90","","1070.62","0.09","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","p-bromophenyl i-propyl sulfoxide","p-bromophenyl i-propyl sulfoxide","","- C9 H11 Br O S -","- C9 H11 Br O S -","- C36 H44 Br4 O4 S4 -","4","1","","Naso, Francesco; Cardellicchio, Cosimo; Capozzi, Maria Annunziata M.; Capitelli, Francesco; Bertolasi, Valerio","Self-assemblies of chiral p-haloaryl sulfoxides through C?H?O short contacts and halogen involving interactions","New Journal of Chemistry","2006","30","12","1782","","10.1039/b607545b","","","0.71073","MoKα","","0.0866","0.0561","","","0.1546","0.172","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052347","6.1391","0.0002","7.7239","0.0002","24.0213","0.0008","90","","90","","90","","1139.04","0.06","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","p-bromophenyl phenyl sulfoxide","p-bromophenyl phenyl sulfoxide","","- C12 H9 Br O S -","- C12 H9 Br O S -","- C48 H36 Br4 O4 S4 -","4","1","","Naso, Francesco; Cardellicchio, Cosimo; Capozzi, Maria Annunziata M.; Capitelli, Francesco; Bertolasi, Valerio","Self-assemblies of chiral p-haloaryl sulfoxides through C?H?O short contacts and halogen involving interactions","New Journal of Chemistry","2006","30","12","1782","","10.1039/b607545b","","","0.71073","MoKα","","0.0562","0.0411","","","0.0964","0.1025","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052348","4.6262","0.0001","9.2833","0.0003","20.717","0.0008","90","","90","","90","","889.72","0.05","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","chloromethyl p-chlorophenyl sulfoxide","chloromethyl p-chlorophenyl sulfoxide","","- C7 H6 Cl2 O S -","- C7 H6 Cl2 O S -","- C28 H24 Cl8 O4 S4 -","4","1","","Naso, Francesco; Cardellicchio, Cosimo; Capozzi, Maria Annunziata M.; Capitelli, Francesco; Bertolasi, Valerio","Self-assemblies of chiral p-haloaryl sulfoxides through C?H?O short contacts and halogen involving interactions","New Journal of Chemistry","2006","30","12","1782","","10.1039/b607545b","","","0.71073","MoKα","","0.051","0.0343","","","0.0761","0.0836","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052349","13.56","0.011","7.385","0.006","26.06","0.02","90","","90","","90","","2610","4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H11 N5 O3 -","- C13 H11 N5 O3 -","- C104 H88 N40 O24 -","8","1","","Moloy Sarkar; Sandip Banthia; Aditi Patil; Mohd. Bismillah Ansari; Anunay Samanta","pH-Regulated “Off‒On” fluorescence signalling of d-block metal ions in aqueous media and realization of molecular IMP logic function","New Journal of Chemistry","2006","30","11","1557","","10.1039/b607642d","","","0.71073","MoKα","","0.1312","0.0567","","","0.1164","0.1495","","","","","","0.95","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052350","11.609","0.002","23.52","0.005","35.59","0.007","90","","95.59","0.03","90","","9671","3","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C85 H80 Ag2 Cl18 N4 O15 S2 -","- C85 H80 Ag2 Cl18 N4 O15 S2 -","- C340 H320 Ag8 Cl72 N16 O60 S8 -","4","0.5","","Laugel, Guillaume; Graf, Ernest; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: on the formation of tubular coordination networks","New Journal of Chemistry","2006","30","9","1340","","10.1039/b607982m","","","0.71073","MoKα","","0.112","0.0759","","","0.223","0.2545","","","","","","1.04","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052351","17.0505","0.0006","17.6067","0.0006","12.0448","0.0005","90","","90","","90","","3615.9","0.2","273","2","273","2","","","","","","","","4","P b a n :2","-P 2ab 2b","50","","","","- C70 H60 N4 O9.5 -","- C70 H60 N4 O9.5 -","- C140 H120 N8 O19 -","2","0.25","","Laugel, Guillaume; Graf, Ernest; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: on the formation of tubular coordination networks","New Journal of Chemistry","2006","30","9","1340","","10.1039/b607982m","","","0.71073","MoKα","","0.1995","0.1117","","","0.2533","0.2845","","","","","","1.164","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052352","22.5845","0.001","12.3139","0.0005","17.2598","0.0006","90","","90","","90","","4800","0.3","173","2","173","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C71 H60 Cl4.5 Hg2 N4 O11 -","- C71 H60 Cl4.5 Hg2 N4 O11 -","- C142 H120 Cl9 Hg4 N8 O22 -","2","0.5","","Laugel, Guillaume; Graf, Ernest; Hosseini, Mir Wais; Planeix, Jean-Marc; Kyritsakas, Nathalie","Molecular tectonics: on the formation of tubular coordination networks","New Journal of Chemistry","2006","30","9","1340","","10.1039/b607982m","","","0.71073","MoKα","","0.1209","0.0938","","","0.2468","0.2744","","","","","","1.111","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052353","6.4541","0.0001","10.0694","0.0002","26.7131","0.0006","98.7916","0.0011","93.26","0.0014","107.242","0.0013","1628.93","0.06","123","","123","","","","","","","","?","4","P -1","-P 1","2","","","","- C39 H51 N3 O -","- C39 H51 N3 O -","- C78 H102 N6 O2 -","2","1","","Edwin C. Constable; H.-J. Güntherodt; Catherine E. Housecroft; Leo Merz; Markus Neuburger; Silvia Schaffner; Yaqiu Tao","An evaluation of the relationship between two- and three-dimensional packing in self-organised monolayers and bulk crystals of amphiphilic 2,2′:6′,2″-terpyridines","New Journal of Chemistry","2006","30","10","1470","","10.1039/b608136c","","","0.71073","MoKα","","0.0489","0.0399","","0.0369","0.036","0.036","","","","","","1.1594","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052354","6.4461","0.0003","10.3457","0.0005","18.8455","0.0008","83.808","0.003","86.289","0.003","72.097","0.002","1188.3","0.1","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C29 H31 N3 O -","- C29 H31 N3 O -","- C58 H62 N6 O2 -","2","1","","Edwin C. Constable; H.-J. Güntherodt; Catherine E. Housecroft; Leo Merz; Markus Neuburger; Silvia Schaffner; Yaqiu Tao","An evaluation of the relationship between two- and three-dimensional packing in self-organised monolayers and bulk crystals of amphiphilic 2,2′:6′,2″-terpyridines","New Journal of Chemistry","2006","30","10","1470","","10.1039/b608136c","","","0.71073","MoKα","","0.0725","0.0438","","0.0965","0.0529","0.0529","","","","","","1.128","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052355","51.0346","0.0008","5.4728","0.0001","20.8564","0.0003","90","","95.9507","0.0007","90","","5793.85","0.16","173","","173","","","","","","","","?","4","C 1 2/c 1","-C 2yc","15","","","","- C33 H47 N3 O -","- C33 H47 N3 O -","- C264 H376 N24 O8 -","8","1","","Edwin C. Constable; H.-J. Güntherodt; Catherine E. Housecroft; Leo Merz; Markus Neuburger; Silvia Schaffner; Yaqiu Tao","An evaluation of the relationship between two- and three-dimensional packing in self-organised monolayers and bulk crystals of amphiphilic 2,2′:6′,2″-terpyridines","New Journal of Chemistry","2006","30","10","1470","","10.1039/b608136c","","","0.71073","MoKα","","0.041","0.0365","","0.0473","0.0459","0.0459","","","","","","0.988","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052356","13.17","0.002","14.881","0.003","16.134","0.003","88.648","0.003","76.965","0.003","69.77","0.003","2885.4","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C98 H102 Cu4 N48 O36 -","- C98 H78 Cu4 N48 O36 -","- C98 H78 Cu4 N48 O36 -","1","0.5","","Hélène Casellas; Chiara Massera; Francesco Buda; Patrick Gamez; Jan Reedijk","Crystallographic evidence of theoretically novel anion‒π interactions","New Journal of Chemistry","2006","30","11","1561","","10.1039/b608172j","","","0.71069","MoKα","","0.1216","0.0598","","","0.1435","0.1677","","","","","","1.009","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052357","6.8245","0.0005","9.5538","0.0007","12.6278","0.0009","77.174","0.004","84.4","0.004","82.637","0.004","794.13","0.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4-methyl-6-(3-pyridyl)pyrimidine,4-nitrobenzoic acid","","- C17 H15 N5 O4 -","- C17 H15 N5 O4 -","- C34 H30 N10 O8 -","2","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.0835","0.0506","","","0.1267","0.1485","","","","","","0.96","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052358","8.2088","0.0007","8.7891","0.0006","15.3371","0.0012","92.767","0.005","105.536","0.004","115.332","0.004","946.59","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4-(3-pyridyl)-6-methylpyrimidine, Me5-PhCOOH","","- C22 H26 N4 O2 -","- C22 H26 N4 O2 -","- C44 H52 N8 O4 -","2","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.0915","0.0738","","","0.1959","0.21","","","","","","1.325","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052359","8.3089","0.0006","8.9991","0.0007","11.1671","0.0007","85.733","0.004","69.174","0.004","77.699","0.005","762.52","0.1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4-(3-pyridyl)-6-methylpyrimidine, 4-hydroxybenzoic acid","","- C17 H16 N4 O3 -","- C17 H16 N4 O3 -","- C34 H32 N8 O6 -","2","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.1129","0.0863","","","0.2031","0.2161","","","","","","1.161","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052360","7.8442","0.0012","8.8879","0.0014","14.216","0.002","101.607","0.002","90.83","0.002","106.753","0.002","926.9","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2-amino-4-(6-methoxy-3-pyridyl)-6-methylpyrimidine, 4-(Me2N)-PhCOOH","","- C20 H23 N5 O3 -","- C20 H23 N5 O3 -","- C40 H46 N10 O6 -","2","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.0563","0.0458","","","0.1234","0.1318","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052361","33.158","0.004","7.3848","0.0007","14.1634","0.0016","90","","106.439","0.006","90","","3326.4","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(2-amino-4-(6-methoxy-3-pyridyl)-6-methylpyrimidine), (2,4-difluorobenzoic acid)","","- C18 H16 F2 N4 O3 -","- C18 H16 F2 N4 O3 -","- C144 H128 F16 N32 O24 -","8","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.1522","0.0558","","","0.1233","0.1514","","","","","","0.876","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052362","5.3534","0.0005","12.6941","0.0012","15.188","0.0014","87.755","0.001","82.921","0.001","87.542","0.002","1022.72","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","(2-amino-4-(6-methoxy-3-pyridyl)-6-methylpyrimidine), Me5-PhCOOH","","- C23 H28 N4 O3 -","- C23 H28 N4 O3 -","- C46 H56 N8 O6 -","2","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.0711","0.0519","","","0.1352","0.1483","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052363","7.374","0.011","8.385","0.013","17.56","0.03","93.51","0.1","96.29","0.07","104.5","0.11","1040","3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","1-(3-methoxy-5-pyridyl)-2-(2-amino-6-methyl-4-pyrimidyl)ethyne, (NO2)2PhCOOH","","- C20 H16 N6 O7 -","- C20 H16 N6 O7 -","- C40 H32 N12 O14 -","2","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.2841","0.1139","","","0.2495","0.3299","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052364","6.9157","0.0012","6.9405","0.0012","19.854","0.004","87.646","0.003","80.636","0.003","81.138","0.003","928.9","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","[1-(3-OMe-5-pyridyl)-2-(2-amino-4-methyl-6-pyrimidyl)-ethyne], NO2PhCOOH","","- C20 H17 N5 O5 -","- C20 H17 N5 O5 -","- C40 H34 N10 O10 -","2","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.1084","0.0532","","","0.1136","0.1382","","","","","","1.001","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052365","10.5742","0.0019","14.599","0.003","13.519","0.003","90","","102.453","0.011","90","","2037.9","0.7","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[1-(3-OMe-5-pyridyl)-2-(2-amino-4-methyl-6-pyrimidyl)-ethyne], 3-Me2N-PhCOOH","","- C22 H23 N5 O3 -","- C22 H23 N5 O3 -","- C88 H92 N20 O12 -","4","1","","Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore","Balancing intermolecular hydrogen-bond interactions for the directed assembly of binary 1 : 1 co-crystals","New Journal of Chemistry","2006","30","10","1452","","10.1039/b608267j","","","0.71073","MoKα","","0.1809","0.0773","","","0.1753","0.2304","","","","","","1.019","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052366","11.503","0.0012","12.2691","0.0014","12.5077","0.0014","104.268","0.013","113.245","0.012","92.87","0.012","1550.2","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Bu4N, cis-Au(tfadt)","","","- C24 H36 Au F6 N3 S4 -","- C24 H36 Au F6 N3 S4 -","- C48 H72 Au2 F12 N6 S8 -","2","1","","Olivier Jeannin; Marc Fourmigué","Perylene salts of unsymmetrical nickel and gold dithiolene complexes with 3 ∶ 2 stoichiometry: conformational polymorphism and strong antiferromagnetic interactions","New Journal of Chemistry","2006","30","12","1774","","10.1039/b608420f","","","0.71073","MoKα","","0.0434","0.0334","","","0.0825","0.0879","","","","","","1.042","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052367","10.867","0.0013","12.7568","0.0016","13.221","0.0015","111.176","0.013","103.135","0.014","96.571","0.015","1624.9","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(Perylene)3, [Au(tfadt)2]2","","","- C76 H36 Au2 F12 N4 S8 -","- C76 H36 Au2 F12 N4 S8 -","- C76 H36 Au2 F12 N4 S8 -","1","0.5","","Olivier Jeannin; Marc Fourmigué","Perylene salts of unsymmetrical nickel and gold dithiolene complexes with 3 ∶ 2 stoichiometry: conformational polymorphism and strong antiferromagnetic interactions","New Journal of Chemistry","2006","30","12","1774","","10.1039/b608420f","","","0.71073","MoKα","","0.0399","0.0258","","","0.0473","0.0499","","","","","","0.938","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052368","10.8853","0.0014","12.6566","0.0014","13.1882","0.0016","113.253","0.013","103.614","0.014","94.149","0.014","1594.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(perylene)1.5,[Ni(tfadt)2]","","","- C38 H18 F6 N2 Ni S4 -","- C38 H18 F6 N2 Ni S4 -","- C76 H36 F12 N4 Ni2 S8 -","2","1","","Olivier Jeannin; Marc Fourmigué","Perylene salts of unsymmetrical nickel and gold dithiolene complexes with 3 ∶ 2 stoichiometry: conformational polymorphism and strong antiferromagnetic interactions","New Journal of Chemistry","2006","30","12","1774","","10.1039/b608420f","","","0.71073","MoKα","","0.1187","0.046","","","0.1111","0.1385","","","","","","0.823","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052369","25.7658","0.0012","8.0568","0.0005","17.6766","0.0009","90","","117.347","0.004","90","","3259.4","0.3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","PPh4+, Au(tfadt)2-","","","- C32 H20 Au F6 N2 P S4 -","- C32 H20 Au F6 N2 P S4 -","- C128 H80 Au4 F24 N8 P4 S16 -","4","0.5","","Olivier Jeannin; Marc Fourmigué","Perylene salts of unsymmetrical nickel and gold dithiolene complexes with 3 ∶ 2 stoichiometry: conformational polymorphism and strong antiferromagnetic interactions","New Journal of Chemistry","2006","30","12","1774","","10.1039/b608420f","","","0.71073","MoKα","","0.064","0.0397","","","0.1022","0.1187","","","","","","1.148","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052370","11.155","0.0013","11.7052","0.0013","13.5301","0.0015","73.117","0.013","78.734","0.014","67.536","0.013","1555.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","TBA, Au(tfadt)2","","","- C24 H36 Au F6 N3 S4 -","- C24 H36 Au F6 N3 S4 -","- C48 H72 Au2 F12 N6 S8 -","2","1","","Olivier Jeannin; Marc Fourmigué","Perylene salts of unsymmetrical nickel and gold dithiolene complexes with 3 ∶ 2 stoichiometry: conformational polymorphism and strong antiferromagnetic interactions","New Journal of Chemistry","2006","30","12","1774","","10.1039/b608420f","","","0.71073","MoKα","","0.0606","0.0385","","","0.0847","0.0946","","","","","","1.042","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052371","3.973","0.003","10.96","0.007","36.13","0.02","90","","91.289","0.01","90","","1572.8","1.8","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H12 O2 S2 -","- C22 H12 O2 S2 -","- C88 H48 O8 S8 -","4","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","Experimental evidence for carbonyl?? electron cloud interactions","New Journal of Chemistry","2006","30","12","1801","","10.1039/b608628d","","","0.71073","MoKα","","0.0605","0.0425","","","0.0983","0.1048","","","","","","1.036","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052372","5.876","0.0007","9.9959","0.0012","17.79","0.002","102.163","0.002","91.168","0.002","103.455","0.002","990.8","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H14 Br2 O2 -","- C26 H14 Br2 O2 -","- C52 H28 Br4 O4 -","2","1","","Gautrot, Julien E.; Hodge, Philip; Cupertino, Domenico; Helliwell, Madeleine","Experimental evidence for carbonyl?? electron cloud interactions","New Journal of Chemistry","2006","30","12","1801","","10.1039/b608628d","","","0.71073","MoKα","","0.0546","0.0382","","","0.0834","0.0906","","","","","","1.016","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052373","24.531","0.005","11.147","0.005","17.686","0.005","90","","133.306","0.005","90","","3519","2","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H24 Cl2 Fe N6 O8 -","- C28 H24 Cl2 Fe N6 O8 -","- C112 H96 Cl8 Fe4 N24 O32 -","4","0.5","","Genre, Caroline; Matouzenko, Galina S.; Jeanneau, Erwann; Luneau, Dominique","A spin-crossover iron(ii) coordination polymer with the 8-aminoquinoline ligand: synthesis, crystal structure and magnetic properties of [Fe(aqin)2(4,4?-bpy)](ClO4)2?2EtOH (aqin = 8-aminoquinoline, 4,4?-bpy = 4,4?-bipyridyl)","New Journal of Chemistry","2006","30","11","1669","","10.1039/b608679a","","","0.71069","MoKα","","0.1995","0.1275","","0.2011","0.1364","0.1364","","","","","","1.1034","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052374","25.192","0.005","11.485","0.005","18.005","0.005","90","","133.652","0.005","90","","3769","2","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H24 Cl2 Fe N6 O8 -","- C28 H24 Cl2 Fe N6 O8 -","- C112 H96 Cl8 Fe4 N24 O32 -","4","0.5","","Genre, Caroline; Matouzenko, Galina S.; Jeanneau, Erwann; Luneau, Dominique","A spin-crossover iron(ii) coordination polymer with the 8-aminoquinoline ligand: synthesis, crystal structure and magnetic properties of [Fe(aqin)2(4,4?-bpy)](ClO4)2?2EtOH (aqin = 8-aminoquinoline, 4,4?-bpy = 4,4?-bipyridyl)","New Journal of Chemistry","2006","30","11","1669","","10.1039/b608679a","","","0.71069","MoKα","","0.2454","0.1307","","0.3139","0.1438","0.1438","","","","","","1.1309","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052375","7.232","0.0014","9.89","0.002","24.259","0.005","90","","90","","90","","1735.1","0.6","253","2","253","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H20 Fe N2 -","- C21 H20 Fe N2 -","- C84 H80 Fe4 N8 -","4","1","","Lo, Kenneth Kam-Wing; Lau, Jason Shing-Yip; Zhu, Nianyong","Synthesis, crystal structures, electrochemical and protein-binding properties of ferrocene?indole conjugates","New Journal of Chemistry","2006","30","11","1567","","10.1039/b609052d","","","0.71069","MoKα","","0.0351","0.0261","","","0.0534","0.055","","","","","","0.875","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052376","6.907","0.0014","13.826","0.003","17.936","0.004","90","","91.36","0.03","90","","1712.3","0.6","253","2","253","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Fe N2 -","- C21 H22 Fe N2 -","- C84 H88 Fe4 N8 -","4","1","","Lo, Kenneth Kam-Wing; Lau, Jason Shing-Yip; Zhu, Nianyong","Synthesis, crystal structures, electrochemical and protein-binding properties of ferrocene?indole conjugates","New Journal of Chemistry","2006","30","11","1567","","10.1039/b609052d","","","0.71073","MoKα","","0.0393","0.0284","","","0.085","0.0874","","","","","","1.046","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052377","9.4753","0.001","12.7836","0.0013","15.653","0.002","73.346","0.002","81.158","0.002","86.034","0.002","1794.3","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H22 N2 O2 S3 -","- C16 H22 N2 O2 S3 -","- C64 H88 N8 O8 S12 -","4","2","","Mark W. Glenny; Marie Lacombe; Jason B. Love; Alexander J. Blake; Leonard F. Lindoy; Robert C. Luckay; Karsten Gloe; Bianca Antonioli; Claire Wilson; Martin Schröder","Design and synthesis of heteroditopic aza-thioether macrocycles for metal extraction","New Journal of Chemistry","2006","30","12","1755","","10.1039/b609180f","","","0.71073","MoKα","","0.131","0.0542","","","0.0878","0.105","","","","","","0.817","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052378","13.45","0.003","7.195","0.002","20.096","0.004","90","","106.53","0.03","90","","1864.4","0.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N2 O S4 -","- C16 H22 N2 O S4 -","- C64 H88 N8 O4 S16 -","4","1","","Mark W. Glenny; Marie Lacombe; Jason B. Love; Alexander J. Blake; Leonard F. Lindoy; Robert C. Luckay; Karsten Gloe; Bianca Antonioli; Claire Wilson; Martin Schröder","Design and synthesis of heteroditopic aza-thioether macrocycles for metal extraction","New Journal of Chemistry","2006","30","12","1755","","10.1039/b609180f","","","0.71073","MoKα","","0.0469","0.0364","","","0.0781","0.0878","","","","","","1.137","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052379","5.4621","0.0004","19.624","0.0014","16.0384","0.0012","90","","91.023","0.002","90","","1718.9","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N2 O3 S2 -","- C16 H22 N2 O3 S2 -","- C64 H88 N8 O12 S8 -","4","1","","Mark W. Glenny; Marie Lacombe; Jason B. Love; Alexander J. Blake; Leonard F. Lindoy; Robert C. Luckay; Karsten Gloe; Bianca Antonioli; Claire Wilson; Martin Schröder","Design and synthesis of heteroditopic aza-thioether macrocycles for metal extraction","New Journal of Chemistry","2006","30","12","1755","","10.1039/b609180f","","","0.71073","MoKα","","0.0553","0.0355","","","0.0794","0.0851","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052380","12.5943","0.0008","14.8366","0.001","10.1311","0.0007","90","","99.462","0.001","90","","1867.3","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H29 N3 O3 S2 -","- C15 H29 N3 O3 S2 -","- C60 H116 N12 O12 S8 -","4","1","","Mark W. Glenny; Marie Lacombe; Jason B. Love; Alexander J. Blake; Leonard F. Lindoy; Robert C. Luckay; Karsten Gloe; Bianca Antonioli; Claire Wilson; Martin Schröder","Design and synthesis of heteroditopic aza-thioether macrocycles for metal extraction","New Journal of Chemistry","2006","30","12","1755","","10.1039/b609180f","","","0.71073","MoKα","","0.0575","0.0371","","","0.0845","0.0906","","","","","","0.929","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052381","10.308","0.0007","10.3129","0.0007","16.9116","0.0011","88.351","0.001","84.537","0.001","72.061","0.001","1702.6","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H48 Cl2 N6 O5 S2 -","- C25 H46 Cl2 N6 O5 S2 -","- C50 H92 Cl4 N12 O10 S4 -","2","1","","Mark W. Glenny; Marie Lacombe; Jason B. Love; Alexander J. Blake; Leonard F. Lindoy; Robert C. Luckay; Karsten Gloe; Bianca Antonioli; Claire Wilson; Martin Schröder","Design and synthesis of heteroditopic aza-thioether macrocycles for metal extraction","New Journal of Chemistry","2006","30","12","1755","","10.1039/b609180f","","","0.71073","MoKα","","0.0678","0.0595","","","0.171","0.18","","","","","","1.052","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052382","17.049","0.003","10.189","0.002","17.316","0.003","90","","115.526","0.003","90","","2714.4","0.9","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H36 N4 O2 S3 -","- C26 H36 N4 O2 S3 -","- C104 H144 N16 O8 S12 -","4","1","","Mark W. Glenny; Marie Lacombe; Jason B. Love; Alexander J. Blake; Leonard F. Lindoy; Robert C. Luckay; Karsten Gloe; Bianca Antonioli; Claire Wilson; Martin Schröder","Design and synthesis of heteroditopic aza-thioether macrocycles for metal extraction","New Journal of Chemistry","2006","30","12","1755","","10.1039/b609180f","","","0.71073","MoKα","","0.0502","0.0366","","","0.0956","0.101","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052383","11.967","0.002","20.985","0.004","7.75","0.002","90","","93.036","0.003","90","","1943.5","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H28 Ag N3 O4 S3 -","- C14 H28 Ag N3 O4 S3 -","- C56 H112 Ag4 N12 O16 S12 -","4","1","","Mark W. Glenny; Marie Lacombe; Jason B. Love; Alexander J. Blake; Leonard F. Lindoy; Robert C. Luckay; Karsten Gloe; Bianca Antonioli; Claire Wilson; Martin Schröder","Design and synthesis of heteroditopic aza-thioether macrocycles for metal extraction","New Journal of Chemistry","2006","30","12","1755","","10.1039/b609180f","","","0.71073","MoKα","","0.0563","0.0271","","","0.0404","0.0442","","","","","","0.833","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052384","9.151","0.0002","14.8907","0.0003","17.1566","0.0004","90","","104.576","0.0008","90","","2262.6","0.09","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","tetraethyleneammonium 1-phenyl-1-monocarba-6-iodo-undecaborane","","- C15 H33 B9 I N -","- C15 H33 B9 I N -","- C60 H132 B36 I4 N4 -","4","1","","Sumby, Christopher J.; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Kilner, Colin A.; Hardie, Michaele J.","Crystal-packing motifs of [Ag4L4]4+ star-burst tetrahedra","New Journal of Chemistry","2006","30","10","1390","","10.1039/b609356f","","","0.71069","MoKα","","0.0356","0.0313","","","0.0809","0.0839","","","","","","1.058","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052385","19.5276","0.0012","19.5276","0.0012","93.94","0.002","90","","90","","120","","31023","3","150","2","150","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","tetrakis[2,7,12-trimethoxy-3,8,13-tris(4-pyridylmethylamino)-10,15- dihydro-5H-tribenzo[a,d,g]cyclononene]-tris(acetonitrile)tetrasilver(I) hexafluorophosphate acetonitrile clathrate hydrate","","- C184 H194 Ag4 F24 N32 O13 P4 -","- C192 H191.94 Ag4 F24.05 N34 O12.99 P4.01 -","- C1152 H1151.64 Ag24 F144.3 N204 O77.94 P24.06 -","6","0.333333","","Sumby, Christopher J.; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Kilner, Colin A.; Hardie, Michaele J.","Crystal-packing motifs of [Ag4L4]4+ star-burst tetrahedra","New Journal of Chemistry","2006","30","10","1390","","10.1039/b609356f","","","0.71073","MoKα","","0.1293","0.1116","","","0.2859","0.3006","","","","","","1.099","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052386","20.1481","0.0019","23.478","0.003","30.814","0.003","68.529","0.005","73.259","0.004","65.528","0.004","12185","2","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","tetrakis[2,7,12-trimethoxy-3,8,13-tris(4-pyridylmethylamino)- 10,15-dihydro-5H-tribenzo[a,d,g]cyclononene]-di(acetonitrile) bis(1-phenyl-1-monocarba-6-iodo-undecaborane)tetrasilver(I) 1-phenyl-1-monocarba-6-iodo-undecaborane acetonitrile clathrate","","- C222 H259 Ag4 B36 I4 N37 O12 -","- C222 H259 Ag4 B36 I4 N37 O12 -","- C444 H518 Ag8 B72 I8 N74 O24 -","2","1","","Sumby, Christopher J.; Carr, Michael J.; Franken, Andreas; Kennedy, John D.; Kilner, Colin A.; Hardie, Michaele J.","Crystal-packing motifs of [Ag4L4]4+ star-burst tetrahedra","New Journal of Chemistry","2006","30","10","1390","","10.1039/b609356f","","","0.71073","MoKα","","0.1664","0.0944","","","0.2468","0.304","","","","","","1.088","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052387","11.117","0.001","18.714","0.001","18.941","0.001","90","","90","","90","","3940.6","0.5","150","0.1","150","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C39 H54 Br2 N2 O P2 -","- C39 H54 Br2 N2 O P2 -","- C156 H216 Br8 N8 O4 P8 -","4","1","","Matthieu Demange; Leila Boubekeur; Audrey Auffrant; Nicolas Mézailles; Louis Ricard; Xavier Le Goff; Pascal Le Floch","A new and convenient approach towards bis(iminophosphoranyl)methane ligands and their dicationic, cationic, anionic and dianionic derivatives","New Journal of Chemistry","2006","30","12","1745","","10.1039/b610049j","","","0.71069","MoKα","","0.0492","0.0342","","","0.0712","0.0758","","","","","","1.038","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052388","11.05","0.001","17.697","0.001","17.839","0.001","90","","97.322","0.001","90","","3460","0.4","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H45 Br N2 O P2 -","- C35 H45 Br N2 O P2 -","- C140 H180 Br4 N8 O4 P8 -","4","1","","Matthieu Demange; Leila Boubekeur; Audrey Auffrant; Nicolas Mézailles; Louis Ricard; Xavier Le Goff; Pascal Le Floch","A new and convenient approach towards bis(iminophosphoranyl)methane ligands and their dicationic, cationic, anionic and dianionic derivatives","New Journal of Chemistry","2006","30","12","1745","","10.1039/b610049j","","","0.71069","MoKα","","0.0705","0.0364","","","0.0722","0.0809","","","","","","0.955","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052389","14.22","0.001","10.278","0.001","20.462","0.001","90","","93.927","0.001","90","","2983.6","0.4","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H32 N2 P2 -","- C37 H32 N2 P2 -","- C148 H128 N8 P8 -","4","1","","Matthieu Demange; Leila Boubekeur; Audrey Auffrant; Nicolas Mézailles; Louis Ricard; Xavier Le Goff; Pascal Le Floch","A new and convenient approach towards bis(iminophosphoranyl)methane ligands and their dicationic, cationic, anionic and dianionic derivatives","New Journal of Chemistry","2006","30","12","1745","","10.1039/b610049j","","","0.71069","MoKα","","0.0492","0.0379","","","0.1033","0.1102","","","","","","1.055","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052390","15.799","0.001","10.945","0.001","20.552","0.001","90","","98.349","0.001","90","","3516.2","0.4","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H41 Li N2 O P2 -","- C41 H41 Li N2 O P2 -","- C164 H164 Li4 N8 O4 P8 -","4","1","","Matthieu Demange; Leila Boubekeur; Audrey Auffrant; Nicolas Mézailles; Louis Ricard; Xavier Le Goff; Pascal Le Floch","A new and convenient approach towards bis(iminophosphoranyl)methane ligands and their dicationic, cationic, anionic and dianionic derivatives","New Journal of Chemistry","2006","30","12","1745","","10.1039/b610049j","","","0.71069","MoKα","","0.0796","0.0463","","","0.1207","0.1341","","","","","","1.057","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052391","18.344","0.001","16.708","0.001","25.57","0.001","90","","106.406","0.001","90","","7517.9","0.7","150","0.1","150","0.1","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C74 H94 Li4 N4 O P4 -","- C72 H89 Li4 N4 O0.5 P4 -","- C288 H356 Li16 N16 O2 P16 -","4","2","","Matthieu Demange; Leila Boubekeur; Audrey Auffrant; Nicolas Mézailles; Louis Ricard; Xavier Le Goff; Pascal Le Floch","A new and convenient approach towards bis(iminophosphoranyl)methane ligands and their dicationic, cationic, anionic and dianionic derivatives","New Journal of Chemistry","2006","30","12","1745","","10.1039/b610049j","","","0.71069","MoKα","","0.0504","0.0393","","","0.0975","0.102","","","","","","0.998","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052392","11.2887","0.0009","11.8949","0.0009","11.9433","0.0009","117.911","0.008","98.65","0.009","91.797","0.009","1391.5","0.2","293","2","123","2","","","","","","","","6","P 1","P 1","1","Bis(potassium-(4,7,13,1621,24-Hexaoxa-1,10- diazabicyclo(8.8.8)hexacosane))-nonagermanid - ammonia(1/4)","Bis[potassium-(4,7,13,1621,24-Hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane)]- nonagermanid - ammonia(1/4)","","- C36 H84 Ge5 K2 N8 O12 -","- C36 H84 Ge5 K2 N8 O12 -","- C36 H84 Ge5 K2 N8 O12 -","1","1","","Suchentrunk, Christof; Korber, Nikolaus","Ge52? Zintl anions: synthesis and crystal structures of [K([2.2.2]-crypt)]2Ge5?4NH3 and [Rb([2.2.2]-crypt)]2Ge5?4NH3","New Journal of Chemistry","2006","30","12","1737","","10.1039/b610547e","","","0.71073","MoKα","","0.0501","0.0449","","","0.1181","0.1205","","","","","","1.063","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052393","11.3169","0.0015","12.3333","0.0015","20.915","0.003","89.183","0.013","83.6","0.02","78.266","0.015","2840.3","0.7","123","2","123","2","","","","","","","","6","P -1","-P 1","2","Bis(rubidium-(4,7,13,1621,24-Hexaoxa-1,10- diazabicyclo(8.8.8)hexacosane))-nonagermanid - ammonia(1/4)","Bis[rubidium-(4,7,13,1621,24-Hexaoxa-1,10-diazabicyclo[8.8.8]hexacosane)]- nonagermanid - ammonia(1/4)","","- C36 H84 Ge5 N8 O12 Rb2 -","- C36 H84 Ge5 N8 O12 Rb2 -","- C72 H168 Ge10 N16 O24 Rb4 -","2","1","","Suchentrunk, Christof; Korber, Nikolaus","Ge52? Zintl anions: synthesis and crystal structures of [K([2.2.2]-crypt)]2Ge5?4NH3 and [Rb([2.2.2]-crypt)]2Ge5?4NH3","New Journal of Chemistry","2006","30","12","1737","","10.1039/b610547e","","","0.71073","MoKα","","0.0671","0.042","","","0.0946","0.1013","","","","","","0.883","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052394","6.0136","0.0017","29.216","0.008","7.656","0.002","90","","91.536","0.006","90","","1344.6","0.6","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H22 N8 -","- C34 H22 N8 -","- C68 H44 N16 -","2","0.5","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.71073","MoKα","","0.1262","0.0458","","","0.1061","0.1466","","","","","","0.888","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052395","6.2391","0.0004","11.626","0.0008","15.4933","0.0011","93.237","0.001","91.763","0.001","100.927","0.001","1100.7","0.13","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H26 Cl12 N8 -","- C38 H26 Cl12 N8 -","- C38 H26 Cl12 N8 -","1","0.5","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.6768","synchrotron","","0.0649","0.0582","","","0.1419","0.1454","","","","","","1.057","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052396","24.367","0.006","5.9124","0.0015","21.707","0.006","90","","112.744","0.004","90","","2884.1","1.3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C33 H25 Cl3 N8 -","- C33 H25 Cl3 N8 -","- C132 H100 Cl12 N32 -","4","0.5","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.71073","MoKα","","0.1067","0.0571","","","0.1279","0.1412","","","","","","0.886","","","","has coordinates","194618","2020-10-21","18:00:00",""
"7052397","18.067","0.002","5.501","0.0006","16.801","0.002","90","","102.921","0.002","90","","1627.5","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 N8 O2 S2 -","- C34 H34 N8 O2 S2 -","- C68 H68 N16 O4 S4 -","2","0.5","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.71073","MoKα","","0.0887","0.0626","","","0.1348","0.1459","","","","","","1.052","","","","has coordinates","180077","2020-10-21","18:00:00",""
"7052398","10.403","0.002","16.763","0.003","17.194","0.003","80.373","0.003","82.56","0.003","82.475","0.003","2912.9","0.9","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C39.75 H37.25 Cl3.75 Cu4 N14 O22.5 -","- C39.75 H37.25 Cl3.75 Cu4 N14 O22.5 -","- C79.5 H74.5 Cl7.5 Cu8 N28 O45 -","2","1","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.6768","synchrotron","","0.1106","0.0625","","","0.1837","0.213","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052399","8.43","0.002","10.588","0.003","16.58","0.004","85.393","0.004","81.475","0.004","84.808","0.004","1454.2","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C41.2 H41.2 Cl3.6 Cu4 N14 O22 -","- C41.2 H41.2 Cl3.6 Cu4 N14 O22 -","- C41.2 H41.2 Cl3.6 Cu4 N14 O22 -","1","0.5","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.6906","synchrotron","","0.158","0.0842","","","0.214","0.261","","","","","","1.006","","","","has coordinates,has disorder","180077","2020-10-21","18:00:00",""
"7052400","9.4936","0.0019","10.691","0.002","22.746","0.005","85.21","0.03","85.11","0.03","74.06","0.03","2207.4","0.8","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H42 Cd2 N12 O15 -","- C38 H42 Cd2 N12 O15 -","- C76 H84 Cd4 N24 O30 -","2","1","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.6749","Synchrotron","","0.0428","0.0335","","","0.0807","0.0863","","","","","","1.034","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052401","10.7406","0.0004","21.5613","0.001","16.7294","0.0008","90","","99.066","0.003","90","","3825.8","0.3","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C90 H54 Cd2 N28 O12 -","- C90 H54 Cd2 N28 O12 -","- C180 H108 Cd4 N56 O24 -","2","0.5","","Frédéric Thébault; Alexander J. Blake; Claire Wilson; Neil R. Champness; Martin Schröder","Synthesis of pyridazinyl ligands for multimetallic complexes","New Journal of Chemistry","2006","30","10","1498","","10.1039/b611561f","","","0.71073","MoKα","","0.168","0.0805","","","0.117","0.144","","","","","","1.05","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052402","13.5851","0.0012","16.1634","0.0015","48.468","0.005","90","","95.559","0.001","90","","10592.6","1.7","163","2","163","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Complex 4","","","- C88 H86 Ag8 N32 O35 -","- C88 H86 Ag8 N32 O35 -","- C352 H344 Ag32 N128 O140 -","4","1","","Sumby, Christopher J.; Steel, Peter J.","An investigation of the coordination chemistry of the hexadentate ligand di-2-pyridylketone azine; the formation of a discrete tetranuclear complex with silver nitrate","New Journal of Chemistry","2005","29","8","1077","","10.1039/b400879k","","","0.71073","MoKα","","0.1086","0.0487","","","0.0881","0.099","","","","","","1.023","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052403","7.03","0.003","9.039","0.004","9.806","0.004","76.783","0.006","75.962","0.006","68.6","0.006","556","0.4","168","2","168","2","","","","","","","","5","P -1","-P 1","2","Complex 5","","","- C22 H16 Cu N10 O6 -","- C22 H16 Cu N10 O6 -","- C22 H16 Cu N10 O6 -","1","0.5","","Sumby, Christopher J.; Steel, Peter J.","An investigation of the coordination chemistry of the hexadentate ligand di-2-pyridylketone azine; the formation of a discrete tetranuclear complex with silver nitrate","New Journal of Chemistry","2005","29","8","1077","","10.1039/b400879k","","","0.71073","MoKα","","0.0414","0.0295","","","0.0661","0.0678","","","","","","0.989","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052404","11.9524","0.0008","11.9524","0.0008","7.6116","0.0004","90","","90","","90","","1087.39","0.12","293","2","293","2","","","","","","","","2","P -4 21 c","P -4 2n","114","","","","- C6 S8 -","- C6 S8 -","- C24 S32 -","4","0.5","","Beck, Johannes; Weber, Johannes; Mukhopadhyay, Atashi Basu; Dolg, Michael","Bent and planar molecules in polymorphs of the tricyclic carbon sulfide C6S8","New Journal of Chemistry","2005","29","3","465","","10.1039/b402881c","","","1.54184","CuKα","","0.0478","0.0346","","","0.0787","0.0849","","","","","","1.042","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052405","12.303","0.0003","17.02","0.0004","16.877","0.0006","90","","96.651","0.0011","90","","3510.21","0.17","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H100 F6 N8 O8 S2 -","- C54 H100 F6 N8 O7.98 S2 -","- C108 H200 F12 N16 O15.96 S4 -","2","0.5","","Taquet, Jean-philippe; Siri, Olivier; Collin, Jean-Paul; Messaoudi, Abdellatif; Braunstein, Pierre","One-electron oxidation-induced dimerising C?C coupling of a 2,5-diamino-1,4-benzoquinonediimine: a chemical and electrochemical investigation","New Journal of Chemistry","2005","29","1","188","","10.1039/b408762c","","","0.71073","MoKα","","0.2167","0.1451","","","0.382","0.4187","","","","","","1.33","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052406","10.922","0.003","11.627","0.002","15.562","0.004","80.772","0.009","77.567","0.013","77.758","0.011","1872.3","0.8","123","2","123","2","","","","","","","","5","P -1","-P 1","2","[Li(N,N'-Dipamidine)(THF)2]","","","- C40 H57 Li N2 O2 -","- C40 H57 Li N2 O2 -","- C80 H114 Li2 N4 O4 -","2","1","","René T. Boeré; Marcus L. Cole; Peter C. Junk","The syntheses and structures of some main group complexes of the sterically hindered N,N?-bis(2,6-diisopropylphenyl)-4-toluamidinate ligand","New Journal of Chemistry","2005","29","1","128","","10.1039/b409086a","","x-ray","0.71073","MoKα","","0.2305","0.0719","","","0.1563","0.2172","","","","","","0.893","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052407","23.409","0.0011","10.6758","0.0004","25.0402","0.0012","90","","114.337","0.003","90","","5701.7","0.5","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","[Mg(N,N'-Dipamidine)2]","","","- C32 H41 Mg0.5 N2 -","- C32 H41 Mg0.5 N2 -","- C256 H328 Mg4 N16 -","8","1","","René T. Boeré; Marcus L. Cole; Peter C. Junk","The syntheses and structures of some main group complexes of the sterically hindered N,N?-bis(2,6-diisopropylphenyl)-4-toluamidinate ligand","New Journal of Chemistry","2005","29","1","128","","10.1039/b409086a","","x-ray","0.71073","MoKα","","0.2285","0.0666","","","0.1387","0.1947","","","","","","0.908","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052408","15.2283","0.0004","15.2283","0.0004","12.091","0.0002","90","","90","","120","","2428.26","0.1","123","2","123","2","","","","","","","","4","P 31","P 31","144","[Al(N,N'-Dipamidine)(Me)2]","","","- C34 H47 Al N2 -","- C34 H47 Al N2 -","- C102 H141 Al3 N6 -","3","1","","René T. Boeré; Marcus L. Cole; Peter C. Junk","The syntheses and structures of some main group complexes of the sterically hindered N,N?-bis(2,6-diisopropylphenyl)-4-toluamidinate ligand","New Journal of Chemistry","2005","29","1","128","","10.1039/b409086a","","x-ray","0.71073","MoKα","","0.0783","0.0477","","","0.0946","0.1117","","","","","","1.063","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052409","19.947","0.005","11.67","0.002","20.004","0.007","90","","101.878","0.01","90","","4557","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14.5 H34 Mo N O4 P3 -","- C14.5 H30 Mo N O4 P3 -","- C116 H240 Mo8 N8 O32 P24 -","8","1","","Leopoldo Contreras; Margarita Paneque; Murielle Sellin; Ernesto Carmona; Pedro J. Pérez; Enrique Gutiérrez-Puebla; Angeles Monge; Caridad Ruiz","Novel carbon dioxide and carbonyl carbonate complexes of molybdenum. The X-ray structures of trans-[Mo(CO2)2{HN(CH2CH2PMe2)2}(PMe3)] and [Mo3(µ2-CO3)(µ2-O)2(O)2(CO)2(H2O)(PMe3)6]·H2O","New Journal of Chemistry","2005","29","1","109","","10.1039/b409385b","","","0.71073","MoKα","","0.2355","0.0645","","","0.1734","0.2384","","","","","","0.911","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052410","9.7692","0.001","16.3332","0.001","24.6818","0.001","90","","98.993","0.01","90","","3889.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H58 Mo3 O11 P6 -","- C21 H58 Mo3 O11 P6 -","- C84 H232 Mo12 O44 P24 -","4","1","","Leopoldo Contreras; Margarita Paneque; Murielle Sellin; Ernesto Carmona; Pedro J. Pérez; Enrique Gutiérrez-Puebla; Angeles Monge; Caridad Ruiz","Novel carbon dioxide and carbonyl carbonate complexes of molybdenum. The X-ray structures of trans-[Mo(CO2)2{HN(CH2CH2PMe2)2}(PMe3)] and [Mo3(µ2-CO3)(µ2-O)2(O)2(CO)2(H2O)(PMe3)6]·H2O","New Journal of Chemistry","2005","29","1","109","","10.1039/b409385b","","","0.71073","MoKα","","0.076","0.0327","","","0.0889","0.1038","","","","","","1.065","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052411","28.259","0.003","8.4639","0.0007","16.7535","0.0015","90","","100.473","0.001","90","","3940.4","0.6","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 Cl2 O3 Re -","- C19 H21 Cl2 O3 Re -","- C152 H168 Cl16 O24 Re8 -","8","2","","Alvaro Aballay; Eric Clot; Odile Eisenstein; Maria Teresa Garland; Fernando Godoy; A. Hugo Klahn; Juan Carlos Muñoz; Beatriz Oelckers","Selectivity in C?Cl bond activation of dichloroarenes by photogenerated Cp*Re(CO)2: combined experimental and DFT studies","New Journal of Chemistry","2005","29","1","226","","10.1039/b410265g","","","0.71073","MoKα","","0.0649","0.0434","","","0.0997","0.1108","","","","","","0.917","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052412","14.0448","0.0012","8.5444","0.0007","15.8837","0.0014","90","","90","","90","","1906.1","0.3","297","2","297","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C19 H21 Cl2 O2 Re -","- C19 H21 Cl2 O2 Re -","- C76 H84 Cl8 O8 Re4 -","4","1","","Alvaro Aballay; Eric Clot; Odile Eisenstein; Maria Teresa Garland; Fernando Godoy; A. Hugo Klahn; Juan Carlos Muñoz; Beatriz Oelckers","Selectivity in C?Cl bond activation of dichloroarenes by photogenerated Cp*Re(CO)2: combined experimental and DFT studies","New Journal of Chemistry","2005","29","1","226","","10.1039/b410265g","","","0.71073","MoKα","","0.0373","0.0287","","","0.0546","0.0579","","","","","","0.985","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052413","12.007","0.003","13.152","0.004","16.196","0.005","90","","102.99","0.02","90","","2492.2","1.3","296.2","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H33 N3 O2 -","- C30 H33 N3 O2 -","- C120 H132 N12 O8 -","4","1","","Ooyama, Yousuke; Nakamura, Takato; Yoshida, Katsuhira","Heterocyclic quinol-type fluorophores. Synthesis of novel imidazoanthraquinol derivatives and their photophysical properties in benzene and in the crystalline state","New Journal of Chemistry","2005","29","3","447","","10.1039/b410311d","","","0.7107","MoKα","","0.2316","0.0763","","","0.149","0.2316","","","","","","1.068","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052414","11.224","0.002","11.907","0.002","12.51","0.002","77.529","0.005","89.453","0.005","76.548","0.005","1586.2","0.5","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H54 O2 P2 Ru -","- C30 H54 O2 P2 Ru -","- C60 H108 O4 P4 Ru2 -","2","1","","Ferrando-Miguel, German; Wu, Peng; Huffman, John C.; Caulton, Kenneth G.","New d4 dihydrides of Ru(iv) and Os(iv) with ?-donor ligands: M(H)2(chelate)(PiPr3)2 with chelate =ortho-XYC6H4 with X, Y = O, NR; R = H or CH3","New Journal of Chemistry","2005","29","1","193","","10.1039/b411487f","","","0.71073","MoKα","","","0.0351","","","","0.0346","","","","","","1.033","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052415","8.9882","0.0003","21.8475","0.0009","14.1438","0.0006","90","","97.422","0.001","90","","2754.14","0.19","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H52 N2 Os P2 -","- C25 H50 N2 Os P2 -","- C100 H200 N8 Os4 P8 -","4","2","","Ferrando-Miguel, German; Wu, Peng; Huffman, John C.; Caulton, Kenneth G.","New d4 dihydrides of Ru(iv) and Os(iv) with ?-donor ligands: M(H)2(chelate)(PiPr3)2 with chelate =ortho-XYC6H4 with X, Y = O, NR; R = H or CH3","New Journal of Chemistry","2005","29","1","193","","10.1039/b411487f","","","0.71073","MoKα","","0.0389","0.0322","","","0.0674","0.0698","","","","","","1.032","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052416","11.174","0.002","14.01","0.003","17.346","0.004","93.49","0.03","97.46","0.03","109.51","0.03","2522.1","1.1","123","2","123","2","","","","","","","","5","P -1","-P 1","2","[Ca(DippForm)2(THF)]","","","- C54 H78 Ca N4 O -","- C54 H78 Ca N4 O -","- C108 H156 Ca2 N8 O2 -","2","1","","Cole, Marcus L.; Junk, Peter C.","N,N?-Bis(2,6-diisopropylphenyl)formamidinate complexes of the heavy alkaline earths","New Journal of Chemistry","2005","29","1","135","","10.1039/b411494a","","x-ray","0.71073","MoKα","","0.2771","0.082","","","0.1437","0.2012","","","","","","0.947","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052417","12.0689","0.0003","12.7964","0.0005","19.6889","0.0007","84.466","0.003","86.449","0.003","64.201","0.001","2724.21","0.16","123","2","123","2","","","","","","","","5","P -1","-P 1","2","[Sr(DippForm)2(THF)2]","","","- C58 H86 N4 O2 Sr -","- C58 H86 N4 O2 Sr -","- C116 H172 N8 O4 Sr2 -","2","1","","Cole, Marcus L.; Junk, Peter C.","N,N?-Bis(2,6-diisopropylphenyl)formamidinate complexes of the heavy alkaline earths","New Journal of Chemistry","2005","29","1","135","","10.1039/b411494a","","x-ray","0.71073","MoKα","","0.143","0.0723","","","0.1359","0.1658","","","","","","1.038","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052418","11.9811","0.0004","12.8483","0.0004","20.3537","0.0009","84.463","0.001","86.001","0.001","63.451","0.003","2788.47","0.19","123","2","123","2","","","","","","","","5","P -1","-P 1","2","[Ba(DippForm)2(THF)2]","","","- C58 H86 Ba N4 O2 -","- C58 H86 Ba N4 O2 -","- C116 H172 Ba2 N8 O4 -","2","1","","Cole, Marcus L.; Junk, Peter C.","N,N?-Bis(2,6-diisopropylphenyl)formamidinate complexes of the heavy alkaline earths","New Journal of Chemistry","2005","29","1","135","","10.1039/b411494a","","x-ray","0.71073","MoKα","","0.1428","0.0533","","","0.0913","0.1138","","","","","","0.953","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052419","9.4525","0.0004","11.418","0.0005","14.3724","0.0007","110.256","0.003","91.904","0.002","106.104","0.001","1383.7","0.11","123","2","123","2","","","","","","","","4","P -1","-P 1","2","DippN(4-HC6F4)C(H)NDipp","","","- C31 H36 F4 N2 -","- C31 H36 F4 N2 -","- C62 H72 F8 N4 -","2","1","","Cole, Marcus L.; Junk, Peter C.","N,N?-Bis(2,6-diisopropylphenyl)formamidinate complexes of the heavy alkaline earths","New Journal of Chemistry","2005","29","1","135","","10.1039/b411494a","","x-ray","0.71073","MoKα","","0.0785","0.049","","","0.1425","0.1659","","","","","","0.984","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052420","10.0686","0.0007","17.8421","0.0012","12.4515","0.0008","90","","113.427","0.001","90","","2052.5","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H74 N2 O8 Ti2 -","- C30 H74 N2 O8 Ti2 -","- C60 H148 N4 O16 Ti4 -","2","0.5","","Fric, Helmut; Schubert, Ulrich","Amine adducts of titanium tetraalkoxides","New Journal of Chemistry","2005","29","1","232","","10.1039/b411688g","","","0.71073","MoKα","","0.0418","0.0383","","","0.1128","0.1156","","","","","","1.084","","","","has coordinates","275164","2022-05-07","00:11:35",""
"7052421","9.394","0.006","12.441","0.009","14.435","0.009","100.633","0.014","95.931","0.016","111.947","0.012","1510.2","1.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H110 N2 O14 Si2 Ti2 -","- C46 H110 N2 O14 Si2 Ti2 -","- C46 H110 N2 O14 Si2 Ti2 -","1","0.5","","Fric, Helmut; Schubert, Ulrich","Amine adducts of titanium tetraalkoxides","New Journal of Chemistry","2005","29","1","232","","10.1039/b411688g","","","0.71073","MoKα","","0.2755","0.1158","","","0.2523","0.291","","","","","","0.829","","","","has coordinates","275164","2022-05-07","00:11:35",""
"7052422","9.6481","0.0011","9.8787","0.0011","12.2188","0.0014","78.936","0.002","82.489","0.002","78.503","0.002","1114.8","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C37 H79 N2 O8 Ti2 -","- C37 H79 N2 O8 Ti2 -","- C37 H79 N2 O8 Ti2 -","1","0.5","","Fric, Helmut; Schubert, Ulrich","Amine adducts of titanium tetraalkoxides","New Journal of Chemistry","2005","29","1","232","","10.1039/b411688g","","","0.71073","MoKα","","0.0401","0.0368","","","0.0986","0.1006","","","","","","1.038","","","","has coordinates","275164","2022-05-07","00:11:35",""
"7052423","18.061","0.002","20.378","0.002","25.193","0.004","69.128","0.015","69.681","0.015","69.84","0.018","7862","2","150","","150","","","","","","","","see text","5","P -1","-P 1","2","","","","- C200 H307.1 N16 O65.55 S32 -","- C200 H307.104 N16 O65.552 S32 -","- C200 H307.104 N16 O65.552 S32 -","1","0.5","","Corbellini, Francesca; van Leeuwen, Fijs W. B.; Beijleveld, Hans; Kooijman, Huub; Spek, Anthony L.; Verboom, Willem; Crego-Calama, Mercedes; Reinhoudt, David N.","Multiple ionic interactions for noncovalent synthesis of molecular capsules in polar solvents","New Journal of Chemistry","2005","29","1","243","","10.1039/b412409j","","x-ray","0.71073","MoKα","","0.1427","0.0995","","","0.2518","0.2676","","","","","","1.282","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052424","16.374","0.005","17.289","0.005","9.688","0.002","98.63","0.02","106.33","0.02","74.81","0.02","2531.3","1.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Compound 1","","- C24 H10 N2 O10 Os3 -","- C24 H10 N2 O10 Os3 -","- C96 H40 N8 O40 Os12 -","4","2","","Clarke, Lionel P.; Cole, Jacqueline M.; Davies, John E.; French, Alexandra; Koentjoro, Olivia F.; Raithby, Paul R.; Shields, Gregory P.","Molecular rearrangements of diynes coordinated to triosmium carbonyl clusters: reactions of [Os3(�-H)2(CO)10] and [Os3(CO)10(MeCN)2] with 1,4-dipyridylbuta-1,3-diyne","New Journal of Chemistry","2005","29","1","145","","10.1039/b412578a","","","0.71073","MoKα","","0.0529","0.0399","","0.1052","0.0977","","","","1.024","1.047","1.047","","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052425","21.296","0.002","13.576","0.002","18.931","0.002","90","","107.15","0.01","90","","5229.9","1.1","293","2","293","2","","","","","","","CH2Cl2/CDCl3 evaporation","5","P 1 21/c 1","-P 2ybc","14","","Compound 2","","- C24 H10 N2 O10 Os3 -","- C24 H10 N2 O10 Os3 -","- C192 H80 N16 O80 Os24 -","8","2","","Clarke, Lionel P.; Cole, Jacqueline M.; Davies, John E.; French, Alexandra; Koentjoro, Olivia F.; Raithby, Paul R.; Shields, Gregory P.","Molecular rearrangements of diynes coordinated to triosmium carbonyl clusters: reactions of [Os3(�-H)2(CO)10] and [Os3(CO)10(MeCN)2] with 1,4-dipyridylbuta-1,3-diyne","New Journal of Chemistry","2005","29","1","145","","10.1039/b412578a","","","0.71073","MoKα","","0.0808","0.0448","","0.0955","0.0833","","","","1.051","1.111","1.111","","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052426","10.25","0.005","14.515","0.004","8.843","0.002","107.27","0.02","102.64","0.04","85.36","0.03","1225.7","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Compound 3","","- C23 H10 N2 O9 Os3 -","- C23 H10 N2 O9 Os3 -","- C46 H20 N4 O18 Os6 -","2","1","","Clarke, Lionel P.; Cole, Jacqueline M.; Davies, John E.; French, Alexandra; Koentjoro, Olivia F.; Raithby, Paul R.; Shields, Gregory P.","Molecular rearrangements of diynes coordinated to triosmium carbonyl clusters: reactions of [Os3(�-H)2(CO)10] and [Os3(CO)10(MeCN)2] with 1,4-dipyridylbuta-1,3-diyne","New Journal of Chemistry","2005","29","1","145","","10.1039/b412578a","","","0.71073","MoKα","","0.0982","0.0406","","0.1068","0.0891","","","","1.012","1.056","1.056","","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052427","11.258","0.002","12.994","0.003","8.381","0.002","104.69","0.03","103.26","0.03","85.71","0.03","1154.2","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Compound 6 . 2 dichloromethane","","- C36 H12 Cl4 N2 O20 Os6 -","- C36 H12 Cl4 N2 O20 Os6 -","- C36 H12 Cl4 N2 O20 Os6 -","1","0.5","","Clarke, Lionel P.; Cole, Jacqueline M.; Davies, John E.; French, Alexandra; Koentjoro, Olivia F.; Raithby, Paul R.; Shields, Gregory P.","Molecular rearrangements of diynes coordinated to triosmium carbonyl clusters: reactions of [Os3(�-H)2(CO)10] and [Os3(CO)10(MeCN)2] with 1,4-dipyridylbuta-1,3-diyne","New Journal of Chemistry","2005","29","1","145","","10.1039/b412578a","","","0.71073","MoKα","","0.0782","0.0379","","0.1484","0.0882","","","","1.037","1.077","1.077","","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052428","8.784","0.0006","28.201","0.003","16.797","0.0009","90","","97.085","0.005","90","","4129.1","0.6","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Compound 6","","- C34 H8 N2 O20 Os6 -","- C34 H8 N2 O20 Os6 -","- C136 H32 N8 O80 Os24 -","4","2","","Clarke, Lionel P.; Cole, Jacqueline M.; Davies, John E.; French, Alexandra; Koentjoro, Olivia F.; Raithby, Paul R.; Shields, Gregory P.","Molecular rearrangements of diynes coordinated to triosmium carbonyl clusters: reactions of [Os3(�-H)2(CO)10] and [Os3(CO)10(MeCN)2] with 1,4-dipyridylbuta-1,3-diyne","New Journal of Chemistry","2005","29","1","145","","10.1039/b412578a","","","0.71073","MoKα","","0.0692","0.0495","","","0.1029","0.1116","","","","","","0.986","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052429","11.211","0.004","19.277","0.004","19.435","0.003","90","","105.13","0.02","90","","4054.6","1.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Compound 7","","- C34 H10 N2 O20 Os6 -","- C34 H10 N2 O20 Os6 -","- C136 H40 N8 O80 Os24 -","4","1","","Clarke, Lionel P.; Cole, Jacqueline M.; Davies, John E.; French, Alexandra; Koentjoro, Olivia F.; Raithby, Paul R.; Shields, Gregory P.","Molecular rearrangements of diynes coordinated to triosmium carbonyl clusters: reactions of [Os3(�-H)2(CO)10] and [Os3(CO)10(MeCN)2] with 1,4-dipyridylbuta-1,3-diyne","New Journal of Chemistry","2005","29","1","145","","10.1039/b412578a","","","0.71073","MoKα","","0.1858","0.0636","","0.1995","0.1342","","","","1.023","1.103","1.103","","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052430","12.1071","0.0007","31.5677","0.0017","8.0986","0.0004","90","","108.907","0.001","90","","2928.2","0.3","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ni-3B","","","- C36 H32 N4 Ni -","- C36 H32 N4 Ni -","- C144 H128 N16 Ni4 -","4","1","","Hubert S. Gill; Isaac Finger; Ivana Božidarevič; Florence Szydlo; Michael J. Scott","Preparation of α,β-unsubstituted meso-arylbidipyrrins via metal-templated, oxidative coupling of dipyrrins","New Journal of Chemistry","2005","29","1","68","","10.1039/b412620c","","","0.71073","MoKα","","0.0477","0.0392","","","0.0951","0.099","","","","","","1.079","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052431","30.6299","0.0016","8.0062","0.0004","26.695","0.0014","90","","116.586","0.001","90","","5854.2","0.5","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Ni-2B","","","- C36 H34 N4 Ni -","- C36 H34 N4 Ni -","- C288 H272 N32 Ni8 -","8","1","","Hubert S. Gill; Isaac Finger; Ivana Božidarevič; Florence Szydlo; Michael J. Scott","Preparation of α,β-unsubstituted meso-arylbidipyrrins via metal-templated, oxidative coupling of dipyrrins","New Journal of Chemistry","2005","29","1","68","","10.1039/b412620c","","","0.71073","MoKα","","0.0437","0.0347","","","0.0867","0.0913","","","","","","1.05","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052432","8.778","0.001","5.62","0.001","15.635","0.002","90","","98.504","0.005","90","","762.83","0.19","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H6 N4 O4 -","- C6 H6 N4 O4 -","- C24 H24 N16 O16 -","4","1","","Siri, Olivier; Braunstein, Pierre","Tuning the synthesis of a dinitroaromatic towards a new trinitroaromatic stabilized energetic material","New Journal of Chemistry","2005","29","1","75","","10.1039/b412789g","","","0.71069","MoKα","","0.0733","0.0489","","","0.1124","0.1211","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052433","11.4133","0.0002","12.1448","0.0002","17.4349","0.0003","84.6835","0.0007","72.1592","0.0007","75.5004","0.0007","2226.87","0.07","173.2","","173.2","","","","","","","","","6","P -1","-P 1","2","","","","- C51 H40 Cl5 O P2 Re -","- C51 H40 Cl5 O P2 Re -","- C102 H80 Cl10 O2 P4 Re2 -","2","1","","Parr, Maria L.; Perez-Acosta, Carmen; Faller, J. W.","Synthesis, characterization and structural investigation of new rhenium-oxo complexes containing bidentate phosphine ligands: an exploration of chirality and conformation in chelate rings of small and large bite angle ligands","New Journal of Chemistry","2005","29","4","613","","10.1039/b412818d","","","0.7107","MoKα","","0.0478","0.031","","0.037","","0.033","","","1.011","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052434","10.6209","0.0003","11.6561","0.0003","16.7301","0.0005","69.9318","0.0013","85.4535","0.0013","69.6","0.0013","1821.48","0.09","173.2","","173.2","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H38 Cl3 O2 P2 Re -","- C36 H28 Cl3 O P2 Re -","- C72 H56 Cl6 O2 P4 Re2 -","2","1","","Parr, Maria L.; Perez-Acosta, Carmen; Faller, J. W.","Synthesis, characterization and structural investigation of new rhenium-oxo complexes containing bidentate phosphine ligands: an exploration of chirality and conformation in chelate rings of small and large bite angle ligands","New Journal of Chemistry","2005","29","4","613","","10.1039/b412818d","","","0.7107","MoKα","","0.0857","0.045","","0.053","","0.046","","","1.292","","","1.45","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052435","9.7531","0.0002","13.2526","0.0003","17.0097","0.0005","71.8177","0.001","74.7252","0.001","69.727","0.001","1929.41","0.08","173.2","","173.2","","","","","","","","","6","P -1","-P 1","2","","","","- C38 H32 Cl7 O2 P2 Re -","- C38 H32 Cl7 O2 P2 Re -","- C76 H64 Cl14 O4 P4 Re2 -","2","1","","Parr, Maria L.; Perez-Acosta, Carmen; Faller, J. W.","Synthesis, characterization and structural investigation of new rhenium-oxo complexes containing bidentate phosphine ligands: an exploration of chirality and conformation in chelate rings of small and large bite angle ligands","New Journal of Chemistry","2005","29","4","613","","10.1039/b412818d","","","0.7107","MoKα","","0.0669","0.034","","0.07","","0.032","","","1.522","","","0.88","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052436","8.723","0.007","13.581","0.002","13.656","0.003","94.42","0.01","93.37","0.05","92.69","0.04","1608","1.4","295","","295","","","","","","","","?","6","P -1","-P 1","2","","","","- C34 H30 Cr N6 O P -","- C34 H26 Cr N6 O P -","- C68 H52 Cr2 N12 O2 P2 -","2","1","","Luminita Toma; Rodrigue Lescouëzec; Jacqueline Vaissermann; Patrick Herson; Valérie Marvaud; Francesc Lloret; Miguel Julve","[CrIII(L)(CN)4]-: a new building block in designing cyanide-bridged 4,2-ribbon-like chains {[CrIII(L)(CN)4]2Mn(H2O)2}·nH2O [L = 2-aminomethylpyridine (n = 6) and 1,10-phenanthroline (n = 4)]","New Journal of Chemistry","2005","29","1","210","","10.1039/b413473g","","","0.71073","MoKα","","0.1079","0.0527","","0.0757","0.0591","0.0591","","","","","","0.9488","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052437","9.369","0.003","27.635","0.007","14.477","0.004","90","","97.52","0.02","90","","3716","1.8","295","","295","","","","1","","","","?","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H34 Cr N6 O2 P -","- C41 H34 Cr N6 O2 P -","- C164 H136 Cr4 N24 O8 P4 -","4","1","","Luminita Toma; Rodrigue Lescouëzec; Jacqueline Vaissermann; Patrick Herson; Valérie Marvaud; Francesc Lloret; Miguel Julve","[CrIII(L)(CN)4]-: a new building block in designing cyanide-bridged 4,2-ribbon-like chains {[CrIII(L)(CN)4]2Mn(H2O)2}·nH2O [L = 2-aminomethylpyridine (n = 6) and 1,10-phenanthroline (n = 4)]","New Journal of Chemistry","2005","29","1","210","","10.1039/b413473g","","","0.71073","MoKα","","0.1208","0.0466","","0.0594","0.0547","0.0547","","","","","","1.1061","","","","has coordinates","198676","2020-10-21","18:00:00",""
"7052438","7.191","0.005","10.566","0.007","11.906","0.005","101.66","0.04","107.08","0.04","96.72","0.05","831.7","0.9","295","","295","","","","","","","","?","6","P -1","-P 1","2","","","","- C20 H32 Cr2 Mn N12 O8 -","- C20 H16 Cr2 Mn N12 O8 -","- C20 H16 Cr2 Mn N12 O8 -","1","0.5","","Luminita Toma; Rodrigue Lescouëzec; Jacqueline Vaissermann; Patrick Herson; Valérie Marvaud; Francesc Lloret; Miguel Julve","[CrIII(L)(CN)4]-: a new building block in designing cyanide-bridged 4,2-ribbon-like chains {[CrIII(L)(CN)4]2Mn(H2O)2}·nH2O [L = 2-aminomethylpyridine (n = 6) and 1,10-phenanthroline (n = 4)]","New Journal of Chemistry","2005","29","1","210","","10.1039/b413473g","","","0.71073","MoKα","","0.063","0.0599","","0.0632","0.0618","0.0618","","","","","","1.0327","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052439","7.641","0.005","15.569","0.004","15.49","0.004","90","","93.69","0.04","90","","1838.9","1.4","295","","295","","","","1","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H28 Cr2 Mn N12 O6 -","- C32 H16 Cr2 Mn N12 O6 -","- C64 H32 Cr4 Mn2 N24 O12 -","2","0.5","","Luminita Toma; Rodrigue Lescouëzec; Jacqueline Vaissermann; Patrick Herson; Valérie Marvaud; Francesc Lloret; Miguel Julve","[CrIII(L)(CN)4]-: a new building block in designing cyanide-bridged 4,2-ribbon-like chains {[CrIII(L)(CN)4]2Mn(H2O)2}·nH2O [L = 2-aminomethylpyridine (n = 6) and 1,10-phenanthroline (n = 4)]","New Journal of Chemistry","2005","29","1","210","","10.1039/b413473g","","","0.71073","MoKα","","0.1139","0.0912","","0.0891","0.0811","0.0811","","","","","","1.0766","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052440","8.961","0.001","9.253","0.001","11.405","0.002","109.38","0.01","103.19","0.01","96.75","0.01","849.1","0.2","299","2","299","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H24 F4 -","- C19 H24 F4 -","- C38 H48 F8 -","2","1","","Bremer, Matthias; Lietzau, Lars","1,1,6,7-Tetrafluoroindanes: improved liquid crystals for LCD-TV application","New Journal of Chemistry","2005","29","1","72","","10.1039/b414312d","","","0.71073","MoKα","","0.1287","0.055","","","0.1181","0.1486","","","","","","0.986","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052441","10.212","0.002","16.968","0.003","17.657","0.004","90","","91.45","0.03","90","","3058.6","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H36 O9 Sn W -","- C21 H36 O9 Sn2 W -","- C84 H144 O36 Sn8 W4 -","4","1","","Veith, Michael; Ehses, Markus; Huch, Volker","Synthesis, solid-state molecular structure and solution dynamics of new alkoxy stannylene-transition metal complexes","New Journal of Chemistry","2005","29","1","154","","10.1039/b414662j","","","0.71073","MoKα","","0.1038","0.0964","","","0.234","0.241","","","","","","1.181","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052442","10.238","0.002","17.01","0.003","17.6","0.004","90","","91.03","0.03","90","","3064.5","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H36 Cr O9 Sn2 -","- C21 H36 Cr O9 Sn2 -","- C84 H144 Cr4 O36 Sn8 -","4","1","","Veith, Michael; Ehses, Markus; Huch, Volker","Synthesis, solid-state molecular structure and solution dynamics of new alkoxy stannylene-transition metal complexes","New Journal of Chemistry","2005","29","1","154","","10.1039/b414662j","","","0.71073","MoKα","","0.0938","0.0638","","","0.1555","0.1824","","","","","","1.113","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052443","12.599","0.003","11.177","0.002","13.217","0.003","90","","95.24","0.03","90","","1853.4","0.7","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C26 H36 Cr2 O14 Sn2 -","- C26 H37 Cr2 O14 Sn2 -","- C52 H74 Cr4 O28 Sn4 -","2","0.5","","Veith, Michael; Ehses, Markus; Huch, Volker","Synthesis, solid-state molecular structure and solution dynamics of new alkoxy stannylene-transition metal complexes","New Journal of Chemistry","2005","29","1","154","","10.1039/b414662j","","","0.71073","MoKα","","0.0365","0.0331","","","0.0839","0.0868","","","","","","1.097","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052444","12.55","0.003","11.19","0.002","13.39","0.003","90","","94.97","0.03","90","","1873.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C26 H36 Cr O14 Sn2 W -","- C26 H36 Cr O14 Sn2 W -","- C52 H72 Cr2 O28 Sn4 W2 -","2","0.5","","Veith, Michael; Ehses, Markus; Huch, Volker","Synthesis, solid-state molecular structure and solution dynamics of new alkoxy stannylene-transition metal complexes","New Journal of Chemistry","2005","29","1","154","","10.1039/b414662j","","","0.71073","MoKα","","0.0712","0.0616","","","0.1904","0.199","","","","","","1.707","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052445","29.4551","0.0005","15.4086","0.0002","25.479","0.0005","90","","99.503","0.003","90","","11405.3","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C64.5 H73 Br0.5 N0.5 O11 -","- C64.5 H56 Br0.5 N0.5 O11 -","- C516 H448 Br4 N4 O88 -","8","1","","Heidi Mansikkamäki; Christoph A. Schalley; Maija Nissinen; Kari Rissanen","Weak interactions between resorcinarenes and diquaternary alkyl ammonium cations","New Journal of Chemistry","2005","29","1","116","","10.1039/b415401k","","","0.71073","MoKα","","0.1861","0.1075","","","0.2758","0.3237","","","","","","1.014","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052446","12.4513","0.0002","13.6703","0.0002","19.7836","0.0004","71.716","0.005","79.631","0.005","72.394","0.001","3034.14","0.12","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H88 Br4 N4 O11 -","- C55 H88 Br4 N4 O11 -","- C110 H176 Br8 N8 O22 -","2","1","","Heidi Mansikkamäki; Christoph A. Schalley; Maija Nissinen; Kari Rissanen","Weak interactions between resorcinarenes and diquaternary alkyl ammonium cations","New Journal of Chemistry","2005","29","1","116","","10.1039/b415401k","","","0.71073","MoKα","","0.1057","0.0486","","","0.0766","0.0898","","","","","","1.023","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052447","12.0544","0.0001","12.8536","0.0002","15.3163","0.0002","85.953","0.001","84.491","0.001","69.52","0.001","2211.14","0.05","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H64 Br2 N2 O9 -","- C46 H64 Br2 N2 O9 -","- C92 H128 Br4 N4 O18 -","2","1","","Heidi Mansikkamäki; Christoph A. Schalley; Maija Nissinen; Kari Rissanen","Weak interactions between resorcinarenes and diquaternary alkyl ammonium cations","New Journal of Chemistry","2005","29","1","116","","10.1039/b415401k","","","0.71069","MoKα","","0.0385","0.0298","","","0.0651","0.0692","","","","","","1.022","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052448","11.3877","0.0002","12.5699","0.0003","17.5983","0.0004","99.359","0.001","91.183","0.001","98.78","0.001","2453.73","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H74 Cl2 N2 O10 -","- C50 H74 Cl2 N2 O10 -","- C100 H148 Cl4 N4 O20 -","2","1","","Heidi Mansikkamäki; Christoph A. Schalley; Maija Nissinen; Kari Rissanen","Weak interactions between resorcinarenes and diquaternary alkyl ammonium cations","New Journal of Chemistry","2005","29","1","116","","10.1039/b415401k","","","0.71073","MoKα","","0.1064","0.0605","","","0.1282","0.1487","","","","","","1.02","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052449","53.256","0.0008","12.649","0.0003","20.5761","0.0007","90","","97.955","0.001","90","","13727.4","0.6","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C66 H107 Br3 N3 O10 -","- C66 H105 Br3 N3 O10 -","- C528 H840 Br24 N24 O80 -","8","1","","Heidi Mansikkamäki; Christoph A. Schalley; Maija Nissinen; Kari Rissanen","Weak interactions between resorcinarenes and diquaternary alkyl ammonium cations","New Journal of Chemistry","2005","29","1","116","","10.1039/b415401k","","","0.71073","MoKα","","0.145","0.0677","","","0.1346","0.1656","","","","","","1.015","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052450","15.8558","0.0003","17.823","0.0004","20.256","0.0004","85.693","0.001","88.54","0.001","86.632","0.001","5697","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C117 H164 Br3 N3 O23.5 -","- C117 H151 Br3 N3 O23.5 -","- C234 H302 Br6 N6 O47 -","2","1","","Heidi Mansikkamäki; Christoph A. Schalley; Maija Nissinen; Kari Rissanen","Weak interactions between resorcinarenes and diquaternary alkyl ammonium cations","New Journal of Chemistry","2005","29","1","116","","10.1039/b415401k","","","0.71073","MoKα","","0.1874","0.074","","","0.1388","0.1746","","","","","","0.992","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052451","9.8246","0.0001","15.7155","0.0002","26.8439","0.0004","91.387","0.001","91.438","0.001","92.686","0.001","4137.46","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C87 H140 Br N O10.5 -","- C87 H137.5 Br N O10.5 -","- C174 H275 Br2 N2 O21 -","2","1","","Heidi Mansikkamäki; Christoph A. Schalley; Maija Nissinen; Kari Rissanen","Weak interactions between resorcinarenes and diquaternary alkyl ammonium cations","New Journal of Chemistry","2005","29","1","116","","10.1039/b415401k","","","0.71073","MoKα","","0.1194","0.0644","","","0.1212","0.1423","","","","","","1.034","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052452","15.882","0.0003","10.2424","0.0002","26.2432","0.0006","90","","94.555","0.0007","90","","4255.49","0.15","180","","180","","","","","","","","?","6","P 1 21/c 1","-P 2ybc","14","","","","- C63 H81 Br2 Cl15 N2 O16 -","- C63 H81 Br2 Cl15 Li2 N2 O16 -","- C126 H162 Br4 Cl30 Li4 N4 O32 -","2","0.5","","Pascu, Sofia I.; Jarrosson, Thibaut; Naumann, Christoph; Otto, Sijbren; Kaiser, Guido; Sanders, Jeremy K. M.","Cation-reinforced donor-acceptor pseudorotaxanes","New Journal of Chemistry","2005","29","1","80","","10.1039/b415418e","","","0.71073","MoKα","","0.1577","0.1","","0.1528","0.1184","0.1184","","","","","","1.0981","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052453","10.7147","0.0002","13.4449","0.0002","19.5512","0.0003","103.233","0.0007","90.1735","0.0007","94.5532","0.0007","2732.42","0.08","180","","180","2","","","","","","","?","8","P -1","-P 1","2","","","","- C108 H76 B2 Cl4 F40 Li2 N2 O16 -","- C108 H76 B2 Cl4 F40 Li2 N2 O16 -","- C108 H76 B2 Cl4 F40 Li2 N2 O16 -","1","0.5","","Pascu, Sofia I.; Jarrosson, Thibaut; Naumann, Christoph; Otto, Sijbren; Kaiser, Guido; Sanders, Jeremy K. M.","Cation-reinforced donor-acceptor pseudorotaxanes","New Journal of Chemistry","2005","29","1","80","","10.1039/b415418e","","","0.71073","MoKα","","0.0682","0.0452","","0.0666","0.0562","0.0562","","","","","","1.094","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052454","7.566","0.001","10.3074","0.0014","15.598","0.002","72.355","0.002","88.102","0.002","81.429","0.002","1146.2","0.3","150","2","150","2","","","","","","","?","5","P -1","-P 1","2","","","","- C38 H56 I2 Li2 O14 -","- C38 H56 I2 Li2 O14 -","- C38 H56 I2 Li2 O14 -","1","0.5","","Pascu, Sofia I.; Jarrosson, Thibaut; Naumann, Christoph; Otto, Sijbren; Kaiser, Guido; Sanders, Jeremy K. M.","Cation-reinforced donor-acceptor pseudorotaxanes","New Journal of Chemistry","2005","29","1","80","","10.1039/b415418e","","","0.6923","synchrotron","","0.036","0.0342","","0.0435","0.0367","0.0367","","","","","","0.9607","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052455","10.8071","0.0002","11.2503","0.0002","18.3062","0.0003","78.4706","0.0008","81.8524","0.0007","86.3758","0.0012","2157.41","0.07","180","","180","","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C64 H78 Cl18 I2 N2 Na2 O14 -","- C64 H78 Cl18 I2 N2 Na2 O14 -","- C64 H78 Cl18 I2 N2 Na2 O14 -","1","0.5","","Pascu, Sofia I.; Jarrosson, Thibaut; Naumann, Christoph; Otto, Sijbren; Kaiser, Guido; Sanders, Jeremy K. M.","Cation-reinforced donor-acceptor pseudorotaxanes","New Journal of Chemistry","2005","29","1","80","","10.1039/b415418e","","","0.71073","MoKα","","0.0421","0.0344","","0.0461","0.0444","0.0444","","","","","","1.0757","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052456","38.511","0.0001","15.7246","0.0002","22.8791","0.0003","90","","93.64","0.0005","90","","13826.9","0.3","180","","180","","","","","","","","?","7","C 1 2/c 1","-C 2yc","15","","","","- C122 H96 B2 F48 N2 Na2 O14 -","- C122 H96 B2 F48 N2 Na2 O14 -","- C488 H384 B8 F192 N8 Na8 O56 -","4","0.5","","Pascu, Sofia I.; Jarrosson, Thibaut; Naumann, Christoph; Otto, Sijbren; Kaiser, Guido; Sanders, Jeremy K. M.","Cation-reinforced donor-acceptor pseudorotaxanes","New Journal of Chemistry","2005","29","1","80","","10.1039/b415418e","","","0.71073","MoKα","","0.242","0.158","","0.2243","0.1728","0.1728","","","","","","1.1708","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052457","8.6574","0.0017","18.3472","0.001","22.6283","0.0015","90","","90","","90","","3594.3","0.8","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H42 N4 O6 S3 -","- C36 H42 N4 O6 S3 -","- C144 H168 N16 O24 S12 -","4","1","","Ilioudis, Christos A.; Bearpark, Michael J.; Steed, Jonathan W.","Hydrogen bonds between ammonium ions and aromatic rings exist and have key consequences on solid-state and solution phase properties","New Journal of Chemistry","2005","29","1","64","","10.1039/b415532g","","","0.71073","MoKα","","0.212","0.1203","","","0.1668","0.1891","","","","","","1.113","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7052458","9.4427","0.0019","9.947","0.002","12.252","0.003","84.27","0.03","73.42","0.03","74.08","0.03","1060.3","0.5","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H31 Cl4 N4 O2 -","- C15 H31 Cl4 N4 O2 -","- C30 H62 Cl8 N8 O4 -","2","1","","Ilioudis, Christos A.; Bearpark, Michael J.; Steed, Jonathan W.","Hydrogen bonds between ammonium ions and aromatic rings exist and have key consequences on solid-state and solution phase properties","New Journal of Chemistry","2005","29","1","64","","10.1039/b415532g","","","0.71073","MoKα","","0.1053","0.0504","","","0.0922","0.11","","","","","","1.007","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052459","8.669","0.004","12.752","0.004","13.644","0.004","67.57","0.03","89.21","0.03","72.56","0.03","1321.4","0.9","301.2","","301.2","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H24 Cl N2 O7 Re Se -","- C25 H20 Cl N2 O7 Re Se -","- C50 H40 Cl2 N4 O14 Re2 Se2 -","2","1","","Wong, Keith Man-Chung; Li, Wei-Ping; Cheung, Kung-Kai; Yam, Vivian Wing-Wah","Synthesis, photophysics, electrochemistry and metal ion-binding studies of rhenium(i) complexes with crown ether pendants: selective and specific binding properties for various metal ions","New Journal of Chemistry","2005","29","1","165","","10.1039/b415951a","","","0.7107","MoKalpha","","","0.0264","","","0.0319","","","","","1.496","1.496","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052460","8.6509","0.0012","12.618","0.002","14","0.003","107.936","0.01","99.633","0.006","90.21","0.007","1430.9","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C24.5 H20 Ag4 N4 O9.5 -","- C24.5 H20 Ag4 N4 O9.5 -","- C49 H40 Ag8 N8 O19 -","2","1","","Liu, Zheng; Liu, Ping; Chen, Yun; Wang, Jian; Huang, Meihua","Synthesis, structures, and photoluminescent properties of two ligand unsupported silver(i) coordination polymers from isonicotinate anions","New Journal of Chemistry","2005","29","3","474","","10.1039/b417363e","","","0.71073","MoKα","","0.0519","0.0373","","","0.0829","0.0911","","","","","","1.066","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052461","11.1771","0.0002","19.1123","0.0001","14.0739","0.0002","90","","90.16","0.001","90","","3006.46","0.07","129.2","","129.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H52 O Yb -","- C30 H52 O Yb -","- C120 H208 O4 Yb4 -","4","1","","Schultz, Madeleine; Sofield, Chadwick D.; Walter, Marc D.; Andersen, Richard A.","Coordination complexes of bivalent ansa-ytterbocenes: synthesis, structure and comparison with related unbridged ytterbocenes and ansa-ferrocenes","New Journal of Chemistry","2005","29","7","919","","10.1039/b418550a","","","0.7107","MoKα","","0","0.0326","","0","0.0395","0.0395","","","","","","1.293","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052462","29.0586","0.0005","15.9398","0.0002","24.5206","0.0004","90","","90","","90","","11357.7","0.3","156.2","","156.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H56 O Si Yb -","- C35.285 H56 O Si Yb -","- C423.42 H672 O12 Si12 Yb12 -","12","3","","Schultz, Madeleine; Sofield, Chadwick D.; Walter, Marc D.; Andersen, Richard A.","Coordination complexes of bivalent ansa-ytterbocenes: synthesis, structure and comparison with related unbridged ytterbocenes and ansa-ferrocenes","New Journal of Chemistry","2005","29","7","919","","10.1039/b418550a","","","0.7107","MoKα","","0","0.0457","","0","0.0465","0.0465","","","","","","1.235","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052463","11.8426","0.0006","16.438","0.0009","22.338","0.001","90","","99.068","0.001","90","","4294.2","0.4","163.2","","163.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H64 N2 Si Yb -","- C44.455 N2 Si Yb -","- C177.82 N8 Si4 Yb4 -","4","1","","Schultz, Madeleine; Sofield, Chadwick D.; Walter, Marc D.; Andersen, Richard A.","Coordination complexes of bivalent ansa-ytterbocenes: synthesis, structure and comparison with related unbridged ytterbocenes and ansa-ferrocenes","New Journal of Chemistry","2005","29","7","919","","10.1039/b418550a","","","0.7107","MoKα","","0","0.0455","","0","0.0509","0.0509","","","","","","1.18","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052464","11.7197","0.0002","16.5509","0.0002","17.5383","0.0003","90","","90","","90","","3401.93","0.09","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","[Li{N(2,6-iPr2C6H3)C(H)N(2,6-iPr2C6H3)}(PMDETA)]","","","- C34 H58 Li N5 -","- C34 H58 Li N5 -","- C136 H232 Li4 N20 -","4","1","","Cole, Marcus L.; Davies, Aaron J.; Jones, Cameron; Junk, Peter C.","Bulky formamidinate complexes of lithium: the first examples of η2:η1-CN,N′ metal amidinate coordination","New Journal of Chemistry","2005","29","11","1404","","10.1039/b511519a","","x-ray","0.71073","MoKα","","0.1003","0.0514","","","0.0983","0.1114","","","","","","0.963","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052466","11.726","0.003","8.518","0.003","20.943","0.006","90","","91.31","0.02","90","","2091.3","1.1","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N'-diphenyl-3,6,9-trioxaundecanedicarboxamide","","- C20 H28 N2 O7 -","- C20 H28 N2 O7 -","- C80 H112 N8 O28 -","4","1","","Sylvie Meyer; Rémy Louis; Bernard Metz; Yvette Agnus; Alexandre Varnek; Maurice Gross","Unprecedented role of water in self-assembly of potential molecular tweezers","New J. Chem.","2000","24","6","371","376","10.1039/b001127o","","","1.54184","Cu-Kα","","0.034","0.034","","0.047","","0.047","","","1.439","","","1.485","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052467","12.587","0.006","14.127","0.005","11.423","0.006","92.14","0.04","112.82","0.04","111.2","0.03","1707.8","1.6","293.2","","293.2","","","","","","","","-","7","P -1","-P 1","2","","","","- C65 H58 Cl10 N2 O2 P4 Ru -","- C65 H56 Cl10 N2 O2 P4 Ru0.5 -","- C65 H56 Cl10 N2 O2 P4 Ru0.5 -","1","0.5","","Gaw, Kirsty G.; Smith, Martin B.; Slawin, Alexandra M. Z.","Molybdenum(0), ruthenium(II), palladium(II), platinum(II), copper(I) and gold(I) complexes of a new methoxy functionalised bis(phosphino)amine: synthesis and structure","New Journal of Chemistry","2000","24","6","429","","10.1039/b001458n","","","0.7107","MoKα","","0.0874","0.0874","","0.1186","","0.1186","","","6.086","","","6.086","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052468","11.8719","0.0015","7.8232","0.0012","12.9433","0.0016","90","","99.176","0.015","90","","1186.7","0.3","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H10 N2 O2 -","- C15 H10 N2 O2 -","- C60 H40 N8 O8 -","4","1","","Eastmond, Geoffrey C.; Gilchrist, Thomas L.; Paprotny, Jerzy; Steiner, Alexander","Cyano-activated fluoro displacement reactions in the synthesis of cyanophenoxazines and related compounds","New Journal of Chemistry","2001","25","3","385","","10.1039/b008503k","","","0.71073","MoKα","","0.1212","0.1113","","","0.2915","0.2972","","","","","","1.131","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052469","27.732","0.006","7.833","0.002","19.416","0.004","90","","106.8","0.03","90","","4037.6","1.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H7 N O2 -","- C13 H7 N O2 -","- C208 H112 N16 O32 -","16","2","","Eastmond, Geoffrey C.; Paprotny, Jerzy; Steiner, Alexander; Swanson, Linda","Synthesis of cyanodibenzo[1,4]dioxines and their derivatives by cyano-activated fluoro displacement reactions","New Journal of Chemistry","2001","25","3","379","","10.1039/b008508l","","","0.71073","MoKα","","0.1394","0.0464","","","0.0927","0.1124","","","","","","0.661","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052470","10.6409","0.0015","5.9763","0.0007","16.382","0.002","90","","102.504","0.017","90","","1017.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 F N O4 -","- C12 H6 F N O4 -","- C48 H24 F4 N4 O16 -","4","1","","Eastmond, Geoffrey C.; Paprotny, Jerzy; Steiner, Alexander; Swanson, Linda","Synthesis of cyanodibenzo[1,4]dioxines and their derivatives by cyano-activated fluoro displacement reactions","New Journal of Chemistry","2001","25","3","379","","10.1039/b008508l","","","0.71073","MoKα","","0.051","0.0373","","","0.102","0.1089","","","","","","1.021","","","","has coordinates,has disorder","180078","2020-10-21","18:00:00",""
"7052471","9.2675","0.0003","8.1573","0.0003","13.8649","0.0005","90","","102.968","0.001","90","","1021.42","0.06","130","1","130","1","","","","","","","","4","P 1 21 1","P 2yb","4","","7,7-di(S(+)-2-(methoxy)pyrrolidino)-8,8-dicyanoquinodimethane","","- C22 H28 N4 O2 -","- C22 H28 N4 O2 -","- C44 H56 N8 O4 -","2","1","","Srinivasa Gopalan, R.; Kulkarni, Giridhar U.; Ravi, M.; Rao, C. N. R.","A charge density study of an intramolecular charge-transfer quinoid compound with strong NLO properties","New Journal of Chemistry","2001","25","9","1108","","10.1039/b103117c","","","0.71073","MoKα","","0.2382","0.1383","","0.2175","0.1803","","","","1.632","1.835","1.835","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052472","6.923","0.002","17.925","0.003","8.08","0.003","90","","104.39","0.01","90","","971.2","0.5","295","2","295","2","","","","","","","","3","I2/m","","","","perfluoronaphthalene phenanthrene complex (1:1)","","- C24 H10 F8 -","","","2","","","Collings, Jonathan C.; Roscoe, Karl P.; Thomas, Rhodri Ll.; Batsanov, Andrei S.; Stimson, Lorna M.; Howard, Judith A. K.; Marder, Todd B.","Arene-perfluoroarene interactions in crystal engineering. Part 3. Single-crystal structures of 1 : 1 complexes of octafluoronaphthalene with fused-ring polyaromatic hydrocarbons","New Journal of Chemistry","2001","25","11","1410","1417","10.1039/b105502j","","","0.71073","MoKα","","","","","","","","","","","","","","","","","","219075","2020-10-21","18:00:00",""
"7052473","22.9235","0.0007","9.9309","0.0005","12.8363","0.0007","90","0.01","101.078","0.003","90","0.01","2867.7","0.2","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H38 N4 O2 -","- C33 H38 N4 O2 -","- C132 H152 N16 O8 -","4","1","","Baouid, Abdesselam; Elhazazi, Saïd; Hasnaoui, Aïssa; Compain, Philippe; Lavergne, Jean-Pierre; Huet, François","Highly peri-, regio- and diastereoselective 1,3-dipolar cycloaddition of mesitonitrile oxide to 1,7-dimethyl-2,3-dihydro-1H-1,4-diazepines: unexpected one-step formation of a new triheterocyclic framework","New Journal of Chemistry","2001","25","12","1479","1481","10.1039/B107409C","","","0.71073","MoKα","","","0.073","","","","0.083","","","","","","1.575","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7052474","23.3956","0.0017","31.216","0.002","21.2594","0.0015","90","","107.908","0.002","90","","14773.9","1.8","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C156 H187 Mo2 N9 O10 -","- C156 H185.5 Mo2 N9 O10 -","- C624 H742 Mo8 N36 O40 -","4","1","","Gibson, Vernon C.; Redshaw, Carl; Elsegood, Mark R. J.","A novel ligand family based on bulky metallocalix[4 and 8]arene substituents","New Journal of Chemistry","2002","26","1","16","19","10.1039/b108088c","","","0.6878","synchrotron","","0.1227","0.067","","","0.1624","0.1869","","","","","","0.953","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7052475","7.9346","0.0004","18.6728","0.0009","13.9672","0.0007","90","","104.485","0.003","90","","2003.62","0.17","80","2","80","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H27 Au Cl4 O8 -","- C10 H27 Au Cl4 O8 -","- C40 H108 Au4 Cl16 O32 -","4","1","","Calleja, Maria; Mason, Sax A.; Paul D. Prince; Steed, Jonathan W.; Wilkinson, Clive","Single crystal neutron and X-ray diffraction studies of (H7O3)[AuCl4]·15-crown-5","New Journal of Chemistry","2001","25","12","1475","1478","10.1039/B108935H","","neutron","1.2316","neutron","","0.0508","0.0381","","","0.0804","0.0851","","","","","","1.078","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7052476","7.9441","0.0007","18.6964","0.0016","13.9886","0.001","90","","104.347","0.003","90","","2012.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H27 Au Cl4 O8 -","- C10 H27 Au Cl4 O8 -","- C40 H108 Au4 Cl16 O32 -","4","1","","Calleja, Maria; Mason, Sax A.; Paul D. Prince; Steed, Jonathan W.; Wilkinson, Clive","Single crystal neutron and X-ray diffraction studies of (H7O3)[AuCl4]·15-crown-5","New Journal of Chemistry","2001","25","12","1475","1478","10.1039/B108935H","","","0.71073","MoKα","","0.0462","0.0358","","","0.0789","0.083","","","","","","1.107","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7052477","10.376","0.003","17.697","0.002","14.647","0.003","90","","109.23","0.02","90","","2539.5","1","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tropolonate, 2,6-diaminopyridinium, hydrate","","- C24 H30 N6 O6 -","- C12 H15 N3 O3 -","- C96 H120 N24 O24 -","8","2","","Bertolasi, Valerio; Pretto, Loretta; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone","Hydrogen-bonded supramolecular structures in co-crystals of ??- or ??-diketone enols with 2,6-diaminopyridine or 2,4-diaminopyrimidine","New Journal of Chemistry","2002","26","11","1559","","10.1039/b205705k","","","0.71073","MoKα","","0.0967","0.0495","","","0.1183","0.1325","","","","","","1.048","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7052478","28.1286","0.0005","12.0327","0.0002","16.7257","0.0003","90","","91.701","0.001","90","","5658.54","0.17","120","2","120","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C28 H30 N4 O4 S2 Zn -","- C28 H30 N4 O4 S2 Zn -","- C224 H240 N32 O32 S16 Zn8 -","8","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0331","0.0269","","","0.0665","0.071","","","","","","1.033","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052479","9.9115","0.0007","17.0894","0.0011","7.2934","0.0006","90","","99.177","0.004","90","","1219.56","0.15","100","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Cu N4 O4 S2 -","- C26 H26 Cu N4 O4 S2 -","- C52 H52 Cu2 N8 O8 S4 -","2","0.5","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0342","0.0313","","","0.1152","0.1197","","","","","","1.026","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052480","9.0349","0.0011","10.2869","0.0014","20.698","0.003","90","","91.706","0.005","90","","1922.8","0.4","100","2","100","2","","","","","","","","7","P 1 c 1","P -2yc","7","","","","- C14 H12 Cu F6 N4 O4 S2 -","- C14 Cu F6 N4 O4 S2 -","- C56 Cu4 F24 N16 O16 S8 -","4","2","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.1521","0.1409","","","0.3597","0.368","","","","","","1.197","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052481","10.4495","0.0003","14.0233","0.0004","15.1965","0.0004","90","","106.221","0.001","90","","2138.19","0.1","105","2","105","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Cu F6 N4 O4 S2 -","- C16 H16 Cu F6 N4 O4 S2 -","- C64 H64 Cu4 F24 N16 O16 S8 -","4","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0468","0.0345","","","0.0817","0.0874","","","","","","1.041","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052482","26.6725","0.0009","14.5387","0.0004","14.9797","0.0005","90","","102.051","0.001","90","","5680.9","0.3","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H31 Cu N4 O4.5 S2 -","- C28 H31 Cu N4 O4.5 S2 -","- C224 H248 Cu8 N32 O36 S16 -","8","2","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.1437","0.0732","","","0.1597","0.1856","","","","","","1.08","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052483","7.3347","0.0003","17.0575","0.0006","9.822","0.0003","90","","99.139","0.001","90","","1213.25","0.08","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 N4 Ni O4 S2 -","- C26 H26 N4 Ni O4 S2 -","- C52 H52 N8 Ni2 O8 S4 -","2","0.5","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0802","0.0699","","","0.2024","0.2108","","","","","","1.087","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052484","10.4583","0.0014","16.052","0.002","29.546","0.004","90","","90","","90","","4960.1","1.1","100","2","100","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C18 H24 F6 N4 Ni O6 S2 -","- C18 H24 F6 N4 Ni O6 S2 -","- C144 H192 F48 N32 Ni8 O48 S16 -","8","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.074","0.0619","","","0.1589","0.1676","","","","","","1.066","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052485","7.9362","0.0003","9.4498","0.0003","14.7162","0.0005","80.519","0.001","80.609","0.001","81.548","0.001","1065.77","0.06","105","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H16 F6 N4 Ni O4 S2 -","- C16 H16 F6 N4 Ni O4 S2 -","- C32 H32 F12 N8 Ni2 O8 S4 -","2","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0378","0.0336","","","0.0933","0.096","","","","","","1.039","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052486","32.016","0.011","11.932","0.004","16.782","0.008","90","","118.86","0.02","90","","5615","4","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H30 N4 Ni O4 S2 -","- C28 H30 N4 Ni O4 S2 -","- C224 H240 N32 Ni8 O32 S16 -","8","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0639","0.0435","","","0.118","0.1288","","","","","","1.052","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052487","29.967","0.006","7.9772","0.0015","26.183","0.005","90","","121.349","0.005","90","","5345.4","1.8","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H26.26 Co N4 O4.16 S2 -","- C26 H26 Co N4 O4.13 S2 -","- C208 H208 Co8 N32 O33.04 S16 -","8","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0667","0.0373","","","0.09","0.1151","","","","","","1.109","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052488","8.2696","0.0003","9.8013","0.0003","13.0497","0.0004","93.015","0.001","95.599","0.001","108.418","0.001","994.84","0.06","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H12 Co F6 N4 O4 S2 -","- C14 H12 Co F6 N4 O4 S2 -","- C28 H24 Co2 F12 N8 O8 S4 -","2","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0448","0.0369","","","0.0947","0.0991","","","","","","1.05","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052489","7.9999","0.0002","9.3718","0.0003","14.7362","0.0005","82.625","0.001","81.527","0.001","81.726","0.001","1074.89","0.06","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H16 Co F6 N4 O4 S2 -","- C16 H16 Co F6 N4 O4 S2 -","- C32 H32 Co2 F12 N8 O8 S4 -","2","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0457","0.0359","","","0.0925","0.098","","","","","","1.031","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052490","32.449","0.0009","12.0653","0.0004","16.738","0.0005","90","","119.721","0.001","90","","5691","0.3","110","2","110","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H30 Co N4 O4 S2 -","- C28 H30 Co N4 O4 S2 -","- C224 H240 Co8 N32 O32 S16 -","8","1","","Congreve, Aileen; Kataky, Ritu; Knell, Mark; Parker, David; Puschmann, Horst; Senanayake, Kanthi; Wylie, Lisa","Examination of cobalt, nickel, copper and zinc(ii) complex geometry and binding affinity in aqueous media using simple pyridylsulfonamide ligands","New Journal of Chemistry","2003","27","1","98","106","10.1039/b206279h","","","0.71073","MoKα","","0.0512","0.0382","","","0.1171","0.122","","","","","","1.106","","","","has coordinates","274641","2022-04-22","16:38:21",""
"7052491","11.0102","0.0002","11.3676","0.0002","13.6847","0.0003","76.117","0.005","82.625","0.005","65.319","0.005","1510.07","0.08","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C74 H58 Cu N14 O6 -","- C74 H58 Cu0.5 N14 O6 -","- C74 H58 Cu0.5 N14 O6 -","1","0.5","","Bertrand Zimmer; Marie Hutin; Véronique Bulach; Mir Wais Hosseini; André De Cian; Nathalie Kyritsakas","Coordination polymers based on porphyrin and copper: the influence of the crystallization solvents on the dimensionality of the network","New Journal of Chemistry","2002","26","11","1532","1535","10.1039/B206661K","","","0.71073","Mo-Kα","","0.107","0.044","","7.231","","0.063","","","1.8","","","1.03","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7052492","12.8117","0.0002","13.0953","0.0002","13.5473","0.0003","104.664","0.005","111.913","0.005","104.738","0.005","1879.56","0.16","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C73 H51 Cl15 N12 O4 -","- C73 H40 Cl15 N12 O4 -","- C73 H40 Cl15 N12 O4 -","1","0.5","","Bertrand Zimmer; Marie Hutin; Véronique Bulach; Mir Wais Hosseini; André De Cian; Nathalie Kyritsakas","Coordination polymers based on porphyrin and copper: the influence of the crystallization solvents on the dimensionality of the network","New Journal of Chemistry","2002","26","11","1532","1535","10.1039/B206661K","","","0.71073","Mo-Kα","","0.128","0.069","","0.178","","0.083","","","2.427","","","1.072","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052493","9.9533","0.0002","13.2375","0.0004","13.3971","0.0003","88.813","0.005","69.005","0.005","88.363","0.004","1647.2","0.09","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C72 H66 Cu N12 O11 -","- C72 H44 Cu0.5 N12 O11 -","- C72 H44 Cu0.5 N12 O11 -","1","0.5","","Bertrand Zimmer; Marie Hutin; Véronique Bulach; Mir Wais Hosseini; André De Cian; Nathalie Kyritsakas","Coordination polymers based on porphyrin and copper: the influence of the crystallization solvents on the dimensionality of the network","New Journal of Chemistry","2002","26","11","1532","1535","10.1039/B206661K","","","0.71073","Mo-Kα","","0.094","0.054","","0.179","","0.068","","","2.789","","","1.027","","","","has coordinates","180078","2020-10-21","18:00:00",""
"7052494","7.1084","0.0006","7.4863","0.0006","11.923","0.001","99.788","0.004","107.055","0.003","98.477","0.004","584.51","0.09","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H11 Br N2 O -","- C12 H11 Br N2 O -","- C24 H22 Br2 N4 O2 -","2","1","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.5608","AgKα","","0.0504","0.05","","0.058","","0.058","","","1.465","","","1.46","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052495","7.0475","0.001","7.438","0.003","20.763","0.004","90","","90","","90","","1088.4","0.5","296.2","","296.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H10 F N2 O -","- C12 H10 F N2 O -","- C48 H40 F4 N8 O4 -","4","0.5","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.7107","MoKα","","0.087","0.087","","0.071","","0.071","","","2.097","","","2.1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052496","7.531","0.001","12.236","0.002","7.154","0.001","106.27","0.01","100.1","1","74.9","0.01","607.2","1.3","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H11 I N2 O -","- C12 H11 I N2 O -","- C24 H22 I2 N4 O2 -","2","1","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.5608","AgKα","","0.0403","0.04","","0.054","","0.054","","","1.477","","","1.48","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052497","7.1729","0.0005","14.506","0.002","11.384","0.001","90","","106.972","0.006","90","","1132.9","0.2","296.2","","296.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 N2 O -","- C13 H14 N2 O -","- C52 H56 N8 O4 -","4","1","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.5608","AgKα","","0.0698","0.07","","0.066","","0.066","","","2.008","","","2","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052498","7.126","0.006","7.635","0.001","11.337","0.002","102.33","0.01","103.28","0.05","96.74","0.05","577.4","0.5","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N3 O3 -","- C12 H11 N3 O3 -","- C24 H22 N6 O6 -","2","1","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.7107","MoKα","","0.057","0.057","","0.056","","0.056","","","2.727","","","2.73","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052499","21.324","0.004","7.2771","0.0009","16.929","0.007","90","","111.81","0.03","90","","2439","1.3","296.2","","296.2","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C104 H112 N16 O16 -","8","1","","George, Sumod; Nangia, Ashwini; Bagieu-Beucher, Muriel; Masse, René; Nicoud, Jean-François","Crystal engineering of two-dimensional polar layer structures: hydrogen bond networks in some N-meta-phenylpyrimidinones","New Journal of Chemistry","2003","27","3","568","","10.1039/b207090a","","","0.7107","MoKα","","0.0604","0.06","","0.055","","0.055","","","2.003","","","2","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052500","10.42","0.002","15.207","0.003","19.435","0.004","106.31","0.03","101.79","0.03","99.4","0.03","2812.4","1.2","301","2","301","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H81 Cl2 N O P4 Pt2 -","- C46 Cl2 N O P4 Pt2 -","- C92 Cl4 N2 O2 P8 Pt4 -","2","1","","Tao, Chi-Hang; Wong, Keith Man-Chung; Zhu, Nianyong; Yam, Vivian Wing-Wah","Versatile precursors for multinuclear platinum(ii) alkynyl assembly—synthesis, structural characterization and electrochemical studies of luminescent platinum(ii) alkynyl complexes","New Journal of Chemistry","2003","27","1","150","","10.1039/b210772b","","","0.71073","MoKα","","0.0943","0.0536","","","0.1318","0.1452","","","","","","0.889","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7052501","9.8986","0.0002","31.4972","0.0004","10.9253","0.0004","90","","95.29","0.001","90","","3391.76","0.15","293","2","293","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C18 H36 Cl2 N2 O17 P4 Pb3 -","- C18 H26 Cl2 N2 O17 P4 Pb3 -","- C72 H104 Cl8 N8 O68 P16 Pb12 -","4","0.5","","Sun, Zhong-Ming; Mao, Jiang-Gao; Sun, Yan-Qiong; Zeng, Hui-Yi; Clearfield, Abraham","Hydrothermal synthesis, characterization and crystal structures of two new layered lead(ii) diphosphonates","New Journal of Chemistry","2003","27","9","1326","","10.1039/b302240b","","","0.71073","MoKα","","0.0623","0.0548","","","0.1519","0.1616","","","","","","1.073","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052502","9.0167","0.0006","10.6153","0.0008","14.1165","0.0012","80.777","0.003","72.91","0.005","89.329","0.004","1273.91","0.17","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H44 Co2 O8 P4 -","- C56 H44 Co2 O8 P4 -","- C56 H44 Co2 O8 P4 -","1","0.5","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.1118","0.0535","","","0.0951","0.1162","","","","","","0.996","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052503","7.9541","0.0006","8.0955","0.0006","12.4315","0.0012","86.127","0.005","85.621","0.004","77.462","0.005","778.05","0.11","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H18 Co4 O14 -","- C28 H18 Co4 O14 -","- C28 H18 Co4 O14 -","1","0.5","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0638","0.0473","","","0.1192","0.1288","","","","","","1.128","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052504","13.084","0.0015","18.5298","0.0019","10.169","0.0013","90","","97.236","0.009","90","","2445.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H28 Cl Fe N4 O8 -","- C22 H28 Cl Fe N4 O8 -","- C88 H112 Cl4 Fe4 N16 O32 -","4","0.5","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.1013","0.0715","","","0.2035","0.2358","","","","","","0.909","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052508","7.472","0.0005","8.9926","0.0006","17.5962","0.0014","90","","90","","90","","1182.34","0.15","250","2","250","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0334","0.0294","","","0.0817","0.0861","","","","","","1.069","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052509","7.4858","0.0004","9.0041","0.0005","17.6597","0.001","90","","90","","90","","1190.31","0.11","300","2","300","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0375","0.0325","","","0.0867","0.0912","","","","","","1.116","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052510","7.4904","0.0006","9.0176","0.0007","17.7254","0.0016","90","","90","","90","","1197.27","0.17","350","2","350","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0413","0.0348","","","0.0955","0.1017","","","","","","1.126","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052511","7.1111","0.0012","7.8561","0.0013","9.031","0.0016","75.614","0.003","68.57","0.004","76.107","0.004","448.63","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H9 Co N O7 -","- C7 H5 Co N O7 -","- C14 H10 Co2 N2 O14 -","2","1","","Zhou, You-Fu; Yuan, Da-Qiang; Wu, Ben-Lai; Wang, Rui-Hu; Hong, Mao-Chun","Design of metal-organic NLO materials: complexes derived from pyridine-3,4-dicarboxylate","New Journal of Chemistry","2004","28","12","1590","","10.1039/b401802h","","","0.71073","MoKα","","0.118","0.0889","","","0.2229","0.2615","","","","","","1.022","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052512","14.5462","0.0002","8.8913","0.0002","12.2784","0.0003","90","","97.01","0.001","90","","1576.15","0.06","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","caesium hexa-chloro-monocarbadodecaborane","","","- C H6 B11 Cl6 Cs -","- C H6 B11 Cl6 Cs -","- C4 H24 B44 Cl24 Cs4 -","4","1","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.71073","MoKα","","0.0413","0.0377","","","0.0983","0.1019","","","","","","1.086","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052513","17.802","0.004","14.255","0.004","12.199","0.003","90","","129.34","0.01","90","","2394.2","1.1","173","0.1","173","0.1","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C23 H29 Cl N2 O10 -","- C23 H29 Cl N2 O10 -","- C92 H116 Cl4 N8 O40 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","0.71073","MoKα","","0.0582","0.042","","","0.115","0.1208","","","","","","1.182","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7052514","17.804","0.001","14.131","0.001","12.317","0.001","90","","129.003","0.003","90","","2408.1","0.3","173","0.1","173","0.1","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C23 H29 Cl N2 O10 -","- C23 H29 Cl N2 O10 -","- C92 H116 Cl4 N8 O40 -","4","1","","Kiviniemi, Sari; Nissinen, Maija; Lämsä, Markku T.; Jalonen, Jorma; Rissanen, Kari; Pursiainen, Jouni","Complexation of planar, organic, five-membered cations with crown ethers","New Journal of Chemistry","2000","24","1","47","52","10.1039/a907608e","","","0.71073","MoKα","","0.1318","0.0887","","","0.2289","0.2535","","","","","","1.124","","","","has coordinates","210947","2020-10-21","18:00:00",""
"7052515","11.88","0.0009","15.0636","0.0012","20.7172","0.0017","93.716","0.002","93.872","0.002","107.226","0.002","3519.1","0.5","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C77 H66 Al N O8 Si6 -","- C77 H66 Al N O8 Si6 -","- C154 H132 Al2 N2 O16 Si12 -","2","1","","Gun'ko, Yurii K.; Reilly, Roisin; Kessler, Vadim G.","A convenient route to anionic and cyclic aluminosiloxanes: crystal structures of [PyH][Al{OSiPh2(OSiPh2)2O}2] and the first twelve-membered organic aluminosilicate Al2Si4O6 ring","New Journal of Chemistry","2001","25","4","528","530","10.1039/b009556g","","","0.71073","MoKα","","0.115","0.054","","","0.1125","0.1284","","","","","","0.925","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052516","14.275","0.004","16.322","0.004","16.56","0.004","90","","113.911","0.006","90","","3527.3","1.6","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H64 Al2 Cl2 O7 Si4 -","- C64 Al2 Cl2 O10 Si4 -","- C128 Al4 Cl4 O20 Si8 -","2","0.5","","Gun'ko, Yurii K.; Reilly, Roisin; Kessler, Vadim G.","A convenient route to anionic and cyclic aluminosiloxanes: crystal structures of [PyH][Al{OSiPh2(OSiPh2)2O}2] and the first twelve-membered organic aluminosilicate Al2Si4O6 ring","New Journal of Chemistry","2001","25","4","528","","10.1039/b009556g","","","0.71073","MoKα","","0.1696","0.0782","","","0.1792","0.2024","","","","","","1.151","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052517","26.559","0.003","6.373","0.001","8.079","0.001","90","","90","","90","","1367.5","0.3","569.4","","569.4","","","","","","","","","4","P n m a","-P 2ac 2n","62","(1,2-dihydro-N-tolyl-4,6-dimethylpyrimidin-2-ones) HNO3 salt","","","- C13 H15 N3 O4 -","- C8.5 H12.5 N1.5 O2 -","- C34 H50 N6 O8 -","4","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0644","0.064","","0.061","","0.061","","","3.835","","","3.83","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7052518","26.88","0.003","6.348","0.001","8.102","0.001","90","","90","","90","","1382.5","0.3","296.2","","296.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H12 Cl N3 O4 -","- C12 H12 Cl N3 O4 -","- C48 H48 Cl4 N12 O16 -","4","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0593","0.059","","0.063","","0.063","","","2.895","","","2.9","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052519","6.801","0.001","12.199","0.001","7.327","0.001","90","","90","","90","","607.89","0.13","296.2","","296.2","","","","","","","","Local laboratory","5","P m n 21","P 2ac -2","31","","","","- C12 H13 Cl N2 O -","- C12 H13 Cl N2 O -","- C24 H26 Cl2 N4 O2 -","2","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0398","0.04","","0.052","","0.052","","","2.008","","","2.01","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7052520","7.3047","0.0007","6.7669","0.0006","13.444","0.002","90","","105.59","0.01","90","","640.09","0.13","296.2","","296.2","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C13 H15 Cl N2 O -","- C13 H15 Cl N2 O -","- C26 H30 Cl2 N4 O2 -","2","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0365","0.037","","0.043","","0.043","","","3.015","","","3.02","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052521","7.313","0.001","6.668","0.002","13.644","0.002","90","","105.23","0.01","90","","642","0.2","296.2","","296.2","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C12 H12 Cl2 N2 O -","- C8 H10 Cl N O0.5 -","- C16 H20 Cl2 N2 O -","2","0.5","","","Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics","New Journal of Chemistry","2001","25","12","1520","","10.1039/b104646m","","","0.7107","MoKα","","0.0384","0.038","","0.041","","0.041","","","2.693","","","2.69","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052522","6.1482","0.0001","9.4605","0.0002","17.0184","0.0003","90","","96.5058","0.0009","90","","983.5","0.03","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","trans-[PtCl2{NH=C(Et)ON=C(Me)C(Me)(=O)}2]","","","- C14 H24 Cl2 N4 O4 Pt -","- C14 H24 Cl2 N4 O4 Pt -","- C28 H48 Cl4 N8 O8 Pt2 -","2","0.5","","Makarycheva-Mikhailova, Anastassiya V.; Haukka, Matti; Bokach, Nadezhda A.; Garnovskii, Dmitrii A.; Galanski, Markus; Keppler, Bernhard K.; Pombeiro, Armando J. L.; Kukushkin, Vadim Yu.","Platinum(iv)-mediated coupling of dione monoximes and nitriles: a novel reactivity pattern of the classic oxime-based chelating ligands","New Journal of Chemistry","2002","26","8","1085","","10.1039/b202947b","","","0.71073","MoKα","","0.0195","0.016","","","0.0386","0.0406","","","","","","1.148","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052523","14.2645","0.0007","14.2645","0.0007","18.4532","0.0009","90","","90","","90","","3754.8","0.3","173","2","173","2","","","","","","","","5","P -4 2 c","P -4 2c","112","","","","- C72 H96 Br N O22 -","- C72 H74 Br N O22 -","- C144 H148 Br2 N2 O44 -","2","0.25","","Mansikkamäki, Heidi; Nissinen, Maija; Schalley, Christoph A.; Rissanen, Kari","Self-assembling resorcinarene capsules: solid and gas phase studies on encapsulation of small alkyl ammonium cations","New Journal of Chemistry","2003","27","1","88","","10.1039/b207875a","","","0.71073","MoKα","","0.1313","0.0878","","","0.2231","0.2541","","","","","","1.068","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052524","27.441","0.0004","27.4283","0.0006","26.075","0.0005","90","","121.702","0.002","90","","16697.3","0.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C82 H118.25 Cl N O23 -","- C82 H116 Cl N O22 -","- C656 H928 Cl8 N8 O176 -","8","1","","Mansikkamäki, Heidi; Nissinen, Maija; Schalley, Christoph A.; Rissanen, Kari","Self-assembling resorcinarene capsules: solid and gas phase studies on encapsulation of small alkyl ammonium cations","New Journal of Chemistry","2003","27","1","88","","10.1039/b207875a","","","0.71073","MoKα","","0.2264","0.092","","","0.2069","0.2682","","","","","","1.039","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052525","14.223","0.0007","14.223","0.0007","21.5472","0.0015","90","","90","","90","","4358.9","0.4","173","2","173","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C84 H124 Br N O24 -","- C84.04 H112 Br N O24 -","- C168.08 H224 Br2 N2 O48 -","2","0.125","","Mansikkamäki, Heidi; Nissinen, Maija; Schalley, Christoph A.; Rissanen, Kari","Self-assembling resorcinarene capsules: solid and gas phase studies on encapsulation of small alkyl ammonium cations","New Journal of Chemistry","2003","27","1","88","","10.1039/b207875a","","","0.71073","MoKα","","0.1353","0.0939","","","0.2666","0.2958","","","","","","1.101","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052526","22.496","0.0004","13.7567","0.0003","27.7823","0.0006","90","","100.656","0.001","90","","8449.5","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C88 H124 Cl N O20 -","- C88 H124 Cl N O20 -","- C352 H496 Cl4 N4 O80 -","4","0.5","","Mansikkamäki, Heidi; Nissinen, Maija; Schalley, Christoph A.; Rissanen, Kari","Self-assembling resorcinarene capsules: solid and gas phase studies on encapsulation of small alkyl ammonium cations","New Journal of Chemistry","2003","27","1","88","","10.1039/b207875a","","","0.71073","MoKα","","0.1696","0.0729","","","0.1906","0.2506","","","","","","0.998","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052527","13.3702","0.0004","13.7036","0.0004","14.4145","0.0007","106.713","0.0015","90.5037","0.0015","117.936","0.0019","2202.33","0.15","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C92 H132 Cl N O20 -","- C92 H120 Cl N O20 -","- C92 H120 Cl N O20 -","1","0.5","","Mansikkamäki, Heidi; Nissinen, Maija; Schalley, Christoph A.; Rissanen, Kari","Self-assembling resorcinarene capsules: solid and gas phase studies on encapsulation of small alkyl ammonium cations","New Journal of Chemistry","2003","27","1","88","","10.1039/b207875a","","","0.71069","MoKα","","0.1679","0.0794","","","0.1998","0.2491","","","","","","1.021","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052528","13.3833","0.0002","13.7536","0.0002","14.4512","0.0003","106.68","0.0005","91.0839","0.0005","117.222","0.0005","2230.35","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C92 H132 Br N O20 -","- C92 H120 Br N O20 -","- C92 H120 Br N O20 -","1","0.5","","Mansikkamäki, Heidi; Nissinen, Maija; Schalley, Christoph A.; Rissanen, Kari","Self-assembling resorcinarene capsules: solid and gas phase studies on encapsulation of small alkyl ammonium cations","New Journal of Chemistry","2003","27","1","88","","10.1039/b207875a","","","0.71069","MoKα","","0.1071","0.0653","","","0.168","0.1974","","","","","","1.027","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052529","13.2301","0.0002","13.5456","0.0003","14.779","0.0004","105.801","0.0006","90.7846","0.0007","118.409","0.001","2209.22","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H131 Br N O20.5 -","- C90 H112 Br N O20.5 -","- C90 H112 Br N O20.5 -","1","0.5","","Mansikkamäki, Heidi; Nissinen, Maija; Schalley, Christoph A.; Rissanen, Kari","Self-assembling resorcinarene capsules: solid and gas phase studies on encapsulation of small alkyl ammonium cations","New Journal of Chemistry","2003","27","1","88","","10.1039/b207875a","","","0.71069","MoKα","","0.1224","0.0722","","","0.1758","0.2059","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052530","14.5103","0.0002","28.8821","0.0004","10.2616","0.0001","90","","92.184","0.004","90","","4297.39","0.09","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","2,4-di-tert-butyl-6-((1-hydroxy-cyclohexylmethylimino)- methyl)-phenol","2,4-di-tert-butyl-6-[(1-hydroxy-cyclohexylmethylimino)-methyl]-phenol","","- C22 H35 N O2 -","- C22 H35 N O2 -","- C176 H280 N8 O16 -","8","2","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.1297","0.0634","","","0.1604","0.191","","","","","","1.02","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052531","9.027","0.0018","6.23","0.0012","22.198","0.004","90","","90","","90","","1248.4","0.4","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","2-(((1-hydroxycyclohexyl)methylimino)methyl) phenol","2-{[(1-hydroxycyclohexyl)methylimino]methyl} phenol","","- C14 H19 N O2 -","- C14 H19 N O2 -","- C56 H76 N4 O8 -","4","1","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.0869","0.0532","","","0.1095","0.1413","","","","","","1.165","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052532","10.0724","0.0002","8.267","0.0017","11.7803","0.0002","90","","111.75","0.03","90","","911.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(1-(2-hydroxyethylimino)ethyl)phenol","2-[1-(2-hydroxyethylimino)ethyl]phenol","","- C10 H13 N O2 -","- C10 H13 N O2 -","- C40 H52 N4 O8 -","4","1","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.0531","0.035","","","0.0951","0.1049","","","","","","1.047","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052533","10.2518","0.0002","10.4845","0.0002","19.6987","0.0004","95.9376","0.0007","104.155","0.0008","92.2975","0.0008","2037.31","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","2,4-ditertbutyl-6-((2-hydroxymethylphenylimino)methyl) phenol","2,4-ditertbutyl-6-[(2-hydroxymethylphenylimino)methyl] phenol","","- C22 H29 N O2 -","- C22 H29.0005 N O2.0005 -","- C88 H116.002 N4 O8.002 -","4","2","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.1378","0.0719","","","0.1864","0.2251","","","","","","1.033","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052534","9.5103","0.0002","12.8864","0.0004","15.2106","0.0004","97.8703","0.0011","107.113","0.001","100.48","0.0014","1715.51","0.08","293","2","293","2","","","","","","","synthesis as described","5","P -1","-P 1","2","2-((4-Chloro-2-hydroxymethyl-phenylimino)-methyl)-5- diethylamino-phenol","2-[(4-Chloro-2-hydroxymethyl-phenylimino)-methyl]-5-diethylamino-phenol","","- C18 H21 Cl N2 O2 -","- C18 H21 Cl N2 O2 -","- C72 H84 Cl4 N8 O8 -","4","2","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.1352","0.0858","","","0.238","0.2786","","","","","","1.092","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052535","6.1478","0.0002","7.5477","0.0002","36.0798","0.0001","90","","90","","90","","1674.17","0.07","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(1R,2S)-2-((2-hydroxy-1,2-diphenyl-ethylimino)-methyl)-phenol","(1R,2S)-2-[(2-hydroxy-1,2-diphenyl-ethylimino)-methyl]-phenol","","- C21 H19 N O2 -","- C21 H19 N O2 -","- C84 H76 N4 O8 -","4","1","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.094","0.0499","","","0.1158","0.1488","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052536","6.1083","0.0002","10.3445","0.0004","12.3439","0.0005","93.254","0.002","100.417","0.002","92.94","0.002","764.38","0.05","293","2","293","2","","","","","","","","4","P 1","P 1","1","2-(((1S,2R)-1-hydroxy-1-phenylpropan-2-ylimino)methyl)-4- nitrophenol","2-[{(1S,2R)-1-hydroxy-1-phenylpropan-2-ylimino}methyl]-4-nitrophenol","","- C16 H16 N2 O4 -","- C16 H16 N2 O4 -","- C32 H32 N4 O8 -","2","2","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.0886","0.0613","","","0.1613","0.1787","","","","","","1.012","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052537","7.2044","0.0002","9.3402","0.0002","12.3377","0.0003","69.1986","0.001","80.3396","0.0009","75.9081","0.0009","749.7","0.03","293","2","293","2","","","","","","","synthesis as described","5","P 1","P 1","1","2-(((1S,2R)-1-hydroxy-1-phenylpropan-2-ylimino)methyl)-4- bromophenol","2-[{(1S,2R)-1-hydroxy-1-phenylpropan-2-ylimino}methyl]-4-bromophenol","","- C16 H16 Br N O2 -","- C16 H16 Br N O2 -","- C32 H32 Br2 N2 O4 -","2","2","","Domínguez, Oscar; Rodríguez-Molina, Braulio; Rodríguez, Mario; Ariza, Armando; Farfán, Norberto; Santillan, Rosa","X-Ray crystallographic and spectroscopic properties of eight Schiff bases as evidence of the proton transfer reaction. Role of the intermolecular hydrogen bond","New Journal of Chemistry","2011","35","1","156","","10.1039/c0nj00179a","","x-ray","0.71073","MoKα","","0.0557","0.0432","","","0.108","0.1158","","","","","","1.06","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052538","12.5495","0.0004","24.3646","0.0007","13.2411","0.0004","90","","108.412","0.001","90","","3841.4","0.2","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C71 H124 B4 Li2 N4 Nd2 O6 -","- C71 H124 B4 Li2 N4 Nd2 O6 -","- C142 H248 B8 Li4 N8 Nd4 O12 -","2","0.5","","Sinenkov, Mikhail A.; Fukin, Georgy K.; Cherkasov, Anton V.; Ajellal, Noureddine; Roisnel, Thierry; Kerton, Francesca M.; Carpentier, Jean-François; Trifonov, Alexander A.","Neodymium borohydride complexes supported by diamino-bis(phenoxide) ligands: diversity of synthetic and structural chemistry, and catalytic activity in ring-opening polymerization of cyclic esters","New Journal of Chemistry","2011","35","1","204","","10.1039/c0nj00486c","","","0.71073","MoKα","","0.0451","0.0292","","","0.0622","0.0662","","","","","","1","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052539","15.0652","0.0008","18.92","0.001","26.4699","0.0015","90","","92.549","0.001","90","","7537.3","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C74 H122 Li N4 Nd O4 -","- C74 H122 Li N4 Nd O4 -","- C296 H488 Li4 N16 Nd4 O16 -","4","1","","Sinenkov, Mikhail A.; Fukin, Georgy K.; Cherkasov, Anton V.; Ajellal, Noureddine; Roisnel, Thierry; Kerton, Francesca M.; Carpentier, Jean-François; Trifonov, Alexander A.","Neodymium borohydride complexes supported by diamino-bis(phenoxide) ligands: diversity of synthetic and structural chemistry, and catalytic activity in ring-opening polymerization of cyclic esters","New Journal of Chemistry","2011","35","1","204","","10.1039/c0nj00486c","","","0.71073","MoKα","","0.1127","0.0717","","","0.1863","0.2125","","","","","","1.069","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052540","9.744","0.005","14.106","0.005","15.815","0.005","73.379","0.005","80.941","0.005","85.697","0.005","2055.9","1.4","100","2","100","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C38 H62 B2 Li N2 Nd O4 -","- C38 H62 B2 Li N2 Nd O4 -","- C76 H124 B4 Li2 N4 Nd2 O8 -","2","1","","Sinenkov, Mikhail A.; Fukin, Georgy K.; Cherkasov, Anton V.; Ajellal, Noureddine; Roisnel, Thierry; Kerton, Francesca M.; Carpentier, Jean-François; Trifonov, Alexander A.","Neodymium borohydride complexes supported by diamino-bis(phenoxide) ligands: diversity of synthetic and structural chemistry, and catalytic activity in ring-opening polymerization of cyclic esters","New Journal of Chemistry","2011","35","1","204","","10.1039/c0nj00486c","","x-ray","0.71073","MoKα","","0.0334","0.0283","","","0.067","0.0708","","","","","","1.06","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052541","9.248","0.0004","11.408","0.0007","11.721","0.0008","76.248","0.003","71.031","0.004","78.739","0.003","1126.49","0.12","120","1","120","1","","","","","","","","7","P -1","-P 1","2","Compound X","","","- C40 H58 Cl2 O6 P2 Pd Si2 -","- C40 H58 Cl2 O6 P2 Pd Si2 -","- C40 H58 Cl2 O6 P2 Pd Si2 -","1","0.5","","Linares, Noemi; Sepúlveda, Angel E.; Pacheco, María C.; Berenguer, Jesús R.; Lalinde, Elena; Nájera, Carmen; Garcia-Martinez, Javier","Synthesis of mesoporous metal complex-silica materials and their use as solvent-free catalysts","New Journal of Chemistry","2011","35","1","225","","10.1039/c0nj00509f","","","0.71073","MoKα","","0.0538","0.0378","","","0.078","0.0839","","","","","","1.013","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052542","9.4118","0.0019","18.517","0.004","11.063","0.002","90","","93.02","0.03","90","","1925.4","0.7","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H42 Cl6 N4 Ni2 -","- C38 H42 Cl6 N4 Ni2 -","- C76 H84 Cl12 N8 Ni4 -","2","0.5","","Yu, Jiangang; Hu, Xinquan; Zeng, Yanning; Zhang, Liping; Ni, Caihua; Hao, Xiang; Sun, Wen-Hua","Synthesis, characterisation and ethylene oligomerization behaviour of N-(2-substituted-5,6,7-trihydroquinolin-8-ylidene)arylaminonickel dichlorides","New Journal of Chemistry","2011","35","1","178","","10.1039/c0nj00516a","","","0.71073","MoKα","","","0.0845","","","0.1972","0.2036","","","","","","1.347","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052543","11.597","0.002","17.402","0.004","12.326","0.003","90","","99.83","0.03","90","","2451","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H31 Cl3 N2 Ni O -","- C23 H31 Cl3 N2 Ni O -","- C92 H124 Cl12 N8 Ni4 O4 -","4","1","","Yu, Jiangang; Hu, Xinquan; Zeng, Yanning; Zhang, Liping; Ni, Caihua; Hao, Xiang; Sun, Wen-Hua","Synthesis, characterisation and ethylene oligomerization behaviour of N-(2-substituted-5,6,7-trihydroquinolin-8-ylidene)arylaminonickel dichlorides","New Journal of Chemistry","2011","35","1","178","","10.1039/c0nj00516a","","","0.71073","MoKα","","","0.1587","","","0.3174","0.333","","","","","","1.412","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052544","15.896","0.003","16.77","0.003","18.79","0.004","90","","90","","90","","5009","1.7","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C27 H30 Cl2 N2 Ni -","- C27 H30 Cl2 N2 Ni -","- C216 H240 Cl16 N16 Ni8 -","8","1","","Yu, Jiangang; Hu, Xinquan; Zeng, Yanning; Zhang, Liping; Ni, Caihua; Hao, Xiang; Sun, Wen-Hua","Synthesis, characterisation and ethylene oligomerization behaviour of N-(2-substituted-5,6,7-trihydroquinolin-8-ylidene)arylaminonickel dichlorides","New Journal of Chemistry","2011","35","1","178","","10.1039/c0nj00516a","","","0.71073","MoKα","","","0.1399","","","0.2849","0.2953","","","","","","1.463","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052545","31.488","0.006","10.033","0.002","15.549","0.003","90","","102.2","0.03","90","","4801.3","1.7","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 Cl2 N2 Ni -","- C26 H28 Cl2 N2 Ni -","- C208 H224 Cl16 N16 Ni8 -","8","1","","Yu, Jiangang; Hu, Xinquan; Zeng, Yanning; Zhang, Liping; Ni, Caihua; Hao, Xiang; Sun, Wen-Hua","Synthesis, characterisation and ethylene oligomerization behaviour of N-(2-substituted-5,6,7-trihydroquinolin-8-ylidene)arylaminonickel dichlorides","New Journal of Chemistry","2011","35","1","178","","10.1039/c0nj00516a","","","0.71073","MoKα","","","0.0908","","","0.157","0.1591","","","","","","1.377","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052546","10.302","0.002","11.513","0.003","11.737","0.002","66.37","0.03","64.29","0.04","87.93","0.03","1133","0.7","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H46 Br2 Cl6 N4 O8 Tb2 -","- C36 H46 Br2 Cl6 N4 O8 Tb2 -","- C36 H46 Br2 Cl6 N4 O8 Tb2 -","1","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.0377","0.0323","","","0.0804","0.0827","","","","","","1.084","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052547","10.201","0.002","11.683","0.003","11.701","0.002","64.8","0.03","64.79","0.04","86.63","0.03","1128.7","0.7","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H46 Br2 Cl6 Er2 N4 O8 -","- C36 H46 Br2 Cl6 Er2 N4 O8 -","- C36 H46 Br2 Cl6 Er2 N4 O8 -","1","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.0567","0.0399","","","0.093","0.1006","","","","","","1.013","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052548","12.326","0.003","23.037","0.005","7.3627","0.0015","90","","98.52","0.03","90","","2067.6","0.8","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H38 Br2 Cl6 Gd2 N4 O8 -","- C32 H38 Br2 Cl6 Gd2 N4 O8 -","- C64 H76 Br4 Cl12 Gd4 N8 O16 -","2","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.1024","0.077","","","0.1942","0.2085","","","","","","1.023","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052549","9.547","0.0019","11.51","0.002","11.745","0.002","64.26","0.03","67.15","0.04","85.79","0.03","1064.2","0.6","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H38 Br2 Cl6 N4 O8 Yb2 -","- C32 H38 Br2 Cl6 N4 O8 Yb2 -","- C32 H38 Br2 Cl6 N4 O8 Yb2 -","1","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.0872","0.0515","","","0.114","0.1318","","","","","","1.008","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052550","8.7927","0.0018","18.011","0.004","26.437","0.005","93.16","0.03","94.13","0.04","92.89","0.03","4163.3","1.5","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H26 Br2 Cl3 Eu N4 O7 -","- C29 H26 Br2 Cl3 Eu N4 O7 -","- C116 H104 Br8 Cl12 Eu4 N16 O28 -","4","2","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.173","0.0917","","","0.1697","0.1951","","","","","","1.009","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052551","7.8838","0.0016","14.174","0.003","16.683","0.003","98.85","0.03","99.52","0.04","99.55","0.03","1781.3","0.7","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H44 Br4 Cl6 Er2 N8 O17 -","- C56 H44 Br4 Cl6 Er2 N8 O17 -","- C56 H44 Br4 Cl6 Er2 N8 O17 -","1","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.0608","0.0491","","","0.1121","0.119","","","","","","1.175","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052552","8.0269","0.0016","14.719","0.003","16.14","0.003","97.7","0.03","94.74","0.04","104.75","0.03","1813.8","0.7","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H44 Br4 Cl6 N8 O17 Yb2 -","- C56 H44 Br4 Cl6 N8 O17 Yb2 -","- C56 H44 Br4 Cl6 N8 O17 Yb2 -","1","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.0495","0.0408","","","0.1046","0.1113","","","","","","1.043","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052553","17.803","0.004","22.524","0.005","16.122","0.003","90","","99.51","0.03","90","","6376","2","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H60 Br4 Cl3 N8 Nd O13 -","- C60 H60 Br4 Cl3 N8 Nd O13 -","- C240 H240 Br16 Cl12 N32 Nd4 O52 -","4","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.1221","0.0561","","","0.1046","0.127","","","","","","1.019","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052554","17.595","0.004","22.565","0.005","16.06","0.003","90","","99.41","0.03","90","","6291","2","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H60 Br4 Cl3 Gd N8 O13 -","- C60 H60 Br4 Cl3 Gd N8 O13 -","- C240 H240 Br16 Cl12 Gd4 N32 O52 -","4","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.0518","0.0338","","","0.0733","0.08","","","","","","1.018","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052555","17.72","0.004","22.332","0.005","16.13","0.003","90","","99.52","0.03","90","","6295","2","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C60 H60 Br4 Cl3 Eu N8 O13 -","- C60 H60 Br4 Cl3 Eu N8 O13 -","- C240 H240 Br16 Cl12 Eu4 N32 O52 -","4","0.5","","Yang, Xiaoping; Jones, Richard A.; Oye, Michael M.; Wiester, Michael; Lai, Rachel J.","Influence of metal‒ligand ratio on benzimidazole based luminescent lanthanide complexes: 3-D network structures and chloride anion binding","New Journal of Chemistry","2011","35","2","310","","10.1039/c0nj00518e","","","0.71073","MoKα","","0.0539","0.0355","","","0.0816","0.0881","","","","","","1.033","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052556","13.295","0.001","20.188","0.001","9.613","0.001","90","","120.191","0.006","90","","2230.1","0.3","293","2","293","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C20 H34 Cu4 Mo8 N12 O27 -","- C20 H32 Cu4 Mo8 N12 O27 -","- C40 H64 Cu8 Mo16 N24 O54 -","2","0.25","","Zhang, Chun-Jing; Pang, Hai-Jun; Tang, Qun; Wang, Hui-Yuan; Chen, Ya-Guang","Three 3D octamolybdate-based hybrids with 1D‒3D CuI/CuII-bis(triazole) motifs: influence of the amount of Et3N","New Journal of Chemistry","2011","35","1","190","","10.1039/c0nj00542h","","","0.71069","MoKα","","0.0542","0.032","","","0.0661","0.0681","","","","","","1.024","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052557","12.481","0.003","12.862","0.004","13.332","0.004","100.001","0.002","105.253","0.002","111.736","0.003","1828.1","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H64 Cu2 Mo8 N24 O26 -","- C40 H64 Cu2 Mo8 N24 O26 -","- C40 H64 Cu2 Mo8 N24 O26 -","1","0.5","","Zhang, Chun-Jing; Pang, Hai-Jun; Tang, Qun; Wang, Hui-Yuan; Chen, Ya-Guang","Three 3D octamolybdate-based hybrids with 1D‒3D CuI/CuII-bis(triazole) motifs: influence of the amount of Et3N","New Journal of Chemistry","2011","35","1","190","","10.1039/c0nj00542h","","","0.71069","MoKα","","0.0533","0.0326","","","0.066","0.0678","","","","","","0.96","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052558","10.85","0.001","12.843","0.001","14.74","0.001","112.112","0.005","100.83","0.004","98.902","0.004","1810.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H64 Cu4 Mo8 N24 O26 -","- C40 H64 Cu4 Mo8 N24 O26 -","- C40 H64 Cu4 Mo8 N24 O26 -","1","0.5","","Zhang, Chun-Jing; Pang, Hai-Jun; Tang, Qun; Wang, Hui-Yuan; Chen, Ya-Guang","Three 3D octamolybdate-based hybrids with 1D‒3D CuI/CuII-bis(triazole) motifs: influence of the amount of Et3N","New Journal of Chemistry","2011","35","1","190","","10.1039/c0nj00542h","","","0.71069","MoKα","","0.1646","0.0596","","","0.0774","0.0851","","","","","","1.028","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052559","11.724","0.002","12.829","0.002","11.745","0.002","90","","90","","90","","1766.5","0.5","293","2","293","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C6 H12 Cu I N2 -","- C6 H12 Cu I N2 -","- C48 H96 Cu8 I8 N16 -","8","","","Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Mazzeo, Paolo P.; Ventura, Barbara","Solid-state reactivity of copper(i) iodide: luminescent 2D-coordination polymers of CuI with saturated bidentate nitrogen bases","New Journal of Chemistry","2011","35","2","339","","10.1039/c0nj00547a","","","0.71073","MoKα","","0.0516","0.0395","","","0.1061","0.1112","","","","","","1.096","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052560","10.1972","0.0007","12.1811","0.0006","6.7879","0.0005","90","","120.25","0.01","90","","728.34","0.11","150","2","150","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C4 H10 Cu I N2 -","- C4 H10 Cu I N2 -","- C16 H40 Cu4 I4 N8 -","4","0.5","","Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Mazzeo, Paolo P.; Ventura, Barbara","Solid-state reactivity of copper(i) iodide: luminescent 2D-coordination polymers of CuI with saturated bidentate nitrogen bases","New Journal of Chemistry","2011","35","2","339","","10.1039/c0nj00547a","","","0.71073","MoKα","","0.0225","0.0202","","","0.0467","0.0473","","","","","","1.111","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052561","10.315","0.002","12.217","0.0001","6.859","0.001","90","","120.69","0.002","90","","743.3","0.18","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C4 H10 Cu I N2 -","- C4 H10 Cu I N2 -","- C16 H40 Cu4 I4 N8 -","4","0.5","","Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Mazzeo, Paolo P.; Ventura, Barbara","Solid-state reactivity of copper(i) iodide: luminescent 2D-coordination polymers of CuI with saturated bidentate nitrogen bases","New Journal of Chemistry","2011","35","2","339","","10.1039/c0nj00547a","","","0.71073","MoKα","","0.0246","0.0208","","","0.0492","0.0499","","","","","","0.987","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052562","25.726","0.002","28.737","0.003","9.0939","0.0008","90","","90","","90","","6723","1.1","298","2","298","2","","","","","","","","5","F d d 2","F 2 -2d","43","","","","- C16 H10 Br2 F4 S2 -","- C16 H10 Br2 F4 S2 -","- C256 H160 Br32 F64 S32 -","16","1","","Xia, Jian-Long; Zhang, Chan; Zhu, Xingxun; Ou, Yaping; Jin, Guo-Jun; Yu, Guang-ao; Liu, Sheng Hua","Substituted diethynyldithia[3.3]paracyclophanes—synthetically more accessible new building blocks for molecular scaffolding","New Journal of Chemistry","2011","35","1","97","","10.1039/c0nj00553c","","","0.71073","MoKα","","0.0955","0.0754","","","0.1728","0.1829","","","","","","0.963","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052563","15.8717","0.0003","9.4064","0.0002","17.3535","0.0004","90","","140.512","0.001","90","","1647.53","0.07","293","2","293","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","4-oxopimelic acid 4,4'-bipyridine","4-oxo-heptane-1,7-dioic acid 4,4'-bipyridine","","- C17 H18 N2 O5 -","- C17 H18 N2 O5 -","- C68 H72 N8 O20 -","4","1","","Halasz, Ivan; Rubčić, Mirta; Užarević, Krunoslav; Đilović, Ivica; Meštrović, Ernest","The cocrystal of 4-oxopimelic acid and 4,4′-bipyridine: polymorphism and solid-state transformations","New Journal of Chemistry","2011","35","1","24","","10.1039/c0nj00569j","","","0.71073","MoKα","","0.0589","0.0436","","","0.1112","0.1264","","","","","","1.044","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052564","7.583","0.003","8.752","0.002","24.527","0.006","90","","92.29","0.03","90","","1626.5","0.8","293","2","293","2","","","","","","","chemical synthesis","4","C 1 2/c 1","-C 2yc","15","4-oxo-heptane-1,7-dioic acid 4,4'-bipyridine","","","- C17 H18 N2 O5 -","- C17 H18 N2 O5 -","- C68 H72 N8 O20 -","4","0.5","","Halasz, Ivan; Rubčić, Mirta; Užarević, Krunoslav; Đilović, Ivica; Meštrović, Ernest","The cocrystal of 4-oxopimelic acid and 4,4′-bipyridine: polymorphism and solid-state transformations","New Journal of Chemistry","2011","35","1","24","","10.1039/c0nj00569j","","","0.71073","MoKα","","0.0735","0.0562","","","0.1566","0.1765","","","","","","1.084","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052565","11.4051","0.0003","19.155","0.0005","26.914","0.001","90","","90","","90","","5879.8","0.3","100","2","100","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C90 H8 Cl6 F24 -","- C90 H8 Cl6 F24 -","- C360 H32 Cl24 F96 -","4","0.5","","Goryunkov, Alexey A.; Samokhvalova, Nadezhda A.; Khavrel, Pavel A.; Belov, Nikita M.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Troyanov, Sergey I.","Regioselective near-equatorial chlorination of Cs-C70(CF3)8","New Journal of Chemistry","2011","35","1","32","","10.1039/c0nj00591f","","","0.905","synchrotron","","0.1015","0.0944","","","0.2129","0.2132","","","","","","1.135","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052566","11.5487","0.0007","16.1638","0.0009","16.4446","0.0011","113.729","0.002","92.529","0.002","95.793","0.002","2783.7","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","4.2ETPY","","","- C123 H135 N7 O20 -","- C123 H135 N7 O20 -","- C123 H135 N7 O20 -","1","0.5","","Kennedy, Stuart; Beavers, Christine M.; Teat, Simon J.; Dalgarno, Scott J.","Calixarene nanotubes: structural tolerance towards pyridine templates","New Journal of Chemistry","2011","35","1","28","","10.1039/c0nj00605j","","","0.71073","MoKα","","0.0647","0.048","","","0.1235","0.1348","","","","","","1.033","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052567","46.4651","0.0011","46.4651","0.0011","12.0334","0.0003","90","","90","","120","","22499.5","0.9","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","4.2Pic","","","- C43 H42 N O10 -","- C43 H42.01 N O10 -","- C774 H756.18 N18 O180 -","18","1","","Kennedy, Stuart; Beavers, Christine M.; Teat, Simon J.; Dalgarno, Scott J.","Calixarene nanotubes: structural tolerance towards pyridine templates","New Journal of Chemistry","2011","35","1","28","","10.1039/c0nj00605j","","","0.7749","synchrotron","","0.1219","0.1118","","","0.322","0.3288","","","","","","2.584","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052568","11.2763","0.0014","7.4688","0.0009","17.26","0.002","90","","103.039","0.003","90","","1416.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 N2 O2 -","- C16 H14 N2 O2 -","- C64 H56 N8 O8 -","4","1","","Adak, Laksmikanta; Bhadra, Sukalyan; Chattopadhyay, Kalicharan; Ranu, Brindaban C.","Amphiphilic allylation of activated alkenes by allyl acetates and allylstannanes catalyzed by palladium nanoparticles: an easy access to stereodefined substituted cyclohexene derivatives","New Journal of Chemistry","2011","35","2","430","","10.1039/c0nj00624f","","","0.71073","MoKα","","0.0575","0.0394","","","0.1162","0.1326","","","","","","0.882","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052569","9.031","0.008","7.178","0.006","21.954","0.018","90","","93.07","0.02","90","","1421","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N2 O2 S -","- C14 H11 N2 O2 S -","- C56 H44 N8 O8 S4 -","4","1","","Adak, Laksmikanta; Bhadra, Sukalyan; Chattopadhyay, Kalicharan; Ranu, Brindaban C.","Amphiphilic allylation of activated alkenes by allyl acetates and allylstannanes catalyzed by palladium nanoparticles: an easy access to stereodefined substituted cyclohexene derivatives","New Journal of Chemistry","2011","35","2","430","","10.1039/c0nj00624f","","","0.71073","MoKα","","0.148","0.1208","","","0.3785","0.4144","","","","","","1.644","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052570","12.8437","0.0014","8.3562","0.0009","25.59","0.003","90","","90.944","0.002","90","","2746.1","0.5","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C10 H6 Ag F3 N4 O4 S -","- C10 H6 Ag F3 N4 O4 S -","- C80 H48 Ag8 F24 N32 O32 S8 -","8","2","","Wan, Chong-Qing; Mak, Thomas C. W.","Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts","New Journal of Chemistry","2011","35","2","319","","10.1039/c0nj00631a","","","0.71073","MoKα","","0.1157","0.0595","","","0.1542","0.1883","","","","","","1.054","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052571","9.7425","0.0009","20.2668","0.0019","8.0361","0.0008","90","","90","","90","","1586.7","0.3","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C8 H6 Ag3 N7 O8 S -","- C8 H6 Ag3 N7 O8 S -","- C32 H24 Ag12 N28 O32 S4 -","4","0.5","","Wan, Chong-Qing; Mak, Thomas C. W.","Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts","New Journal of Chemistry","2011","35","2","319","","10.1039/c0nj00631a","","","0.71073","MoKα","","0.0631","0.0472","","","0.1317","0.144","","","","","","1.061","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052572","7.8459","0.0008","11.2785","0.0012","14.4645","0.0015","90","","90","","90","","1280","0.2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C8 H6 Ag Cl N4 O6 S -","- C8 H6 Ag Cl N4 O6 S -","- C32 H24 Ag4 Cl4 N16 O24 S4 -","4","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts","New Journal of Chemistry","2011","35","2","319","","10.1039/c0nj00631a","","","0.71073","MoKα","","0.0405","0.0344","","","0.0887","0.0927","","","","","","1.074","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052573","12.178","0.005","8.01","0.003","14.622","0.006","90","","90","","90","","1426.3","1","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C9 H6 Ag F3 N4 O5 S2 -","- C9 H6 Ag F3 N4 O5 S2 -","- C36 H24 Ag4 F12 N16 O20 S8 -","4","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts","New Journal of Chemistry","2011","35","2","319","","10.1039/c0nj00631a","","","0.71073","MoKα","","0.1024","0.0585","","","0.1341","0.1655","","","","","","1.065","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052574","7.7095","0.0012","10.914","0.0017","14.571","0.002","90","","90","","90","","1226","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C8 H6 Ag N5 O5 S -","- C8 H6 Ag N5 O5 S -","- C32 H24 Ag4 N20 O20 S4 -","4","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts","New Journal of Chemistry","2011","35","2","319","","10.1039/c0nj00631a","","","0.71073","MoKα","","0.0498","0.0368","","","0.0807","0.0872","","","","","","1.024","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052575","5.7845","0.001","7.2446","0.0013","22.243","0.004","90","","92.951","0.004","90","","930.9","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H6 N4 O2 S -","- C8 H6 N4 O2 S -","- C32 H24 N16 O8 S4 -","4","1","","Wan, Chong-Qing; Mak, Thomas C. W.","Supramolecular frameworks constructed from angular-shaped sulfonyldipyrazine and various silver(i) salts","New Journal of Chemistry","2011","35","2","319","","10.1039/c0nj00631a","","","0.71073","MoKα","","0.0595","0.0436","","","0.11","0.1197","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052576","15.7241","0.0009","29.528","0.0018","11.3464","0.0007","90","","90.798","0.001","90","","5267.6","0.5","153","2","153","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","catena-Poly[[tetrakis(hexamethylphosphoramide-κO)bis(nitrato- κ^2^O,O')ytterbium(III)] [silver(I)-di-μ-sulfido-tungstate(VI)(Ag—W)-di-μ-sulfido]]","","- C24 H72 Ag N14 O10 P4 S4 W Yb -","- C24 H72 Ag N14 O10 P4 S4 W Yb -","- C96 H288 Ag4 N56 O40 P16 S16 W4 Yb4 -","4","1","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Yang, Junyi; Wei, Hongyang; Huang, Wenjiang; Cifuentes, Marie P.; Humphrey, Mark G.; Zhang, Chi","Syntheses and NLO properties of 1D heterothiometallic anionic W/S/Ag clusters possessing solvento-ytterbium cation-directed isomeric skeletons","New Journal of Chemistry","2011","35","2","328","","10.1039/c0nj00674b","","","0.7107","MoKα","","0.0354","0.0325","","","0.0674","0.0686","","","","","","1.179","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052577","15.409","0.003","18.605","0.004","18.404","0.004","90","","102.37","0.03","90","","5154","2","153","2","153","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C30 H90 Ag6 O15 S39 W6 Yb2 -","- C30 H78 Ag6 O15 S39 W6 Yb2 -","- C60 H156 Ag12 O30 S78 W12 Yb4 -","2","1","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Yang, Junyi; Wei, Hongyang; Huang, Wenjiang; Cifuentes, Marie P.; Humphrey, Mark G.; Zhang, Chi","Syntheses and NLO properties of 1D heterothiometallic anionic W/S/Ag clusters possessing solvento-ytterbium cation-directed isomeric skeletons","New Journal of Chemistry","2011","35","2","328","","10.1039/c0nj00674b","","","0.71073","MoKα","","0.0258","0.0249","","","0.0452","0.0456","","","","","","0.957","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052578","12.873","0.003","27.479","0.005","19.866","0.006","90","","126.04","0.02","90","","5682","3","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C24 H56 Ag3 N8 O8 S12 W3 Yb -","- C24 H38 Ag3 N8 O8 S12 W3 Yb -","- C96 H152 Ag12 N32 O32 S48 W12 Yb4 -","4","1","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Yang, Junyi; Wei, Hongyang; Huang, Wenjiang; Cifuentes, Marie P.; Humphrey, Mark G.; Zhang, Chi","Syntheses and NLO properties of 1D heterothiometallic anionic W/S/Ag clusters possessing solvento-ytterbium cation-directed isomeric skeletons","New Journal of Chemistry","2011","35","2","328","","10.1039/c0nj00674b","","","0.71073","MoKα","","0.182","0.0661","","","0.1678","0.219","","","","","","1.058","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052579","15.7241","0.0009","29.528","0.0018","11.3464","0.0007","90","","90.798","0.001","90","","5267.6","0.5","153","2","153","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C24 H72 Ag N14 O10 P4 S4 W Yb -","- C24 H72 Ag N14 O10 P4 S4 W Yb -","- C96 H288 Ag4 N56 O40 P16 S16 W4 Yb4 -","4","1","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Yang, Junyi; Wei, Hongyang; Huang, Wenjiang; Cifuentes, Marie P.; Humphrey, Mark G.; Zhang, Chi","Syntheses and NLO properties of 1D heterothiometallic anionic W/S/Ag clusters possessing solvento-ytterbium cation-directed isomeric skeletons","New Journal of Chemistry","2011","35","2","328","","10.1039/c0nj00674b","","","0.7107","MoKα","","0.0338","0.0308","","","0.0613","0.0624","","","","","","1.195","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052580","8.1091","0.0004","10.3382","0.0005","12.6053","0.0006","70.963","0.001","81.468","0.001","73.538","0.001","956.18","0.08","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H12 Ag N5 O5 -","- C22 H12 Ag N5 O5 -","- C44 H24 Ag2 N10 O10 -","2","1","","Massoud, Alshima'a A.; Gohar, Yousry M.; Langer, Vratislav; Lincoln, Per; Svensson, Frida R.; Jänis, Janne; Gårdebjer, Sofie T.; Haukka, Matti; Jonsson, Fabian; Aneheim, Emma; Löwenhielm, Peter; Abu-Youssef, Morsy A. M.; Öhrström, Lars R.","Bis 4,5-diazafluoren-9-one silver(i) nitrate: synthesis, X-ray structures, solution chemistry, hydrogel loading, DNA coupling and anti-bacterial screening","New Journal of Chemistry","2011","35","3","640","","10.1039/c0nj00697a","","","0.71073","MoKα","","0.0485","0.0327","","","0.0767","0.0822","","","","","","1.013","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052581","7.4881","0.001","11.3498","0.0015","13.2259","0.0017","65.156","0.003","88.861","0.003","85.58","0.003","1016.9","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H14 Ag N5 O6 -","- C22 H14 Ag N5 O6 -","- C44 H28 Ag2 N10 O12 -","2","1","","Massoud, Alshima'a A.; Gohar, Yousry M.; Langer, Vratislav; Lincoln, Per; Svensson, Frida R.; Jänis, Janne; Gårdebjer, Sofie T.; Haukka, Matti; Jonsson, Fabian; Aneheim, Emma; Löwenhielm, Peter; Abu-Youssef, Morsy A. M.; Öhrström, Lars R.","Bis 4,5-diazafluoren-9-one silver(i) nitrate: synthesis, X-ray structures, solution chemistry, hydrogel loading, DNA coupling and anti-bacterial screening","New Journal of Chemistry","2011","35","3","640","","10.1039/c0nj00697a","","","0.71073","MoKα","","0.0729","0.0434","","","0.1018","0.1156","","","","","","0.999","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052582","7.856","0.002","7.767","0.002","17.596","0.006","90","","95.93","0.02","90","","1067.9","0.5","302","2","302","2","","","","","","","","4","P 1 21 1","P 2yb","4","E,E-1-(2-(4-nitrophenyl)ethenyl)-4-(2-(3,4,5- trimethoxyphenyl)ethenyl)benzene","E,E-1-[2-(4-nitrophenyl)ethenyl]-4-[2-(3,4,5-trimethoxyphenyl)ethenyl]benzene","","- C25 H23 N O5 -","- C25 H23 N O5 -","- C50 H46 N2 O10 -","2","1","","Collas, Alain; Borger, Roeland De; Amanova, Tatyana; Vande Velde, Christophe M. L.; Baeke, Jan K.; Dommisse, Roger; Alsenoy, Christian Van; Blockhuys, Frank","Asymmetrically substituted distyrylbenzenes and their polar crystal structures","New Journal of Chemistry","2011","35","3","649","","10.1039/c0nj00732c","","","0.71073","MoKα","","0.1057","0.0449","","","0.1091","0.1356","","","","","","1.047","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052583","10.221","0.002","15.239","0.003","15.762","0.004","117.42","0.02","92.26","0.02","93.52","0.02","2168.8","0.9","300","2","300","2","","","","","","","","4","P -1","-P 1","2","(E,E)-1-(2-(4-nitrophenyl)ethenyl)-4-(2-(3,4,5- trimethoxyphenyl)ethenyl)benzene","(E,E)-1-[2-(4-nitrophenyl)ethenyl]-4-[2-(3,4,5-trimethoxyphenyl)ethenyl]benzene","","- C25 H23 N O5 -","- C25 H23 N O5 -","- C100 H92 N4 O20 -","4","2","","Collas, Alain; Borger, Roeland De; Amanova, Tatyana; Vande Velde, Christophe M. L.; Baeke, Jan K.; Dommisse, Roger; Alsenoy, Christian Van; Blockhuys, Frank","Asymmetrically substituted distyrylbenzenes and their polar crystal structures","New Journal of Chemistry","2011","35","3","649","","10.1039/c0nj00732c","","","0.71073","MoKα","","0.1854","0.061","","","0.1414","0.1858","","","","","","0.978","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052584","7.219","0.002","7.402","0.002","18.163","0.005","90","","95.29","0.03","90","","966.4","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","(E,E)-1-(2-(4-nitrophenyl)ethenyl)-4-(2-(3,5- dimethoxyphenyl)ethenyl)benzene","(E,E)-1-[2-(4-nitrophenyl)ethenyl]-4-[2-(3,5-dimethoxyphenyl)ethenyl]benzene","","- C24 H21 N O4 -","- C24 H21 N O4 -","- C48 H42 N2 O8 -","2","1","","Collas, Alain; Borger, Roeland De; Amanova, Tatyana; Vande Velde, Christophe M. L.; Baeke, Jan K.; Dommisse, Roger; Alsenoy, Christian Van; Blockhuys, Frank","Asymmetrically substituted distyrylbenzenes and their polar crystal structures","New Journal of Chemistry","2011","35","3","649","","10.1039/c0nj00732c","","","0.71073","MoKα","","0.0875","0.0594","","","0.1419","0.1752","","","","","","1.133","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052585","10.203","0.003","12.411","0.002","18.442","0.002","74.35","0.01","82.49","0.03","70.76","0.03","2120.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","(E,E)-1-(2-(4-cyanophenyl)ethenyl)-4-(2-(2,4,6- trimethoxyphenyl)ethenyl)benzene","(E,E)-1-[2-(4-cyanophenyl)ethenyl]-4-[2-(2,4,6-trimethoxyphenyl)ethenyl]benzene","","- C26 H23 N O3 -","- C26 H23 N O3 -","- C104 H92 N4 O12 -","4","2","","Collas, Alain; Borger, Roeland De; Amanova, Tatyana; Vande Velde, Christophe M. L.; Baeke, Jan K.; Dommisse, Roger; Alsenoy, Christian Van; Blockhuys, Frank","Asymmetrically substituted distyrylbenzenes and their polar crystal structures","New Journal of Chemistry","2011","35","3","649","","10.1039/c0nj00732c","","","0.71073","MoKα","","0.1643","0.0661","","","0.1632","0.2033","","","","","","1.004","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052586","19.3122","0.0004","16.5116","0.0003","25.1186","0.0005","90","","90","","90","","8009.7","0.3","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","(E,E)-((diethyl-2,2'-(1,2- phenylenebis(iminomethylidyne))bis(3-oxo-3-phenyl-propanato)(2-)- N,N',O$3!,O$3!')(1,3-bis(4-pyridyl) propane)iron(ii)","(E,E)-[{diethyl-2,2'-[1,2-phenylenebis(iminomethylidyne)]bis[3-oxo-3-phenyl- propanato](2-)-<i>N</i>,<i>N</i>',<i>O</i>^3^,<i>O</i>^3^'}(1,3-bis(4-pyridyl) propane)iron(II)","","- C43.54 H42.17 Fe N4 O6.54 -","- C43.542 H42.168 Fe N4 O6.542 -","- C348.336 H337.344 Fe8 N32 O52.336 -","8","1","","Pfaffeneder, Toni M.; Thallmair, Sebastian; Bauer, Wolfgang; Weber, Birgit","Complete and incomplete spin transitions in 1D chain iron(ii) compounds","New Journal of Chemistry","2011","35","3","691","","10.1039/c0nj00750a","","","0.71073","MoKα","","0.0664","0.0325","","","0.0701","0.0744","","","","","","0.841","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052587","10.353","0.0016","10.928","0.002","15.794","0.004","75.074","0.019","81.233","0.017","64.423","0.018","1555.7","0.6","250","2","250","2","","","","","","","","5","P -1","-P 1","2","(2,2')-(1,2-phenylenebis(iminomethylidyne)bis(1-phenylbutane- 1,3-dione) (2-)-N,N',O$3!,O$3!')(bis(1H-imidazol-1-yl) methane)iron(ii)","[2,2']-[1,2-phenylenebis(iminomethylidyne)bis(1-phenylbutane-1,3-dione) (2-)-<i>N</i>,<i>N</i>',<i>O</i>^3^,<i>O</i>^3^'](bis(1<i>H</i>-imidazol-1-yl) methane)iron(II)","","- C35 H30 Fe N6 O4 -","- C35 H30 Fe N6 O4 -","- C70 H60 Fe2 N12 O8 -","2","1","","Pfaffeneder, Toni M.; Thallmair, Sebastian; Bauer, Wolfgang; Weber, Birgit","Complete and incomplete spin transitions in 1D chain iron(ii) compounds","New Journal of Chemistry","2011","35","3","691","","10.1039/c0nj00750a","","","0.71073","MoKα","","0.0946","0.0484","","","0.11","0.1179","","","","","","0.96","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052588","10.3326","0.0016","10.8298","0.0017","15.673","0.003","74.763","0.014","80.991","0.014","64.329","0.015","1523.3","0.5","180","2","180","2","","","","","","","","5","P -1","-P 1","2","(2,2')-(1,2-phenylenebis(iminomethylidyne)bis(1-phenylbutane- 1,3-dione) (2-)-N,N',O$3!,O$3!')(bis(1H-imidazol-1-yl) methane)iron(ii)","[2,2']-[1,2-phenylenebis(iminomethylidyne)bis(1-phenylbutane-1,3-dione) (2-)-<i>N</i>,<i>N</i>',<i>O</i>^3^,<i>O</i>^3^'](bis(1<i>H</i>-imidazol-1-yl) methane)iron(II)","","- C35 H30 Fe N6 O4 -","- C35 H30 Fe N6 O4 -","- C70 H60 Fe2 N12 O8 -","2","1","","Pfaffeneder, Toni M.; Thallmair, Sebastian; Bauer, Wolfgang; Weber, Birgit","Complete and incomplete spin transitions in 1D chain iron(ii) compounds","New Journal of Chemistry","2011","35","3","691","","10.1039/c0nj00750a","","","0.71073","MoKα","","0.1025","0.0567","","","0.1159","0.1243","","","","","","1.002","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052589","10.4117","0.0014","10.5247","0.0012","15.4338","0.0018","74.913","0.01","79.006","0.011","64.091","0.013","1463","0.4","125","2","125","2","","","","","","","","5","P -1","-P 1","2","(2,2')-(1,2-phenylenebis(iminomethylidyne)bis(1-phenylbutane- 1,3-dione) (2-)-N,N',O$3!,O$3!')(bis(1H-imidazol-1-yl) methane)iron(ii)","[2,2']-[1,2-phenylenebis(iminomethylidyne)bis(1-phenylbutane-1,3-dione) (2-)-<i>N</i>,<i>N</i>',<i>O</i>^3^,<i>O</i>^3^'](bis(1<i>H</i>-imidazol-1-yl) methane)iron(II)","","- C35 H30 Fe N6 O4 -","- C35 H30 Fe N6 O4 -","- C70 H60 Fe2 N12 O8 -","2","1","","Pfaffeneder, Toni M.; Thallmair, Sebastian; Bauer, Wolfgang; Weber, Birgit","Complete and incomplete spin transitions in 1D chain iron(ii) compounds","New Journal of Chemistry","2011","35","3","691","","10.1039/c0nj00750a","","","0.71073","MoKα","","0.1183","0.0635","","","0.1366","0.1494","","","","","","1.025","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052590","8.1196","0.0002","16.2585","0.0005","19.1065","0.0005","90","","97.303","0.001","90","","2501.84","0.12","120","0.2","120","0.2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H54 Ca2 Cl4 N2 O30 -","- C34 H54 Ca2 Cl4 N2 O30 -","- C68 H108 Ca4 Cl8 N4 O60 -","2","0.5","","Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Basok, Stepan S.; Strelenko, Yuri A.; Alfimov, Michael V.; Howard, Judith A. K.","Controlled self-assembly of bis(crown)stilbenes into unusual bis-sandwich complexes: structure and stereoselective [2+2] photocycloaddition","New Journal of Chemistry","2011","35","3","724","","10.1039/c0nj00780c","","","0.71073","MoKα","","0.0378","0.0345","","","0.0898","0.094","","","","","","1.054","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052591","12.3927","0.001","13.7956","0.0011","14.7748","0.0012","104.967","0.004","108.561","0.004","105.014","0.004","2146.7","0.3","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H48 K N3 O17 -","- C42 H48 K N3 O17 -","- C84 H96 K2 N6 O34 -","2","1","","Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Basok, Stepan S.; Strelenko, Yuri A.; Alfimov, Michael V.; Howard, Judith A. K.","Controlled self-assembly of bis(crown)stilbenes into unusual bis-sandwich complexes: structure and stereoselective [2+2] photocycloaddition","New Journal of Chemistry","2011","35","3","724","","10.1039/c0nj00780c","","","0.71073","MoKα","","0.2583","0.1104","","","0.2224","0.269","","","","","","0.957","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052592","26.083","0.002","9.2443","0.0009","15.815","0.0013","90","","96.659","0.005","90","","3787.6","0.6","120","0.2","120","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H40 Cl2 Na2 O18 -","- C30 H40 Cl2 Na2 O18 -","- C120 H160 Cl8 Na8 O72 -","4","1","","Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Basok, Stepan S.; Strelenko, Yuri A.; Alfimov, Michael V.; Howard, Judith A. K.","Controlled self-assembly of bis(crown)stilbenes into unusual bis-sandwich complexes: structure and stereoselective [2+2] photocycloaddition","New Journal of Chemistry","2011","35","3","724","","10.1039/c0nj00780c","","","0.71073","MoKα","","0.4133","0.2426","","","0.3541","0.4098","","","","","","1.116","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052593","21.0741","0.0003","21.0741","0.0003","33.459","0.0006","90","","90","","120","","12868.9","0.3","100","2","100","2","","","","","","","","5","R 3 2 :H","R 3 2""","155","","","","- C53 H76 Cl2 N2 O20 -","- C52.96 H75.96 Cl1.66667 N2 O18.6667 -","- C476.64 H683.64 Cl15 N18 O168 -","9","0.5","","Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Basok, Stepan S.; Strelenko, Yuri A.; Alfimov, Michael V.; Howard, Judith A. K.","Controlled self-assembly of bis(crown)stilbenes into unusual bis-sandwich complexes: structure and stereoselective [2+2] photocycloaddition","New Journal of Chemistry","2011","35","3","724","","10.1039/c0nj00780c","","","1.54178","CuKα","","0.0647","0.0628","","","0.1753","0.179","","","","","","1.053","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052594","12.7413","0.0003","17.2121","0.0004","23.8339","0.0005","83.2","0.001","80.486","0.001","70.437","0.001","4846.22","0.19","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H56 Cs N3 O19 -","- C46 H56 Cs N3 O19 -","- C184 H224 Cs4 N12 O76 -","4","2","","Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Basok, Stepan S.; Strelenko, Yuri A.; Alfimov, Michael V.; Howard, Judith A. K.","Controlled self-assembly of bis(crown)stilbenes into unusual bis-sandwich complexes: structure and stereoselective [2+2] photocycloaddition","New Journal of Chemistry","2011","35","3","724","","10.1039/c0nj00780c","","","0.71073","MoKα","","0.1801","0.0808","","","0.2017","0.234","","","","","","0.933","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052595","14.4368","0.0008","17.929","0.0011","18.917","0.0011","78.74","0.003","84.002","0.003","87.88","0.003","4775.2","0.5","120","0.2","120","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H116 Ca2 Cl4 O45 -","- C78 H98 Ca2 Cl4 O45 -","- C156 H196 Ca4 Cl8 O90 -","2","1","","Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Basok, Stepan S.; Strelenko, Yuri A.; Alfimov, Michael V.; Howard, Judith A. K.","Controlled self-assembly of bis(crown)stilbenes into unusual bis-sandwich complexes: structure and stereoselective [2+2] photocycloaddition","New Journal of Chemistry","2011","35","3","724","","10.1039/c0nj00780c","","","0.71073","MoKα","","0.378","0.1145","","","0.232","0.2961","","","","","","0.877","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052596","13.9879","0.0009","26.9584","0.0019","21.0031","0.0015","90","","103.011","0.004","90","","7716.8","0.9","120","0.2","120","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C72 H100 Cl2 K2 O32 -","- C72 H92 Cl2 K2 O32 -","- C288 H368 Cl8 K8 O128 -","4","0.5","","Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Basok, Stepan S.; Strelenko, Yuri A.; Alfimov, Michael V.; Howard, Judith A. K.","Controlled self-assembly of bis(crown)stilbenes into unusual bis-sandwich complexes: structure and stereoselective [2+2] photocycloaddition","New Journal of Chemistry","2011","35","3","724","","10.1039/c0nj00780c","","","0.71073","MoKα","","0.2154","0.102","","","0.2778","0.311","","","","","","1.07","","","","has coordinates,has disorder","180079","2020-10-21","18:00:00",""
"7052597","11.751","0.003","12.885","0.003","13.632","0.003","114.123","0.003","100.136","0.004","97.33","0.004","1808.1","0.7","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H34 N10 O2 -","- C45 H34 N10 O2 -","- C90 H68 N20 O4 -","2","1","","Costa, Roshinee; Schick, Andrew J.; Paul, Nathan B.; Durfee, William S.; Ziegler, Christopher J.","Hydroxybenziphthalocyanines: non-aromatic phthalocyanine analogues that exhibit strong UV-visible absorptions","New Journal of Chemistry","2011","35","4","794","","10.1039/c0nj00500b","","","0.71073","MoKα","","0.0889","0.0639","","","0.1693","0.1871","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052598","7.6457","0.0016","9.891","0.002","15.431","0.003","97.881","0.003","101.751","0.003","93.578","0.003","1126.8","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H25.4 N6 O2.7 -","- C24 H24 N6 O2 -","- C48 H48 N12 O4 -","2","1","","Costa, Roshinee; Schick, Andrew J.; Paul, Nathan B.; Durfee, William S.; Ziegler, Christopher J.","Hydroxybenziphthalocyanines: non-aromatic phthalocyanine analogues that exhibit strong UV-visible absorptions","New Journal of Chemistry","2011","35","4","794","","10.1039/c0nj00500b","","","0.71073","MoKα","","0.0611","0.051","","","0.1443","0.1511","","","","","","1.095","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052599","15.039","0.007","12.809","0.006","14.218","0.006","90","","90","","90","","2739","2","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C32 H26 N8 O2 -","- C32 H26 N8 O2 -","- C128 H104 N32 O8 -","4","1","","Costa, Roshinee; Schick, Andrew J.; Paul, Nathan B.; Durfee, William S.; Ziegler, Christopher J.","Hydroxybenziphthalocyanines: non-aromatic phthalocyanine analogues that exhibit strong UV-visible absorptions","New Journal of Chemistry","2011","35","4","794","","10.1039/c0nj00500b","","","0.71073","MoKα","","0.069","0.0496","","","0.0992","0.108","","","","","","1.025","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052600","13.542","0.008","14.271","0.006","14.801","0.006","62.05","0.02","79.37","0.03","86.9","0.03","2482","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C91 H98 Cl2 Fe6 N2 O26 -","- C91 H96 Cl2 Fe6 N2 O26 -","- C91 H96 Cl2 Fe6 N2 O26 -","1","0.5","","Sañudo, E. C.; Font-Bardia, M.; Solans, X.; Laye, R. H.","Hexanuclear Fe(iii) complexes and their thermal decomposition into an undecanuclear species","New Journal of Chemistry","2011","35","4","842","","10.1039/c0nj00621a","","","0.71073","MoKα","","0.0804","0.0379","","","0.0737","0.082","","","","","","0.869","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052601","9.6137","0.0006","12.1476","0.0007","12.7323","0.0008","82.799","0.005","80.978","0.005","78.045","0.005","1430.02","0.15","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H58 Cl6 Fe6 N2 O26 -","- C32 H56 Cl6 Fe6 N2 O26 -","- C32 H56 Cl6 Fe6 N2 O26 -","1","0.5","","Sañudo, E. C.; Font-Bardia, M.; Solans, X.; Laye, R. H.","Hexanuclear Fe(iii) complexes and their thermal decomposition into an undecanuclear species","New Journal of Chemistry","2011","35","4","842","","10.1039/c0nj00621a","","","0.71073","MoKα","","0.0857","0.0417","","","0.0909","0.1073","","","","","","0.969","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052602","23.155","0.005","16.13","0.003","27.693","0.006","90","","92.01","0.03","90","","10337","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C85 H81 Cl15 Fe6 N2 O26 -","- C85 H79 Cl15 Fe6 N2 O26 -","- C340 H316 Cl60 Fe24 N8 O104 -","4","0.5","","Sañudo, E. C.; Font-Bardia, M.; Solans, X.; Laye, R. H.","Hexanuclear Fe(iii) complexes and their thermal decomposition into an undecanuclear species","New Journal of Chemistry","2011","35","4","842","","10.1039/c0nj00621a","","","0.71073","MoKα","","0.1233","0.0829","","","0.2224","0.2623","","","","","","1.099","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052603","27.8503","0.0009","27.8503","0.0009","31.8394","0.0013","90","","90","","120","","21387.3","1.3","296","0.1","296","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C126 H123 Cl12 Fe11 N0 O42 -","- C126 H117 Cl12 Fe11 O42 -","- C756 H702 Cl72 Fe66 O252 -","6","0.333333","","Sañudo, E. C.; Font-Bardia, M.; Solans, X.; Laye, R. H.","Hexanuclear Fe(iii) complexes and their thermal decomposition into an undecanuclear species","New Journal of Chemistry","2011","35","4","842","","10.1039/c0nj00621a","","","0.71073","MoKα","","0.1083","0.074","","","0.1912","0.2324","","","","","","1.071","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052604","9.339","0.008","15.689","0.014","12.461","0.011","90","","90","","90","","1826","3","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C15 H23 Br2 N2 O3.5 -","- C15 H20 Br2 N2 O2 -","- C60 H80 Br8 N8 O8 -","4","0.5","","Li, Xian-Mei; Fan, Fan; Lu, Jing-Song; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu; Lawrance, Geofferey A.; Wei, Gang","Host‒guest complexes of cucurbit[8]uril with some pentaerythritol derivative guests","New Journal of Chemistry","2011","35","5","1088","","10.1039/c0nj00752h","","","0.71073","MoKα","","0.055","0.0327","","","0.0772","0.082","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052605","13.284","0.003","9.1181","0.0018","11.576","0.002","90","","97.245","0.007","90","","1390.9","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 Br4 N -","- C10 H13 Br4 N -","- C40 H52 Br16 N4 -","4","1","","Li, Xian-Mei; Fan, Fan; Lu, Jing-Song; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu; Lawrance, Geofferey A.; Wei, Gang","Host‒guest complexes of cucurbit[8]uril with some pentaerythritol derivative guests","New Journal of Chemistry","2011","35","5","1088","","10.1039/c0nj00752h","","","0.71073","MoKα","","0.0744","0.0478","","","0.1155","0.1236","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052606","18.139","0.005","21.311","0.005","22.34","0.006","90","","90.915","0.003","90","","8635","4","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C66 H104 Br2 N34 O34 -","- C66 H72 Br2.0013 N34 O18 -","- C264 H288 Br8.0052 N136 O72 -","4","2","","Li, Xian-Mei; Fan, Fan; Lu, Jing-Song; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu; Lawrance, Geofferey A.; Wei, Gang","Host‒guest complexes of cucurbit[8]uril with some pentaerythritol derivative guests","New Journal of Chemistry","2011","35","5","1088","","10.1039/c0nj00752h","","","0.71073","MoKα","","0.077","0.0599","","","0.1571","0.1666","","","","","","1.055","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052607","25.514","0.004","27.351","0.004","12.6917","0.0018","90","","90","","90","","8857","2","223","2","223","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C58 H110.5 Br3.5 Cl N33 O40.5 -","- C58 H61 Br3.5 Cl1.0005 N33 O16.5 -","- C232 H244 Br14 Cl4.002 N132 O66 -","4","1","","Li, Xian-Mei; Fan, Fan; Lu, Jing-Song; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang; Tao, Zhu; Lawrance, Geofferey A.; Wei, Gang","Host‒guest complexes of cucurbit[8]uril with some pentaerythritol derivative guests","New Journal of Chemistry","2011","35","5","1088","","10.1039/c0nj00752h","","","0.71073","MoKα","","0.1106","0.0697","","","0.1692","0.1853","","","","","","0.991","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052608","3.9006","0.0004","6.928","0.0007","7.7307","0.0008","107.693","0.009","99.426","0.008","94.527","0.008","194.49","0.04","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C2 H2 Br Cu N -","- C2 H2 Br Cu N -","- C4 H4 Br2 Cu2 N2 -","2","1","","Pospisil, Jiri; Jess, Inke; Näther, Christian; Necas, Marek; Taborsky, Petr","Luminescence properties of “double-stranded staircase” copper(i) halide coordination polymers with N-containing ligands","New Journal of Chemistry","2011","35","4","861","","10.1039/c0nj00809e","","","0.71073","MoKα","","0.037","0.0342","","","0.1123","0.1132","","","","","","1.204","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052609","8.9211","0.0012","9.6889","0.0013","11.322","0.0015","113.677","0.002","100.094","0.002","91.366","0.002","877.5","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H42 N4 O11 Zn2 -","- C36 H40 N4 O11 Zn2 -","- C36 H40 N4 O11 Zn2 -","1","0.5","","Lee, Yu Jin; Kim, Eun Young; Kim, Soo Hyun; Jang, Seung Pyo; Lee, Tae Geum; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Synthesis, crystal structures, photoluminescence, and catalytic reactivity of novel coordination polymers (0-D, 1-D, 2-D to 3-D) constructed from cis-1,2-cyclohexanedicarboxylic acid and various bipyridyl ligands","New Journal of Chemistry","2011","35","4","833","","10.1039/c0nj00869a","","","0.71073","MoKα","","0.0397","0.0312","","","0.0654","0.0667","","","","","","0.924","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052610","5.8322","0.0006","10.6119","0.001","13.5639","0.0013","89.324","0.002","86.923","0.002","86.978","0.002","837.07","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H44 N2 O14 Zn2 -","- C28 H40 N2 O14 Zn2 -","- C28 H40 N2 O14 Zn2 -","1","0.5","","Lee, Yu Jin; Kim, Eun Young; Kim, Soo Hyun; Jang, Seung Pyo; Lee, Tae Geum; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Synthesis, crystal structures, photoluminescence, and catalytic reactivity of novel coordination polymers (0-D, 1-D, 2-D to 3-D) constructed from cis-1,2-cyclohexanedicarboxylic acid and various bipyridyl ligands","New Journal of Chemistry","2011","35","4","833","","10.1039/c0nj00869a","","","0.71073","MoKα","","0.0464","0.0381","","","0.0939","0.0958","","","","","","0.974","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052611","6.167","0.003","12.715","0.007","13.095","0.007","114.959","0.008","97.225","0.009","93.347","0.008","916.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H36 N2 O10 Zn2 -","- C28 H32 N2 O10 Zn2 -","- C28 H32 N2 O10 Zn2 -","1","0.5","","Lee, Yu Jin; Kim, Eun Young; Kim, Soo Hyun; Jang, Seung Pyo; Lee, Tae Geum; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Synthesis, crystal structures, photoluminescence, and catalytic reactivity of novel coordination polymers (0-D, 1-D, 2-D to 3-D) constructed from cis-1,2-cyclohexanedicarboxylic acid and various bipyridyl ligands","New Journal of Chemistry","2011","35","4","833","","10.1039/c0nj00869a","","","0.71073","MoKα","","0.1342","0.0909","","","0.2512","0.2633","","","","","","1.019","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052612","6.2142","0.0012","9.4307","0.0018","12.213","0.003","81.975","0.003","82.195","0.003","85.397","0.004","700.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H34 N2 O10 Zn2 -","- C28 H34 N2 O10 Zn2 -","- C28 H34 N2 O10 Zn2 -","1","0.5","","Lee, Yu Jin; Kim, Eun Young; Kim, Soo Hyun; Jang, Seung Pyo; Lee, Tae Geum; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Synthesis, crystal structures, photoluminescence, and catalytic reactivity of novel coordination polymers (0-D, 1-D, 2-D to 3-D) constructed from cis-1,2-cyclohexanedicarboxylic acid and various bipyridyl ligands","New Journal of Chemistry","2011","35","4","833","","10.1039/c0nj00869a","","","0.71073","MoKα","","0.1155","0.0595","","","0.1132","0.1485","","","","","","0.952","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052613","5.6008","0.0005","13.9738","0.0013","20.9424","0.0019","93.765","0.002","96.678","0.002","94.342","0.002","1618.7","0.3","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H79 N5 O20 Zn4 -","- C60 H75 N5 O20 Zn4 -","- C60 H75 N5 O20 Zn4 -","1","0.5","","Lee, Yu Jin; Kim, Eun Young; Kim, Soo Hyun; Jang, Seung Pyo; Lee, Tae Geum; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Synthesis, crystal structures, photoluminescence, and catalytic reactivity of novel coordination polymers (0-D, 1-D, 2-D to 3-D) constructed from cis-1,2-cyclohexanedicarboxylic acid and various bipyridyl ligands","New Journal of Chemistry","2011","35","4","833","","10.1039/c0nj00869a","","","0.71073","MoKα","","0.0631","0.0461","","","0.1357","0.1398","","","","","","0.966","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052614","10.3877","0.0011","10.6229","0.0012","23.554","0.003","96.562","0.002","98.759","0.002","113.605","0.002","2309.4","0.5","170","2","170","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H45 N4 O12.5 S4 Zn2 -","- C36 H36 N4 O12.5 S4 Zn2 -","- C72 H72 N8 O25 S8 Zn4 -","2","1","","Lee, Yu Jin; Kim, Eun Young; Kim, Soo Hyun; Jang, Seung Pyo; Lee, Tae Geum; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee","Synthesis, crystal structures, photoluminescence, and catalytic reactivity of novel coordination polymers (0-D, 1-D, 2-D to 3-D) constructed from cis-1,2-cyclohexanedicarboxylic acid and various bipyridyl ligands","New Journal of Chemistry","2011","35","4","833","","10.1039/c0nj00869a","","","0.71073","MoKα","","0.1458","0.072","","","0.1912","0.2036","","","","","","0.883","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052615","4.8445","0.0009","32.906","0.006","6.2836","0.0011","90","","105.406","0.002","90","","965.7","0.3","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 N4 Ni O6 -","- C20 H18 N4 Ni O6 -","- C40 H36 N8 Ni2 O12 -","2","0.5","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.0642","0.0463","","","0.1088","0.1169","","","","","","1.056","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052616","5.0443","0.0006","32.161","0.004","6.3234","0.0008","90","","106.293","0.001","90","","984.6","0.2","292","2","292","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Cu N4 O6 -","- C20 H18 Cu N4 O6 -","- C40 H36 Cu2 N8 O12 -","2","0.5","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.0465","0.0367","","","0.0796","0.0838","","","","","","1.078","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052617","7.096","0.0012","12.071","0.002","22.767","0.004","90","","90.338","0.003","90","","1950.1","0.6","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 N4 O4 Zn -","- C20 H14 N4 O4 Zn -","- C80 H56 N16 O16 Zn4 -","4","1","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.1243","0.0666","","","0.1206","0.1415","","","","","","1.036","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052618","6.6139","0.0007","6.9872","0.0007","10.4414","0.0011","79.736","0.001","82.999","0.001","75.092","0.001","457.35","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 N4 Ni O6 -","- C20 H18 N4 Ni O6 -","- C20 H18 N4 Ni O6 -","1","0.5","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.0327","0.0292","","","0.067","0.0689","","","","","","1.077","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052619","12.463","0.003","11.681","0.003","12.403","0.003","90","","102.109","0.003","90","","1765.5","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H30 N8 Ni O4 -","- C38 H30 N8 Ni O4 -","- C76 H60 N16 Ni2 O8 -","2","0.5","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.0482","0.0358","","","0.0875","0.0939","","","","","","1.039","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052620","7.492","0.0008","10.6557","0.0012","12.1671","0.0014","90","","100.442","0.001","90","","955.24","0.18","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 Cu N4 O6 -","- C20 H18 Cu N4 O6 -","- C40 H36 Cu2 N8 O12 -","2","0.5","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.0234","0.0217","","","0.0618","0.0631","","","","","","1.077","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052621","16.5749","0.0019","18.395","0.002","22.912","0.003","90","","90","","90","","6985.8","1.4","291","2","291","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C20 H14 N4 O4 Zn -","- C20 H14 N4 O4 Zn -","- C320 H224 N64 O64 Zn16 -","16","0.5","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.0359","0.0313","","","0.0855","0.0882","","","","","","1.079","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052622","14.377","0.004","13.872","0.003","14.606","0.004","90","","102.988","0.003","90","","2838.5","1.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H20 N6 O6 Zn2 -","- C30 H20 N6 O6 Zn2 -","- C120 H80 N24 O24 Zn8 -","4","1","","Gong, Yunnan; Liu, Chongbo; Wen, Huiliang; Yan, Liushui; Xiong, Zhiqiang; Ding, Liang","Structural diversity and properties of M(ii) phenyl substituted pyrazole carboxylate complexes with 0D-, 1D-, 2D- and 3D frameworks","New Journal of Chemistry","2011","35","4","865","","10.1039/c0nj00904k","","","0.71073","MoKα","","0.1057","0.0502","","","0.1127","0.1405","","","","","","1.025","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052623","9.345","0.0011","10.061","0.0013","14.9597","0.0018","83.288","0.007","87.451","0.007","80.642","0.008","1377.8","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","1-Phenylamino-5,8-diethylamino-tri-s-triazin","1-Phenylamino-5,8-diethylamino-tri-s-triazin","","- C30 H35 N10 -","- C30 H35 N10 -","- C60 H70 N20 -","2","1","","Schwarzer, Anke; Kroke, Edwin","A series of aryl-/alkyl-substituted melems","New Journal of Chemistry","2011","35","4","953","","10.1039/c0nj00989j","","","0.71073","MoKα","","0.1502","0.0596","","","0.1126","0.1317","","","","","","0.898","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052624","8.3533","0.0012","15.991","0.002","17.814","0.003","111.035","0.007","95.13","0.008","95.873","0.006","2188.8","0.6","200","2","200","2","","","","","","","","4","P -1","-P 1","2","Hexaphenylmelem","Hexaphenylmelem","","- C45 H39 N13 O6 -","- C45 H39 N13 O6 -","- C90 H78 N26 O12 -","2","1","","Schwarzer, Anke; Kroke, Edwin","A series of aryl-/alkyl-substituted melems","New Journal of Chemistry","2011","35","4","953","","10.1039/c0nj00989j","","","0.71073","MoKα","","0.2634","0.0868","","","0.1924","0.2678","","","","","","0.967","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052625","12.553","0.0009","15.4588","0.0011","18.053","0.0015","83.008","0.004","80.797","0.004","67.012","0.004","3176.8","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","1-Phenylamino-5,8-diethylamino-tri-s-triazin","1-Phenylamino-5,8-diethylamino-tri-s-triazin","","- C57 H75 N25 O10 -","- C57 H75 N25 O10 -","- C114 H150 N50 O20 -","2","1","","Schwarzer, Anke; Kroke, Edwin","A series of aryl-/alkyl-substituted melems","New Journal of Chemistry","2011","35","4","953","","10.1039/c0nj00989j","","","0.71073","MoKα","","0.2224","0.069","","","0.1381","0.178","","","","","","0.871","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052626","12.5928","0.0007","12.5928","0.0007","19.4047","0.0019","90","","90","","90","","3077.2","0.4","100","2","100","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","1,5-Diphenylamino-8-ethylamino-tri-s-triazine","1,5-Diphenylamino-8-ethylamino-tri-s-triazine","","- C34 H34 N10 O2 -","- C34 H34 N10 O2 -","- C136 H136 N40 O8 -","4","0.5","","Schwarzer, Anke; Kroke, Edwin","A series of aryl-/alkyl-substituted melems","New Journal of Chemistry","2011","35","4","953","","10.1039/c0nj00989j","","","0.71073","MoKα","","0.2683","0.0569","","","0.1159","0.1544","","","","","","0.808","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052627","6.9224","0.0002","7.9698","0.0002","30.1896","0.0008","90","","93.8408","0.0014","90","","1661.82","0.08","120","2","120","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","Compound X","","","- C12 H20 Cd N2 O11 -","- C12 H20 Cd N2 O11 -","- C48 H80 Cd4 N8 O44 -","4","0.5","","Kostakis, George E.; Casella, Luigi; Boudalis, Athanassios K.; Monzani, Enrico; Plakatouras, John C.","Structural variation from 1D chains to 3D networks: a systematic study of coordination number effect on the construction of coordination polymers using the terepthaloylbisglycinate ligand","New Journal of Chemistry","2011","35","5","1060","","10.1039/c0nj01009j","","x-ray","0.71069","MoKα","","0.0246","0.0212","","","0.046","0.047","","","","","","1.093","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052628","6.8863","0.0005","30.987","0.002","8.0216","0.0006","90","","93.21","0.004","90","","1709","0.2","120","2","120","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H22 Mn N2 O12 -","- C12 H22 Mn N2 O12 -","- C48 H88 Mn4 N8 O48 -","4","1","","Kostakis, George E.; Casella, Luigi; Boudalis, Athanassios K.; Monzani, Enrico; Plakatouras, John C.","Structural variation from 1D chains to 3D networks: a systematic study of coordination number effect on the construction of coordination polymers using the terepthaloylbisglycinate ligand","New Journal of Chemistry","2011","35","5","1060","","10.1039/c0nj01009j","","x-ray","0.71073","MoKα","","0.1142","0.0499","","","0.1015","0.1217","","","","","","1.042","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052629","6.7914","0.0006","30.287","0.003","8.1676","0.0008","90","","90.331","0.004","90","","1680","0.3","100","","100","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 N2 O11 Pb -","- C12 H20 N2 O11 Pb -","- C48 H80 N8 O44 Pb4 -","4","1","","Kostakis, George E.; Casella, Luigi; Boudalis, Athanassios K.; Monzani, Enrico; Plakatouras, John C.","Structural variation from 1D chains to 3D networks: a systematic study of coordination number effect on the construction of coordination polymers using the terepthaloylbisglycinate ligand","New Journal of Chemistry","2011","35","5","1060","","10.1039/c0nj01009j","","x-ray","0.71073","MoKα","","0.0546","0.0426","","","0.1114","0.1204","","","","","","1.054","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052630","39.531","0.007","10.5545","0.0018","23.913","0.004","90","","111.845","0.002","90","","9261","3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C47 H58 O14.4 -","- C47 H58 O14.191 -","- C376 H464 O113.528 -","8","1","","Maerz, Andrew K.; Fowler, Drew A.; Mossine, Andrew V.; Mistry, Miten; Kumari, Harshita; Barnes, Charles L.; Deakyne, Carol A.; Atwood, Jerry L.","Solvent mediated self-assembly of organic nanostructures","New Journal of Chemistry","2011","35","4","784","","10.1039/c1nj00005e","","","0.71073","MoKα","","0.1495","0.0879","","","0.2585","0.3266","","","","","","1.03","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052631","10.94","0.005","12.189","0.005","17.454","0.01","78.497","0.006","87.202","0.007","84.105","0.004","2267.7","1.9","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H40 O16 -","- C48 H64 O12.578 -","- C96 H128 O25.156 -","2","1","","Maerz, Andrew K.; Fowler, Drew A.; Mossine, Andrew V.; Mistry, Miten; Kumari, Harshita; Barnes, Charles L.; Deakyne, Carol A.; Atwood, Jerry L.","Solvent mediated self-assembly of organic nanostructures","New Journal of Chemistry","2011","35","4","784","","10.1039/c1nj00005e","","","0.71073","MoKα","","0.1476","0.0788","","","0.2308","0.2773","","","","","","1.05","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052632","8.538","0.0002","12.9927","0.0003","18.7805","0.0005","106.57","0.001","90.837","0.001","92.743","0.001","1993.68","0.09","150","2","150","2","","","","","","","","7","P 1","P 1","1","","","","- C43 H22 Cl2 F4 N4 O2 S6 -","- C43 H22 Cl2 F4 N4 O2 S6 -","- C86 H44 Cl4 F8 N8 O4 S12 -","2","2","","Saad, Ali; Jeannin, Olivier; Fourmigué, Marc","A binaphthol-substituted tetrathiafulvalene with axial chirality and its enantiopure TCNQF4 charge-transfer salts","New Journal of Chemistry","2011","35","5","1004","","10.1039/c1nj20034h","","","0.71073","MoKα","","0.0686","0.0576","","","0.1585","0.176","","","","","","1.052","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052633","46.597","0.004","8.8358","0.0007","13.4499","0.0009","90","","93.6","0.003","90","","5526.7","0.7","150","2","150","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C62 H43 N O4 S12 -","- C62 H43 N O4 S12 -","- C248 H172 N4 O16 S48 -","4","1","","Saad, Ali; Jeannin, Olivier; Fourmigué, Marc","A binaphthol-substituted tetrathiafulvalene with axial chirality and its enantiopure TCNQF4 charge-transfer salts","New Journal of Chemistry","2011","35","5","1004","","10.1039/c1nj20034h","","","0.71073","MoKα","","0.1586","0.0746","","","0.1662","0.2228","","","","","","1.001","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052634","8.5594","0.0003","13.0019","0.0003","18.8153","0.0005","106.556","0.001","90.875","0.001","92.728","0.001","2003.93","0.1","150","2","150","2","","","","","","","","7","P 1","P 1","1","","","","- C43 H22 Cl2 F4 N4 O2 S6 -","- C43 H22 Cl2 F4 N4 O2 S6 -","- C86 H44 Cl4 F8 N8 O4 S12 -","2","2","","Saad, Ali; Jeannin, Olivier; Fourmigué, Marc","A binaphthol-substituted tetrathiafulvalene with axial chirality and its enantiopure TCNQF4 charge-transfer salts","New Journal of Chemistry","2011","35","5","1004","","10.1039/c1nj20034h","","","0.71073","MoKα","","0.047","0.0409","","","0.1165","0.1325","","","","","","1.098","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052635","16.0832","0.0006","9.0468","0.0003","18.4128","0.0006","90","","99.842","0.002","90","","2639.66","0.16","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H20 O2 S6 -","- C30 H20 O2 S6 -","- C120 H80 O8 S24 -","4","1","","Saad, Ali; Jeannin, Olivier; Fourmigué, Marc","A binaphthol-substituted tetrathiafulvalene with axial chirality and its enantiopure TCNQF4 charge-transfer salts","New Journal of Chemistry","2011","35","5","1004","","10.1039/c1nj20034h","","","0.71073","MoKα","","0.0686","0.0441","","","0.111","0.1401","","","","","","1.102","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052636","10.0556","0.0005","16.6586","0.0009","7.701","0.0004","90","","99.229","0.003","90","","1273.31","0.12","88","2","88","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C60 H64 N8 O8 -","4","1","","Olguín, Juan; Brooker, Sally","Synthesis of 3- and 5-formyl-4-phenyl-1H-pyrazoles: promising head units for the generation of asymmetric imine ligands and mixed metal polynuclear complexes","New Journal of Chemistry","2011","35","6","1242","","10.1039/c0nj00774a","","","0.71073","MoKα","","0.0665","0.0486","","","0.1147","0.125","","","","","","1.098","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052637","8.4741","0.0005","9.4806","0.0005","21.3093","0.0014","90","","90","","90","","1711.98","0.18","89","2","89","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H20 N2 O5 -","- C18 H20 N2 O5 -","- C72 H80 N8 O20 -","4","1","","Olguín, Juan; Brooker, Sally","Synthesis of 3- and 5-formyl-4-phenyl-1H-pyrazoles: promising head units for the generation of asymmetric imine ligands and mixed metal polynuclear complexes","New Journal of Chemistry","2011","35","6","1242","","10.1039/c0nj00774a","","","0.71073","MoKα","","0.0937","0.0624","","","0.1275","0.1438","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052638","12.5943","0.0016","18.395","0.002","20.037","0.003","84.789","0.007","85.699","0.007","70.209","0.006","4344.9","1","89","2","89","2","","","","","","","","8","P -1","-P 1","2","","","","- C85.75 H72.75 B2 F8 Fe N19.25 Ni3 O2.25 -","- C85.75 H72.75 B2 F8 Fe N19.25 Ni3 O2.25 -","- C171.5 H145.5 B4 F16 Fe2 N38.5 Ni6 O4.5 -","2","1","","Olguín, Juan; Brooker, Sally","Synthesis of 3- and 5-formyl-4-phenyl-1H-pyrazoles: promising head units for the generation of asymmetric imine ligands and mixed metal polynuclear complexes","New Journal of Chemistry","2011","35","6","1242","","10.1039/c0nj00774a","","","0.71073","MoKα","","0.0922","0.0743","","","0.1914","0.204","","","","","","1.085","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052639","14.9804","0.0015","15.6008","0.0015","19.252","0.002","84.728","0.003","75.56","0.003","75.295","0.003","4212.5","0.7","150","2","150","2","","","","","","","","4","P 1","P 1","1","","","","- C112 H206 K4 O103 -","- C112 H156 K4 O103 -","- C112 H156 K4 O103 -","1","1","","Fernandes, José A.; Paz, Filipe A. Almeida; Braga, Susana S.; Ribeiro-Claro, Paulo J. A.; Rocha, João","Inclusion of potassium 4,4′-biphenyldicarboxylate into β-cyclodextrin: the design and synthesis of an organic secondary building unit","New Journal of Chemistry","2011","35","6","1280","","10.1039/c0nj00796j","","","0.71073","MoKα","","0.2978","0.1384","","","0.2808","0.3097","","","","","","2.075","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052640","18.915","0.012","24.271","0.016","33.344","0.019","90","","99.883","0.016","90","","15081","16","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C210 H412 K6 O206 -","- C210 H300 K6 O206 -","- C420 H600 K12 O412 -","2","0.5","","Fernandes, José A.; Paz, Filipe A. Almeida; Braga, Susana S.; Ribeiro-Claro, Paulo J. A.; Rocha, João","Inclusion of potassium 4,4′-biphenyldicarboxylate into β-cyclodextrin: the design and synthesis of an organic secondary building unit","New Journal of Chemistry","2011","35","6","1280","","10.1039/c0nj00796j","","","0.71073","MoKα","","0.4596","0.1566","","","0.2844","0.3805","","","","","","1.069","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052641","12.798","0.0007","13.1163","0.0007","21.6536","0.0012","96.589","0.002","103.689","0.002","103.835","0.002","3372.1","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H78 Eu O10 P -","- C78 H78 Eu O10 P -","- C156 H156 Eu2 O20 P2 -","2","1","","Monteiro, Jorge H. S. K.; Adati, Renata D.; Davolos, Marian R.; Vicenti, Juliano R. M.; Burrow, Robert A.","Correlation between structural data and spectroscopic studies of a new β-diketonate complex with trivalent europium and gadolinium","New Journal of Chemistry","2011","35","6","1234","","10.1039/c0nj00831a","","","0.71073","MoKα","","0.046","0.0352","","","0.0787","0.0831","","","","","","1.061","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052642","12.7974","0.0005","13.1246","0.0005","21.5904","0.0008","96.576","0.002","103.758","0.002","103.779","0.002","3364.1","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H78 Gd O10 P -","- C78 H78 Gd O10 P -","- C156 H156 Gd2 O20 P2 -","2","1","","Monteiro, Jorge H. S. K.; Adati, Renata D.; Davolos, Marian R.; Vicenti, Juliano R. M.; Burrow, Robert A.","Correlation between structural data and spectroscopic studies of a new β-diketonate complex with trivalent europium and gadolinium","New Journal of Chemistry","2011","35","6","1234","","10.1039/c0nj00831a","","","0.71073","MoKα","","0.0697","0.0458","","","0.0907","0.1","","","","","","1.018","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052643","9.6204","0.0004","10.8948","0.0005","13.3105","0.0005","90","","95.411","0.004","90","","1388.89","0.1","220","","220","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 Ag Fe0.5 N4 -","- C14 H8 Ag Fe0.5 N4 -","- C56 H32 Ag4 Fe2 N16 -","4","1","","Shepherd, Helena J.; Bartual-Murgui, Carlos; Molnár, Gábor; Real, José Antonio; Muñoz, M. Carmen; Salmon, Lionel; Bousseksou, Azzedine","Thermal and pressure-induced spin crossover in a novel three-dimensional Hoffman-like clathrate complex","New Journal of Chemistry","2011","35","6","1205","","10.1039/c0nj00845a","","","0.7107","MoKα","","0.0803","0.0458","","","0.119","0.1264","","","","","","0.905","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052644","13.779","0.011","25.28","0.02","20.913","0.018","90","","93.576","0.016","90","","7271","10","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","(PPh4)2(Ru2(piv)4W(CN)8).0.5H2O","(PPh4)2[Ru2(piv)4W(CN)8].0.5H2O","","- C76 H77 N8 O8.5 P2 Ru2 W -","- C76 H76 N8 O8.5 P2 Ru2 W -","- C304 H304 N32 O34 P8 Ru8 W4 -","4","1","","Mikuriya, Masahiro; Yoshioka, Daisuke; Borta, Ana; Luneau, Dominique; Matoga, Dariusz; Szklarzewicz, Janusz; Handa, Makoto","Molecule-based magnetic materials based on dinuclear ruthenium carboxylate and octacyanotungstate","New Journal of Chemistry","2011","35","6","1226","","10.1039/c0nj00855a","","","0.71073","MoKα","","0.0377","0.0246","","","0.0503","0.0525","","","","","","0.935","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052645","24.609","0.002","24.609","0.002","15.7876","0.0018","90","","90","","90","","9561","1.5","293","2","293","2","","","","","","","","6","P -4","P -4","81","((Ru2(piv)4)3W(CN)8(H2O))","[{Ru2(piv)4}3W(CN)8(H2O)]","","- C68 H110 N8 O25 Ru6 W -","- C68 H93 N8 O25 Ru6 W -","- C272 H372 N32 O100 Ru24 W4 -","4","1","","Mikuriya, Masahiro; Yoshioka, Daisuke; Borta, Ana; Luneau, Dominique; Matoga, Dariusz; Szklarzewicz, Janusz; Handa, Makoto","Molecule-based magnetic materials based on dinuclear ruthenium carboxylate and octacyanotungstate","New Journal of Chemistry","2011","35","6","1226","","10.1039/c0nj00855a","","","0.71073","MoKα","","0.0805","0.0425","","","0.073","0.0775","","","","","","0.766","","","","has coordinates,has disorder","275218","2022-05-08","21:24:23",""
"7052646","7.5253","0.0003","34.2257","0.0013","19.5251","0.0008","90","","90.483","0.003","90","","5028.7","0.3","180","","180","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H31 K2 Mn5 Mo3 N22 O14 -","- C23 H3 K2 Mn5 Mo3 N22 O14 -","- C92 H12 K8 Mn20 Mo12 N88 O56 -","4","1","","Milon, Julie; Guionneau, Philippe; Duhayon, Carine; Sutter, Jean-Pascal","[K2Mn5{Mo(CN)7}3]: an open framework magnet with four Tc conversions orchestrated by guests and thermal history","New Journal of Chemistry","2011","35","6","1211","","10.1039/c0nj00860e","","","0.71073","MoKα","","0.0626","0.0342","","0.0399","0.0347","0.0347","","","","","","1.093","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052647","12.4549","0.0007","12.6214","0.0007","26.4841","0.0015","90","","91.527","0.001","90","","4161.8","0.4","100","2","100","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C88 H77 Co4 N15 O9 -","- C88 H77 Co4 N15 O9 -","- C176 H154 Co8 N30 O18 -","2","0.5","","Craig, Gavin A.; Costa, José Sánchez; Aguilà, David; Barrios, Leoní A.; Roubeau, Olivier; Teat, Simon J.; Aromí, Guillem","Molecular [Co(iii)Co(ii)] ×2 assemblies of a new bis-phenol/pyrazolyl ligand","New Journal of Chemistry","2011","35","6","1202","","10.1039/c0nj00861c","","","0.7749","synchrotron","","0.0921","0.0643","","","0.19","0.2114","","","","","","1.061","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052648","16.133","0.003","23.373","0.005","23.517","0.005","88.14","0.03","76.5","0.03","80.03","0.03","8492","3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C145 H109 Co8 N25 O14 -","- C145 H107 Co8 N25 O14 -","- C290 H214 Co16 N50 O28 -","2","1","","Craig, Gavin A.; Costa, José Sánchez; Aguilà, David; Barrios, Leoní A.; Roubeau, Olivier; Teat, Simon J.; Aromí, Guillem","Molecular [Co(iii)Co(ii)] ×2 assemblies of a new bis-phenol/pyrazolyl ligand","New Journal of Chemistry","2011","35","6","1202","","10.1039/c0nj00861c","","","0.7383","synchrotron","","0.1792","0.1561","","","0.4118","0.4437","","","","","","1.741","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052649","9.5124","0.0007","11.5501","0.0008","16.6392","0.0012","90","","90","","90","","1828.1","0.2","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C7 H10 Br N3 -","- C7 H10 Br N3 -","- C56 H80 Br8 N24 -","8","1","","Drab, David M.; Smiglak, Marcin; Shamshina, Julia L.; Kelley, Steven P.; Schneider, Stefan; Hawkins, Tommy W.; Rogers, Robin D.","Synthesis of N-cyanoalkyl-functionalized imidazolium nitrate and dicyanamide ionic liquids with a comparison of their thermal properties for energetic applications","New Journal of Chemistry","2011","35","8","1701","","10.1039/c0nj00889c","","","0.71073","MoKα","","0.0284","0.0214","","","0.0526","0.0549","","","","","","1.092","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052650","7.5721","0.0011","11.2151","0.0016","10.52","0.0015","90","","91.133","0.002","90","","893.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H10 Br N3 -","- C7 H10 Br N3 -","- C28 H40 Br4 N12 -","4","1","","Drab, David M.; Smiglak, Marcin; Shamshina, Julia L.; Kelley, Steven P.; Schneider, Stefan; Hawkins, Tommy W.; Rogers, Robin D.","Synthesis of N-cyanoalkyl-functionalized imidazolium nitrate and dicyanamide ionic liquids with a comparison of their thermal properties for energetic applications","New Journal of Chemistry","2011","35","8","1701","","10.1039/c0nj00889c","","","0.71073","MoKα","","0.0397","0.0328","","","0.0826","0.0867","","","","","","1.044","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052651","7.8154","0.0011","18.401","0.003","7.0641","0.001","90","","112.283","0.002","90","","940","0.2","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N6 -","- C8 H8 N6 -","- C32 H32 N24 -","4","1","","Drab, David M.; Smiglak, Marcin; Shamshina, Julia L.; Kelley, Steven P.; Schneider, Stefan; Hawkins, Tommy W.; Rogers, Robin D.","Synthesis of N-cyanoalkyl-functionalized imidazolium nitrate and dicyanamide ionic liquids with a comparison of their thermal properties for energetic applications","New Journal of Chemistry","2011","35","8","1701","","10.1039/c0nj00889c","","","0.71073","MoKα","","0.0416","0.0366","","","0.0925","0.0961","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052652","8.7192","0.0013","9.8611","0.0014","11.1363","0.0016","93.588","0.003","108.321","0.002","112.598","0.002","820.6","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H8 N4 O3 -","- C6 H8 N4 O3 -","- C24 H32 N16 O12 -","4","2","","Drab, David M.; Smiglak, Marcin; Shamshina, Julia L.; Kelley, Steven P.; Schneider, Stefan; Hawkins, Tommy W.; Rogers, Robin D.","Synthesis of N-cyanoalkyl-functionalized imidazolium nitrate and dicyanamide ionic liquids with a comparison of their thermal properties for energetic applications","New Journal of Chemistry","2011","35","8","1701","","10.1039/c0nj00889c","","","0.71073","MoKα","","0.0648","0.0514","","","0.1594","0.1742","","","","","","0.769","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052653","20.5139","0.0004","12.3909","0.0003","15.0847","0.0003","90","","98.958","0.001","90","","3787.55","0.14","115","2","115","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H52 Cu4 I4 S4 -","- C24 H52 Cu4 I4 S4 -","- C96 H208 Cu16 I16 S16 -","4","1","","Knorr, Michael; Guyon, Fabrice; Kubicki, Marek M.; Rousselin, Yoann; Aly, Shawkat M.; Harvey, Pierre D.","Effect of t-BuS vs. n-BuS on the topology, Cu⋯Cu distances and luminescence properties of 2D Cu4I4/RS(CH2)4SR metal‒organic frameworks","New Journal of Chemistry","2011","35","6","1184","","10.1039/c0nj00923g","","","0.71073","MoKα","","0.0479","0.0396","","","0.0821","0.0859","","","","","","1.162","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052654","10.2016","0.0004","18.2596","0.0008","20.2098","0.0006","90","","90","","90","","3764.6","0.2","115","2","115","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C12 H26 Cu2 I2 S2 -","- C12 H26 Cu2 I2 S2 -","- C96 H208 Cu16 I16 S16 -","8","1","","Knorr, Michael; Guyon, Fabrice; Kubicki, Marek M.; Rousselin, Yoann; Aly, Shawkat M.; Harvey, Pierre D.","Effect of t-BuS vs. n-BuS on the topology, Cu⋯Cu distances and luminescence properties of 2D Cu4I4/RS(CH2)4SR metal‒organic frameworks","New Journal of Chemistry","2011","35","6","1184","","10.1039/c0nj00923g","","","0.71073","MoKα","","0.0756","0.0566","","","0.103","0.1124","","","","","","1.111","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052655","16.6165","0.0013","19.3662","0.0015","45.961","0.004","90","","96.779","0.001","90","","14687","2","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H70.8 Cl6 Cu8 Dy2 N12 O25.4 -","- C60 H52 Cl6 Cu8 Dy2 N12 O16 -","- C360 H312 Cl36 Cu48 Dy12 N72 O96 -","6","1.5","","Borta, Ana; Jeanneau, Erwann; Chumakov, Yuri; Luneau, Dominique; Ungur, Liviu; Chibotaru, Liviu F.; Wernsdorfer, Wolfgang","Synthesis, structure, magnetism and theoretical study of a series of complexes with a decanuclear core [Ln(iii)2Cu(ii)8] (Ln = Y, Gd, Tb, Dy)","New Journal of Chemistry","2011","35","6","1270","","10.1039/c0nj00931h","","","0.71073","MoKα","","0.0834","0.0449","","0.1484","0.086","0.1484","","","","","","1.1696","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052656","16.4096","0.0013","19.7554","0.0015","45.583","0.004","90","","95.465","0.001","90","","14710","2","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H70.6 Cl6 Cu8 Gd2 N12 O25.3 -","- C60 H52 Cl6 Cu8 Gd2 N12 O16 -","- C360 H312 Cl36 Cu48 Gd12 N72 O96 -","6","1.5","","Borta, Ana; Jeanneau, Erwann; Chumakov, Yuri; Luneau, Dominique; Ungur, Liviu; Chibotaru, Liviu F.; Wernsdorfer, Wolfgang","Synthesis, structure, magnetism and theoretical study of a series of complexes with a decanuclear core [Ln(iii)2Cu(ii)8] (Ln = Y, Gd, Tb, Dy)","New Journal of Chemistry","2011","35","6","1270","","10.1039/c0nj00931h","","","0.71073","MoKα","","0.0852","0.0465","","0.1441","0.0854","0.1441","","","","","","1.1727","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052657","16.717","0.003","19.241","0.004","45.634","0.009","90","","96.53","0.03","90","","14583","5","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H70.6 Cl6 Cu8 N12 O25.3 Tb2 -","- C60 H52 Cl6 Cu8 N12 O16 Tb2 -","- C360 H312 Cl36 Cu48 N72 O96 Tb12 -","6","1.5","","Borta, Ana; Jeanneau, Erwann; Chumakov, Yuri; Luneau, Dominique; Ungur, Liviu; Chibotaru, Liviu F.; Wernsdorfer, Wolfgang","Synthesis, structure, magnetism and theoretical study of a series of complexes with a decanuclear core [Ln(iii)2Cu(ii)8] (Ln = Y, Gd, Tb, Dy)","New Journal of Chemistry","2011","35","6","1270","","10.1039/c0nj00931h","","","0.71073","MoKα","","0.1081","0.0659","","0.1817","0.1227","0.1817","","","","","","1.0283","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052658","16.5041","0.0016","19.2258","0.0018","45.343","0.004","90","","96.87","0.002","90","","14284","2","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H78.2 Cl6 Cu8 N12 O29.1 Y2 -","- C60 H52 Cl6 Cu8 N12 O16 Y2 -","- C360 H312 Cl36 Cu48 N72 O96 Y12 -","6","1.5","","Borta, Ana; Jeanneau, Erwann; Chumakov, Yuri; Luneau, Dominique; Ungur, Liviu; Chibotaru, Liviu F.; Wernsdorfer, Wolfgang","Synthesis, structure, magnetism and theoretical study of a series of complexes with a decanuclear core [Ln(iii)2Cu(ii)8] (Ln = Y, Gd, Tb, Dy)","New Journal of Chemistry","2011","35","6","1270","","10.1039/c0nj00931h","","","0.71073","MoKα","","0.0862","0.0588","","0.2221","0.1533","0.2221","","","","","","1.0438","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052659","9.0124","0.0002","19.4857","0.0004","14.471","0.0003","90","","96.089","0.001","90","","2526.96","0.09","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H28 Fe Mn N2 O19 -","- C15 H28 Fe Mn N2 O19 -","- C60 H112 Fe4 Mn4 N8 O76 -","4","1","","Maxim, Catalin; Ferlay, Sylvie; Train, Cyrille","Binuclear heterometallic M(iii)‒Mn(ii) (M = Fe, Cr) oxalate-bridged complexes associated with a bisamidinium dication: a structural and magnetic study","New Journal of Chemistry","2011","35","6","1254","","10.1039/c0nj00976h","","","0.71073","MoKα","","0.037","0.0275","","","0.0736","0.0799","","","","","","0.868","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052660","9.003","0.0002","19.3913","0.0005","14.5081","0.0004","90","","96.087","0.001","90","","2518.54","0.11","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H28 Cr Mn N2 O19 -","- C15 H28 Cr Mn N2 O19 -","- C60 H112 Cr4 Mn4 N8 O76 -","4","1","","Maxim, Catalin; Ferlay, Sylvie; Train, Cyrille","Binuclear heterometallic M(iii)‒Mn(ii) (M = Fe, Cr) oxalate-bridged complexes associated with a bisamidinium dication: a structural and magnetic study","New Journal of Chemistry","2011","35","6","1254","","10.1039/c0nj00976h","","","0.71073","MoKα","","0.092","0.0862","","","0.2217","0.2316","","","","","","1.015","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052661","17.0127","0.0009","9.5391","0.0005","26.1916","0.0013","90","","102.583","0.002","90","","4148.4","0.4","110","","110","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C49 H62 N4 O2 -","- C49 H62 N4 O2 -","- C196 H248 N16 O8 -","4","1","","Aravindu, Kunche; Krayer, Michael; Kim, Han-Je; Lindsey, Jonathan S.","Facile synthesis of a B,D-tetradehydrocorrin and rearrangement to bacteriochlorins","New Journal of Chemistry","2011","35","7","1376","","10.1039/c1nj20027e","","","0.71073","MoKα","","0.1499","0.0939","","","0.249","0.2866","","","","","","1.061","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052662","5.1642","0.0002","7.4945","0.0003","8.4337","0.0003","94.823","0.002","96.022","0.003","101.486","0.003","316.26","0.02","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C8 H22 N4 O4 -","- C8 H22 N4 O4 -","- C8 H22 N4 O4 -","1","0.5","","Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M.","Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes","New Journal of Chemistry","2011","35","7","1515","","10.1039/c1nj20040b","","","1.54178","CuKα","","0.0532","0.0506","","","0.1465","0.1505","","","","","","1.066","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052663","10.609","0.0005","5.2","0.0003","14.302","0.0007","90","","112.627","0.004","90","","728.27","0.07","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H26 N4 O4 -","- C10 H26 N4 O4 -","- C20 H52 N8 O8 -","2","0.5","","Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M.","Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes","New Journal of Chemistry","2011","35","7","1515","","10.1039/c1nj20040b","","","0.71073","MoKα","","0.0985","0.0612","","","0.1428","0.162","","","","","","1.055","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052664","5.1899","0.0002","7.4045","0.0003","11.2621","0.0005","99.469","0.002","96.754","0.002","101.269","0.003","413.61","0.03","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H30 N4 O4 -","- C12 H30 N4 O4 -","- C12 H30 N4 O4 -","1","0.5","","Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M.","Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes","New Journal of Chemistry","2011","35","7","1515","","10.1039/c1nj20040b","","","0.71073","MoKα","","0.0999","0.0645","","","0.1702","0.1962","","","","","","1.042","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052665","5.1986","0.0003","7.4194","0.0005","12.423","0.0009","88.755","0.004","79.063","0.004","78.612","0.003","461.13","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H34 N4 O4 -","- C14 H34 N4 O4 -","- C14 H34 N4 O4 -","1","0.5","","Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M.","Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes","New Journal of Chemistry","2011","35","7","1515","","10.1039/c1nj20040b","","","0.71073","MoKα","","0.1154","0.0658","","","0.1572","0.1857","","","","","","1.027","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052666","5.2049","0.0003","7.4169","0.0005","13.6376","0.0009","95.676","0.004","97.552","0.004","101.479","0.003","507.21","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H38 N4 O4 -","- C16 H38 N4 O4 -","- C16 H38 N4 O4 -","1","0.5","","Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M.","Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes","New Journal of Chemistry","2011","35","7","1515","","10.1039/c1nj20040b","","","0.71073","MoKα","","0.1142","0.0706","","","0.1732","0.199","","","","","","1.052","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052667","5.1973","0.0005","7.3964","0.0012","15.0141","0.0016","103.295","0.004","92.698","0.003","101.711","0.005","547.33","0.12","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H42 N4 O4 -","- C18 H42 N4 O4 -","- C18 H42 N4 O4 -","1","0.5","","Martí-Rujas, Javier; Kariuki, Benson M.; Hughes, Colan E.; Morte-Ródenas, Anabel; Guo, Fang; Glavcheva-Laleva, Zornitza; Taştemür, Kemal; Ooi, Li-ling; Yeo, Lily; Harris, Kenneth D. M.","Structural diversity, but no polymorphism, in a homologous family of co-crystals of urea and α,ω-dihydroxyalkanes","New Journal of Chemistry","2011","35","7","1515","","10.1039/c1nj20040b","","","0.71073","MoKα","","0.0589","0.0556","","","0.1649","0.165","","","","","","1.105","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052668","9.1429","0.0012","19.388","0.003","21.699","0.003","90","","90","","90","","3846.4","0.9","93.15","","93.15","","","","","","","","synthesis as described","5","P b c 21","P 2c -2b","29","Tris-ethylenediamine cadmium(ii) bis-biphenyldithiolate cadmium(ii) ethylenediamine","Tris-ethylenediamine cadmium(II) bis-biphenyldithiolate cadmium(II) ethylenediamine","","- C32 H48 Cd2 N8 S4 -","- C32 H44 Cd2 N8 S4 -","- C128 H176 Cd8 N32 S16 -","4","1","","Louvain, Nicolas; Takashima, Yohei; Kitagawa, Susumu; Furukawa, Shuhei","Thermodynamically controlled coordination-engineering of novel 2D cadmium thiolate coordination polymers","New Journal of Chemistry","2011","35","6","1265","","10.1039/c1nj20042a","","x-ray","0.71073","MoKα","","0.0398","0.038","","","0.1001","0.1024","","","","","","1.055","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052669","9.3757","0.0011","16.437","0.002","23.66","0.003","87.968","0.003","83.848","0.003","85.414","0.003","3612.3","0.8","93.15","","93.15","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C66 H88 Cd4 N12 S8 -","- C66 H82 Cd4 N12 S8 -","- C132 H164 Cd8 N24 S16 -","2","1","","Louvain, Nicolas; Takashima, Yohei; Kitagawa, Susumu; Furukawa, Shuhei","Thermodynamically controlled coordination-engineering of novel 2D cadmium thiolate coordination polymers","New Journal of Chemistry","2011","35","6","1265","","10.1039/c1nj20042a","","x-ray","0.71073","MoKα","","0.0399","0.0354","","","0.0792","0.0808","","","","","","1.1","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052670","8.2439","0.0003","21.1076","0.0009","22.4715","0.0008","90","","90","","90","","3910.2","0.3","93.15","","93.15","","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","N,N-diethyl-1,3-propanediamine biphenyldithiolate cadmium(ii)","N,N-diethyl-1,3-propanediamine biphenyldithiolate cadmium(II)","","- C19 H26 Cd N2 S2 -","- C19 H26 Cd N2 S2 -","- C152 H208 Cd8 N16 S16 -","8","1","","Louvain, Nicolas; Takashima, Yohei; Kitagawa, Susumu; Furukawa, Shuhei","Thermodynamically controlled coordination-engineering of novel 2D cadmium thiolate coordination polymers","New Journal of Chemistry","2011","35","6","1265","","10.1039/c1nj20042a","","x-ray","0.71073","MoKα","","0.032","0.0285","","","0.0638","0.0657","","","","","","1.161","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052671","9.776","0.002","12.364","0.003","18.48","0.004","73.75","0.03","80.53","0.03","76.89","0.03","2076.3","0.9","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H20 N2 -","- C28 H20 N2 -","- C112 H80 N8 -","4","2","","Yuan, Yang; Li, Di; Zhang, Xueqiang; Zhao, Xingjia; Liu, Yu; Zhang, Jingying; Wang, Yue","Phenanthroimidazole-derivative semiconductors as functional layer in high performance OLEDs","New Journal of Chemistry","2011","35","7","1534","","10.1039/c1nj20072k","","","0.71073","MoKα","","0.0776","0.0465","","","0.1234","0.1354","","","","","","1.058","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052672","10.527","0.002","18.843","0.004","20.461","0.004","90","","90","","90","","4058.6","1.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C28 H20 N2 -","- C28 H20 N2 -","- C224 H160 N16 -","8","2","","Yuan, Yang; Li, Di; Zhang, Xueqiang; Zhao, Xingjia; Liu, Yu; Zhang, Jingying; Wang, Yue","Phenanthroimidazole-derivative semiconductors as functional layer in high performance OLEDs","New Journal of Chemistry","2011","35","7","1534","","10.1039/c1nj20072k","","","0.71073","MoKα","","0.1638","0.0732","","","0.11","0.1333","","","","","","0.984","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052673","13.726","0.003","8.4643","0.0017","19.367","0.004","90","","109.14","0.03","90","","2125.7","0.9","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C29 H22 N2 -","- C29 H22 N2 -","- C116 H88 N8 -","4","1","","Yuan, Yang; Li, Di; Zhang, Xueqiang; Zhao, Xingjia; Liu, Yu; Zhang, Jingying; Wang, Yue","Phenanthroimidazole-derivative semiconductors as functional layer in high performance OLEDs","New Journal of Chemistry","2011","35","7","1534","","10.1039/c1nj20072k","","","0.71073","MoKα","","0.1475","0.074","","","0.1596","0.191","","","","","","1.025","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052674","11.276","0.0014","21.607","0.003","21.504","0.003","90","","93.406","0.001","90","","5230","1.2","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H45 Cr3 N O18 S -","- C45.637 H43.936 Cr3 N O17.694 S -","- C182.548 H175.744 Cr12 N4 O70.776 S4 -","4","1","","Corradini, Valdis; Cervetti, Christian; Ghirri, Alberto; Biagi, Roberto; del Pennino, Umberto; Timco, Grigore A.; Winpenny, Richard E. P.; Affronte, Marco","Oxo-centered carboxylate-bridged trinuclear complexes deposited on Au(111) by a mass-selective electrospray","New Journal of Chemistry","2011","35","8","1683","","10.1039/c1nj20080a","","x-ray","0.671","synchrotron","","0.1566","0.1287","","","0.2788","0.2899","","","","","","1.168","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052675","9.823","0.0005","10.356","0.0006","10.74","0.0006","63.59","0.003","76.146","0.003","70.354","0.002","916.31","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 N2 O2 Zn -","- C20 H20 N2 O2 Zn -","- C40 H40 N4 O4 Zn2 -","2","1","","Poulter, Neil; Donaldson, Matthew; Mulley, Geraldine; Duque, Luis; Waterfield, Nicholas; Shard, Alex G.; Spencer, Steve; Jenkins, A. Tobias A.; Johnson, Andrew L.","Plasma deposited metal Schiff-base compounds as antimicrobials","New Journal of Chemistry","2011","35","7","1477","","10.1039/c1nj20091g","","","0.71073","MoKα","","0.0741","0.0527","","","0.1258","0.14","","","","","","1.105","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052676","10.713","0.0002","7.356","0.0001","22.324","0.0004","90","","102.898","0.001","90","","1714.85","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 Cu N2 O2 -","- C20 H20 Cu N2 O2 -","- C80 H80 Cu4 N8 O8 -","4","1","","Poulter, Neil; Donaldson, Matthew; Mulley, Geraldine; Duque, Luis; Waterfield, Nicholas; Shard, Alex G.; Spencer, Steve; Jenkins, A. Tobias A.; Johnson, Andrew L.","Plasma deposited metal Schiff-base compounds as antimicrobials","New Journal of Chemistry","2011","35","7","1477","","10.1039/c1nj20091g","","","0.71073","MoKα","","0.0439","0.0339","","","0.0856","0.091","","","","","","1.039","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052677","12.4835","0.0005","12.6087","0.0005","17.541","0.0006","89.168","0.002","84.144","0.002","72.748","0.002","2622.63","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H27 B F24 N7 O2 Rh -","- C50 H27 B F24 N7 O2 Rh -","- C100 H54 B2 F48 N14 O4 Rh2 -","2","1","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.06","0.0482","","","0.1056","0.1088","","","","","","1.993","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052678","12.7888","0.0006","36.1479","0.0019","22.5803","0.0012","90","","97.565","0.003","90","","10347.8","0.9","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C94.5 H57 B2 Cl F48 N12 O6 Rh2 -","- C94.5 H56 B2 Cl F48 N12 O6 Rh2 -","- C378 H224 B8 Cl4 F192 N48 O24 Rh8 -","4","1","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.2028","0.0789","","","0.1696","0.2294","","","","","","0.999","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052679","12.7104","0.0005","12.8002","0.0005","18.2119","0.0007","80.389","0.002","74.396","0.002","81.914","0.002","2799.4","0.19","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C56 H39 B F24 N7 Rh -","- C56 H39 B F24 N7 Rh -","- C112 H78 B2 F48 N14 Rh2 -","2","2","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.0643","0.0608","","","0.1511","0.1534","","","","","","2.732","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052680","19.3288","0.0006","16.2023","0.0005","17.9993","0.0006","90","","100.6","0.002","90","","5540.7","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H39 B F24 N7 Rh -","- C56 H39 B F24 N7 Rh -","- C224 H156 B4 F96 N28 Rh4 -","4","1","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.0582","0.0442","","","0.1302","0.1455","","","","","","1.054","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052681","14.7482","0.0017","21.214","0.003","25.12","0.003","90","","90","","90","","7859.3","1.7","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C48 H47 B N7 Rh -","- C48 H47 B N7 Rh -","- C384 H376 B8 N56 Rh8 -","8","1","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.3212","0.0856","","","0.1576","0.2637","","","","","","0.893","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052682","13.7477","0.0004","17.6434","0.0006","22.8544","0.0007","90","","100.748","0.001","90","","5446.2","0.3","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C53 H40 B F24 N6 O Rh -","- C53 H40 B F23.88 N6 O Rh -","- C212 H160 B4 F95.52 N24 O4 Rh4 -","4","1","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.0661","0.0519","","","0.1659","0.1817","","","","","","1.413","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052683","12.6013","0.0008","12.8203","0.0008","18.6347","0.0012","76.517","0.003","70.71","0.003","81.166","0.003","2753.5","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C55 H35 B F24 N7 Rh -","- C55 H35 B F24 N7 Rh -","- C110 H70 B2 F48 N14 Rh2 -","2","1","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.1292","0.0753","","","0.189","0.2188","","","","","","1.25","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052684","40.121","0.002","12.7579","0.0007","24.5524","0.0012","90","","102.969","0.001","90","","12246.8","1.1","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C58 H42 B F24 N7 Rh -","- C58 H42 B F24 N7 Rh -","- C464 H336 B8 F192 N56 Rh8 -","8","1","","Man, Bradley Y.-W.; Bhadbhade, Mohan; Messerle, Barbara A.","Rhodium(i) complexes bearing N-donor ligands: catalytic activity towards intramolecular cyclization of alkynoic acids and ligand lability","New Journal of Chemistry","2011","35","8","1730","","10.1039/c1nj20094a","","","0.71073","MoKα","","0.0726","0.0575","","","0.1734","0.186","","","","","","1.373","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052685","10.989","0.004","11.905","0.004","23.737","0.007","90","","90","","90","","3105.4","1.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C7 H7.5 Cl0.5 N O2 -","- C15 H15 Cl N2 O4 -","- C120 H120 Cl8 N16 O32 -","8","1","","Majumdar, K. C.; Ganai, Sintu; Nandi, Raj Kumar","Regioselective synthesis of pyrimidine-annulated spiro-dihydrofurans by silver-catalyzed 5-endo-dig cyclization","New Journal of Chemistry","2011","35","7","1355","","10.1039/c1nj20121b","","","0.71073","MoKα","","0.0486","0.0413","","","0.1134","0.1195","","","","","","0.994","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052686","12.3481","0.0006","15.7551","0.0008","16.7496","0.0009","105.903","0.002","108.938","0.002","93.046","0.002","2927.8","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H34 N4 O3 -","- C30 H34 N4 O3 -","- C120 H136 N16 O12 -","4","2","","Maiti, Barnali; Sun, Chung-Ming","Novel approach towards the synthesis of skeletally diverse benzimidazole-pyrrolo[1,2-a]quinoxaline by SNAr/Pictet‒Spengler reaction under focused microwave irradiation","New Journal of Chemistry","2011","35","7","1385","","10.1039/c1nj20153k","","","0.71073","MoKα","","0.1378","0.0861","","","0.2406","0.2707","","","","","","0.956","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052687","5.2175","0.0005","10.5765","0.001","34.092","0.003","90","","90.726","0.002","90","","1881.1","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H24 F6 O6 S8 Zn -","- C34 H24 F6 O6 S8 Zn -","- C68 H48 F12 O12 S16 Zn2 -","2","0.5","","Wang, Yu; Li, Bo; Huang, Guolong; Zhang, Jing-Ping; Zhang, Yan","An asymmetric TTF derivative bearing a phenyl β-diketone group as an efficient ligand towards functional materials","New Journal of Chemistry","2011","35","7","1472","","10.1039/c1nj20167k","","","0.71073","MoKα","","0.0809","0.0559","","","0.1275","0.1412","","","","","","1.048","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052688","4.9287","0.0007","13.501","0.002","14.126","0.002","90","","90","","90","","940","0.2","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H5 I O3 -","- C10 H5 I O3 -","- C40 H20 I4 O12 -","4","1","","Zaware, Santosh B.; Gonnade, Rajesh G.; Srinivas, Darbha; Khan, Ayesha; Rane, Sandhya Y.","Antioxidant and anticancer activities of supramolecularly controlled magnetostructural halo-oximes of lawsone","New Journal of Chemistry","2011","35","8","1615","","10.1039/c1nj20176j","","","0.71073","MoKα","","0.0236","0.023","","","0.0557","0.056","","","","","","1.112","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052689","15.725","0.007","14.103","0.006","14.188","0.006","90","","115.484","0.006","90","","2840","2","297","2","297","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C10 H5 I O3 -","- C10 H5 I O3 -","- C120 H60 I12 O36 -","12","3","","Zaware, Santosh B.; Gonnade, Rajesh G.; Srinivas, Darbha; Khan, Ayesha; Rane, Sandhya Y.","Antioxidant and anticancer activities of supramolecularly controlled magnetostructural halo-oximes of lawsone","New Journal of Chemistry","2011","35","8","1615","","10.1039/c1nj20176j","","","0.71073","MoKα","","0.0223","0.0219","","","0.0568","0.057","","","","","","1.031","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052690","37.766","0.006","4.9473","0.0008","15.836","0.003","90","","106.025","0.002","90","","2843.8","0.8","297","2","297","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C10 H5 I O3 -","- C10 H5 I O3 -","- C120 H60 I12 O36 -","12","3","","Zaware, Santosh B.; Gonnade, Rajesh G.; Srinivas, Darbha; Khan, Ayesha; Rane, Sandhya Y.","Antioxidant and anticancer activities of supramolecularly controlled magnetostructural halo-oximes of lawsone","New Journal of Chemistry","2011","35","8","1615","","10.1039/c1nj20176j","","","0.71073","MoKα","","0.0454","0.0421","","","0.097","0.0993","","","","","","1.08","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052691","14.5758","0.0004","15.5947","0.0004","14.6354","0.0004","90","","90.907","0.001","90","","3326.29","0.15","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-bis(9-hydroxyfluoren-9-yl)benzene. 2-picoline clathrate","1,4-bis(9-hydroxyfluoren-9-yl)benzene. 2-picoline clathrate","","- C44 H36 N2 O2 -","- C44 H32 N2 O2 -","- C176 H128 N8 O8 -","4","1","","Bourne, Susan A.; Corin, Kirsten; Cruickshank, Dyanne L.; Davson, Jessica; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin","Enclathration of bases by a fluorenyl host: structure, stability and selectivity","New Journal of Chemistry","2011","35","7","1556","","10.1039/c1nj20241c","","","0.71073","MoKα","","0.1071","0.0615","","","0.1563","0.1787","","","","","","0.991","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052692","9.4854","0.0002","13.3617","0.0003","14.0639","0.0004","82.287","0.001","81.067","0.001","72.23","0.001","1669.69","0.07","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1,4-bis(9-hydroxyfluoren-9-yl)benzene. 3-picoline clathrate","1,4-bis(9-hydroxyfluoren-9-yl)benzene. 3-picoline clathrate","","- C44 H36 N2 O2 -","- C44 H36 N2 O2 -","- C88 H72 N4 O4 -","2","1","","Bourne, Susan A.; Corin, Kirsten; Cruickshank, Dyanne L.; Davson, Jessica; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin","Enclathration of bases by a fluorenyl host: structure, stability and selectivity","New Journal of Chemistry","2011","35","7","1556","","10.1039/c1nj20241c","","","0.71073","MoKα","","0.085","0.0422","","","0.0913","0.107","","","","","","0.932","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052693","8.1529","0.0001","8.4848","0.0001","12.4124","0.0003","93.615","0.001","90.803","0.001","103.788","0.001","831.86","0.02","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1,4-bis(9-hydroxyfluoren-9-yl)benzene. 4-picoline clathrate","1,4-bis(9-hydroxyfluoren-9-yl)benzene. 4-picoline clathrate","","- C44 H36 N2 O2 -","- C44 H36 N2 O2 -","- C44 H36 N2 O2 -","1","0.5","","Bourne, Susan A.; Corin, Kirsten; Cruickshank, Dyanne L.; Davson, Jessica; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin","Enclathration of bases by a fluorenyl host: structure, stability and selectivity","New Journal of Chemistry","2011","35","7","1556","","10.1039/c1nj20241c","","","0.71073","MoKα","","0.0598","0.0424","","","0.1054","0.112","","","","","","1.077","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052694","16.8977","0.0002","13.9004","0.0002","28.3312","0.0004","90","","90.103","0.001","90","","6654.56","0.16","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,4-bis(9-hydroxyfluoren-9-yl)benzene. 4-picoline and morpholine clathrate","","- C42 H38 N2 O3 -","- C42 H38 N2 O3 -","- C336 H304 N16 O24 -","8","1","","Bourne, Susan A.; Corin, Kirsten; Cruickshank, Dyanne L.; Davson, Jessica; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin","Enclathration of bases by a fluorenyl host: structure, stability and selectivity","New Journal of Chemistry","2011","35","7","1556","","10.1039/c1nj20241c","","","0.71073","MoKα","","0.0803","0.0441","","","0.1029","0.1167","","","","","","1.016","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7052695","8.9644","0.0003","9.5296","0.0003","10.7651","0.0004","101.681","0.001","91.685","0.002","114.011","0.002","816.21","0.05","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","1,4-bis(9-hydroxyfluoren-9-yl)benzene. morpholine clathrate","","- C40 H40 N2 O4 -","- C40 H40 N2 O4 -","- C40 H40 N2 O4 -","1","0.5","","Bourne, Susan A.; Corin, Kirsten; Cruickshank, Dyanne L.; Davson, Jessica; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin","Enclathration of bases by a fluorenyl host: structure, stability and selectivity","New Journal of Chemistry","2011","35","7","1556","","10.1039/c1nj20241c","","","0.71073","MoKα","","0.0815","0.0424","","","0.0932","0.1048","","","","","","1.021","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052696","8.8538","0.0003","10.4545","0.0004","17.0843","0.0008","90","","97.838","0.002","90","","1566.58","0.11","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,4-bis(9-hydroxyfluoren-9-yl)benzene. pyridine clathrate","1,4-bis(9-hydroxyfluoren-9-yl)benzene. pyridine clathrate","","- C42 H32 N2 O2 -","- C42 H32 N2 O2 -","- C84 H64 N4 O4 -","2","0.5","","Bourne, Susan A.; Corin, Kirsten; Cruickshank, Dyanne L.; Davson, Jessica; Nassimbeni, Luigi R.; Su, Hong; Weber, Edwin","Enclathration of bases by a fluorenyl host: structure, stability and selectivity","New Journal of Chemistry","2011","35","7","1556","","10.1039/c1nj20241c","","","0.71073","MoKα","","0.0882","0.0399","","","0.0816","0.0935","","","","","","0.899","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052697","13.8523","0.0012","24.2553","0.0011","25.6268","0.0013","90","","100.963","0.006","90","","8453.3","0.9","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C255.85 H119.85 Cl4.3 N13.85 O8 Zn2 -","- C255.846 H119.846 Cl4.308 N13.846 O8 Zn2 -","- C511.692 H239.692 Cl8.616 N27.692 O16 Zn4 -","2","0.5","","Konarev, Dmitri V.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","Magnetic properties and stability of negatively charged doubly bonded C1202− dimers","New Journal of Chemistry","2011","35","9","1829","","10.1039/c1nj20074g","","","0.7107","MoKα","","0.1354","0.0906","","","0.1737","0.1956","","","","","","1.1","","","","has coordinates,has disorder","180080","2020-10-21","18:00:00",""
"7052698","20.103","0.004","18.97","0.004","6.312","0.0013","90","","105.13","0.03","90","","2323.7","0.9","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H14 Cu5 K2 N4 O19 -","- C12 H8 Cu5 K2 N4 O19 -","- C48 H32 Cu20 K8 N16 O76 -","4","0.5","","Lago, Ana B.; Pasán, Jorge; Cañadillas-Delgado, Laura; Fabelo, Oscar; Casado, Francisco J. M.; Julve, Miguel; Lloret, Francesc; Ruiz-Pérez, Catalina","A three-dimensional copper(ii) 12-metallacrown-4 complex with malonomonohydroxamic acid (H3mmh) as a ligand","New Journal of Chemistry","2011","35","9","1817","","10.1039/c1nj20184k","","","0.7513","","","0.1049","0.099","","","0.26","0.2654","","","","","","1.112","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052699","17.3392","0.0002","12.8333","0.0002","30.5957","0.0004","90","","97.517","0.001","90","","6749.62","0.16","100","2","100","2","","","","","","","","10","P 1 21/c 1","-P 2ybc","14","","","","- C64 H71 B Cl2 F20 Fe I Ir O2 P2 -","- C64 H71 B Cl2 F20 Fe I Ir O2 P2 -","- C256 H284 B4 Cl8 F80 Fe4 I4 Ir4 O8 P8 -","4","1","","Walter, Marc D.; White, Peter S.","[Cp′FeI]2 as convenient entry into iron-modified pincer complexes: bimetallic η6,κ1-POCOP-pincer iron iridium compounds","New Journal of Chemistry","2011","35","9","1842","","10.1039/c1nj20399a","","","0.71073","MoKα","","0.0333","0.0254","","","0.0555","0.0581","","","","","","1.025","","","","has coordinates","180080","2020-10-21","18:00:00",""
"7052700","8.285","0.0002","12.3186","0.0002","13.351","0.0002","100.781","0.001","95.673","0.001","104.308","0.001","1281.87","0.04","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H39 I Ir O2 P2 -","- C22 H39 I Ir O2 P2 -","- C44 H78 I2 Ir2 O4 P4 -","2","1","","Walter, Marc D.; White, Peter S.","[Cp′FeI]2 as convenient entry into iron-modified pincer complexes: bimetallic η6,κ1-POCOP-pincer iron iridium compounds","New Journal of Chemistry","2011","35","9","1842","","10.1039/c1nj20399a","","","0.71073","MoKα","","0.0377","0.032","","","0.0654","0.0683","","","","","","1.042","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052701","13.9554","0.0002","18.5992","0.0003","15.2199","0.0003","90","","113.895","0.001","90","","3611.87","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H58 Fe2 I2 -","- C34 H58 Fe2 I2 -","- C136 H232 Fe8 I8 -","4","1","","Walter, Marc D.; White, Peter S.","[Cp′FeI]2 as convenient entry into iron-modified pincer complexes: bimetallic η6,κ1-POCOP-pincer iron iridium compounds","New Journal of Chemistry","2011","35","9","1842","","10.1039/c1nj20399a","","","1.54178","CuKα","","0.0328","0.0296","","","0.0718","0.0734","","","","","","1.068","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052702","20.4092","0.0004","11.168","0.0002","27.512","0.0005","90","","96.086","0.001","90","","6235.5","0.2","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C34 H58 Fe -","- C34 H58 Fe -","- C272 H464 Fe8 -","8","2","","Walter, Marc D.; White, Peter S.","[Cp′FeI]2 as convenient entry into iron-modified pincer complexes: bimetallic η6,κ1-POCOP-pincer iron iridium compounds","New Journal of Chemistry","2011","35","9","1842","","10.1039/c1nj20399a","","","1.54178","CuKα","","0.0617","0.0435","","","0.1004","0.1083","","","","","","1.026","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052703","19.373","0.0005","11.056","0.0003","19.6321","0.0005","90","","104.548","0.002","90","","4070.14","0.19","100","1","100","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H24 F6 N3 P Ru -","- C16 H24 F6 N3 P Ru -","- C128 H192 F48 N24 P8 Ru8 -","8","1","","Trujillo, Alexander; Justaud, Frédéric; Toupet, Loïc; Cador, Olivier; Carrillo, David; Manzur, Carolina; Hamon, Jean-René","New copper(ii)-centered complexes with organometallic donor‒acceptor substituted unsymmetrical Schiff base ligands","New Journal of Chemistry","2011","35","10","2027","","10.1039/c0nj01018a","","","0.71069","MoKα","","0.0307","0.0274","","","0.0798","0.0814","","","","","","1.044","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7052704","8.4612","0.0004","21.2485","0.0009","13.5664","0.0006","90","","91.226","0.003","90","","2438.51","0.19","100","1","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 Br Cu Fe N2 O3 -","- C28 H25 Br Cu Fe N2 O3 -","- C112 H100 Br4 Cu4 Fe4 N8 O12 -","4","1","","Trujillo, Alexander; Justaud, Frédéric; Toupet, Loïc; Cador, Olivier; Carrillo, David; Manzur, Carolina; Hamon, Jean-René","New copper(ii)-centered complexes with organometallic donor‒acceptor substituted unsymmetrical Schiff base ligands","New Journal of Chemistry","2011","35","10","2027","","10.1039/c0nj01018a","","","0.71069","MoKα","","0.0985","0.0376","","","0.0812","0.0922","","","","","","0.642","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052705","6.3749","0.0002","20.3759","0.0006","12.154","0.0003","90","","112.878","0.001","90","","1454.54","0.07","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H9 O5 P S W -","- C11 H9 O5 P S W -","- C44 H36 O20 P4 S4 W4 -","4","1","","Duffy, Matthew P.; Lin, Yuhan; Ting, Liow Yu; Mathey, François","Intramolecular [4+2] versus [2+2] cycloadditions in P‒X‒P-linked biphospholes (X = O, S)","New Journal of Chemistry","2011","35","10","2001","","10.1039/c1nj20087a","","","0.71073","MoKα","","0.0344","0.0285","","","0.063","0.0653","","","","","","1.15","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052706","20.3643","0.0008","6.62","0.0003","20.5323","0.0008","90","","97.883","0.002","90","","2741.8","0.2","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 O10 P2 S W2 -","- C22 H16 O10 P2 S W2 -","- C88 H64 O40 P8 S4 W8 -","4","1","","Duffy, Matthew P.; Lin, Yuhan; Ting, Liow Yu; Mathey, François","Intramolecular [4+2] versus [2+2] cycloadditions in P‒X‒P-linked biphospholes (X = O, S)","New Journal of Chemistry","2011","35","10","2001","","10.1039/c1nj20087a","","","0.71073","MoKα","","0.0586","0.0442","","","0.1049","0.1188","","","","","","1.093","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052707","8.3454","0.0001","9.5569","0.0001","17.296","0.0002","97.99","","98.728","0.001","98.47","","1330.12","0.03","103","2","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H16 O10 P2 S W2 -","- C22 H16 O10 P2 S W2 -","- C44 H32 O20 P4 S2 W4 -","2","1","","Duffy, Matthew P.; Lin, Yuhan; Ting, Liow Yu; Mathey, François","Intramolecular [4+2] versus [2+2] cycloadditions in P‒X‒P-linked biphospholes (X = O, S)","New Journal of Chemistry","2011","35","10","2001","","10.1039/c1nj20087a","","","0.71073","MoKα","","0.0252","0.0209","","","0.0472","0.0488","","","","","","1.054","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052708","11.498","0.006","29.702","0.016","31.391","0.017","90","","97.333","0.005","90","","10633","10","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C106.48 H116.48 Cl2.45 N5 O11 -","- C106.484 H116.484 Cl2.452 N5 O11 -","- C425.936 H465.936 Cl9.808 N20 O44 -","4","1","","Evans, Nicholas H.; Serpell, Christopher J.; Beer, Paul D.","A meta-xylenediamide macrocycle containing rotaxane anion host system constructed by a new synthetic clipping methodology","New Journal of Chemistry","2011","35","10","2047","","10.1039/c1nj20109c","","","0.6889","Synchrotron","","0.2083","0.1371","","0.0895","0.0616","0.0616","","","","","","1.1455","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052709","19.605","0.005","15.173","0.005","23.927","0.005","90","","90","","90","","7117","3","153","2","153","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C62 H72 Br4 Cl0 N4 Pd2 -","- C62 H72 Br4 N4 Pd2 -","- C248 H288 Br16 N16 Pd8 -","4","0.5","","Vasudevan, Kalyan V.; Cowley, Alan H.","New bimetallic complexes supported by a tetrakis(imino)pyracene (TIP) ligand","New Journal of Chemistry","2011","35","10","2043","","10.1039/c1nj20128j","","","0.71069","MoKα","","0.1095","0.0672","","","0.1729","0.1906","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052710","19.46","0.005","15.257","0.005","23.428","0.005","90","","90","","90","","6956","3","153","2","153","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C64 H76 Cl8 N4 Pd2 -","- C62 H72 Cl4 N4 Pd2 -","- C248 H288 Cl16 N16 Pd8 -","4","0.5","","Vasudevan, Kalyan V.; Cowley, Alan H.","New bimetallic complexes supported by a tetrakis(imino)pyracene (TIP) ligand","New Journal of Chemistry","2011","35","10","2043","","10.1039/c1nj20128j","","","0.71069","MoKα","","0.1088","0.0557","","","0.1312","0.1456","","","","","","0.957","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052711","10.37","0.005","22.405","0.005","15.448","0.005","90","","95.681","0.005","90","","3572","2","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C63 H74 Cl2 I6 In2 N4 -","- C62 H72 I6 In2 N4 -","- C124 H144 I12 In4 N8 -","2","0.5","","Vasudevan, Kalyan V.; Cowley, Alan H.","New bimetallic complexes supported by a tetrakis(imino)pyracene (TIP) ligand","New Journal of Chemistry","2011","35","10","2043","","10.1039/c1nj20128j","","","0.71069","MoKα","","0.1168","0.0545","","","0.1248","0.14","","","","","","0.921","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052712","11.676","0.005","17.25","0.005","18.117","0.005","90","","91.994","0.005","90","","3647","2","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H76 Cl10 In2 N4 -","- C62 H72 Cl6 In2 N4 -","- C124 H144 Cl12 In4 N8 -","2","0.5","","Vasudevan, Kalyan V.; Cowley, Alan H.","New bimetallic complexes supported by a tetrakis(imino)pyracene (TIP) ligand","New Journal of Chemistry","2011","35","10","2043","","10.1039/c1nj20128j","","","0.71069","MoKα","","0.0793","0.0478","","","0.1273","0.1377","","","","","","0.998","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052713","10.178","0.005","21.687","0.005","15.394","0.005","90","","92.761","0.005","90","","3394","2","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C63 H74 Br6 Cl2 In2 N4 -","- C62 H72 Br6 In2 N4 -","- C124 H144 Br12 In4 N8 -","2","0.5","","Vasudevan, Kalyan V.; Cowley, Alan H.","New bimetallic complexes supported by a tetrakis(imino)pyracene (TIP) ligand","New Journal of Chemistry","2011","35","10","2043","","10.1039/c1nj20128j","","","0.71069","MoKα","","0.0954","0.051","","","0.0955","0.1049","","","","","","0.993","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052714","7.7765","0.0006","8.343","0.0006","9.3377","0.0008","91.786","0.006","106.387","0.007","90.049","0.006","580.9","0.08","150","2","150","2","","","","","","","","4","P 1","P 1","1","","","","- C11 H14 N4 O2 -","- C11 H14 N4 O2 -","- C22 H28 N8 O4 -","2","2","","Jozak, Thomas; Sun, Yu; Thiel, Werner R.","Synthesis, characterization and co-ordination chemistry of dioxolanedipyrazoles","New Journal of Chemistry","2011","35","10","2114","","10.1039/c1nj20148d","","","1.54184","CuKα","","0.0414","0.0398","","","0.1049","0.1061","","","","","","1.068","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052715","9.8264","0.0002","11.8915","0.0002","16.8036","0.0004","90","","100.463","0.002","90","","1930.86","0.07","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C14 H19 F6 N4 O2 P Pd -","- C14 H19 F6 N4 O2 P Pd -","- C56 H76 F24 N16 O8 P4 Pd4 -","4","2","","Jozak, Thomas; Sun, Yu; Thiel, Werner R.","Synthesis, characterization and co-ordination chemistry of dioxolanedipyrazoles","New Journal of Chemistry","2011","35","10","2114","","10.1039/c1nj20148d","","","1.54184","CuKα","","0.0327","0.0317","","","0.0763","0.0768","","","","","","1.051","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052716","12.4072","0.0001","12.4072","0.0001","39.0374","0.0004","90","","90","","90","","6009.36","0.09","150","2","150","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C62 H88 N8 O4 Rh4 -","- C62 H88 N8 O4 Rh4 -","- C248 H352 N32 O16 Rh16 -","4","0.5","","Jozak, Thomas; Sun, Yu; Thiel, Werner R.","Synthesis, characterization and co-ordination chemistry of dioxolanedipyrazoles","New Journal of Chemistry","2011","35","10","2114","","10.1039/c1nj20148d","","","1.54184","CuKα","","0.0204","0.0197","","","0.0414","0.0416","","","","","","1.059","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052717","23.588","0.004","9.1363","0.0009","13.1639","0.001","90","","90","","90","","2836.9","0.6","200","2","200","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C32 H23 Mn O4 P S -","- C32 H23 Mn O4 P S -","- C128 H92 Mn4 O16 P4 S4 -","4","1","","Rose-Munch, Françoise; Cetiner, Derya; Chavarot-Kerlidou, Murielle; Rose, Eric","Phosphino-substituted (η5-cyclohexadienyl)tricarbonylmanganese complexes: synthesis and structure","New Journal of Chemistry","2011","35","10","2004","","10.1039/c1nj20152b","","","0.71073","MoKα","","0.0594","0.0416","","","0.0947","0.1015","","","","","","1.014","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052718","17.267","0.003","14.598","0.002","31.643","0.005","90","","90","","90","","7976","2","305","2","305","2","","","","","","","","9","P b c a","-P 2ac 2ab","61","","","","- C30 H37 Cl F6 N3 O2 P Ru S2 -","- C30 H37 Cl F6 N3 O2 P Ru S2 -","- C240 H296 Cl8 F48 N24 O16 P8 Ru8 S16 -","8","1","","Duan, Gongping; Wong, Wing-Tak; Yam, Vivian Wing-Wah","Synthesis and photochromic studies of η6-mesitylene ruthenium(ii) complexes bearing N-heterocyclic carbene ligands with the dithienylethene moiety","New Journal of Chemistry","2011","35","10","2267","","10.1039/c1nj20161a","","","0.71073","MoKα","","0.1467","0.0994","","","0.2443","0.2715","","","","","","1.135","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052719","18.598","0.007","17.64","0.007","22.631","0.008","90","","102.867","0.005","90","","7238","5","305","2","305","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C31 H38 Cl F6 N3 O1.5 P Ru S2 -","- C31 H38 Cl F6 N3 O1.5 P Ru S2 -","- C248 H304 Cl8 F48 N24 O12 P8 Ru8 S16 -","8","1","","Duan, Gongping; Wong, Wing-Tak; Yam, Vivian Wing-Wah","Synthesis and photochromic studies of η6-mesitylene ruthenium(ii) complexes bearing N-heterocyclic carbene ligands with the dithienylethene moiety","New Journal of Chemistry","2011","35","10","2267","","10.1039/c1nj20161a","","","0.71073","MoKα","","0.0607","0.0546","","","0.1661","0.1731","","","","","","1.042","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052720","15.0558","0.0004","20.5033","0.0004","13.3843","0.0003","90","","111.011","0.001","90","","3856.94","0.16","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C72 H126 P4 Si4 U2 -","- C72 H126 P4 Si4 U2 -","- C144 H252 P8 Si8 U4 -","2","0.5","","Frey, Alistair S. P.; Cloke, F. Geoffrey N.; Hitchcock, Peter B.; Green, Jennifer C.","Activation of P4 by U(η5-C5Me5)(η8-C8H6(SiiPr3)2-1,4)(THF); the X-ray structure of [U(η5-C5Me5)(η8-C8H6(SiiPr3)2-1,4)]2(μ-η2:η2-P4)","New Journal of Chemistry","2011","35","10","2022","","10.1039/c1nj20163h","","x-ray","0.71073","MoKα","","0.057","0.0368","","","0.0602","0.0649","","","","","","1.069","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052721","20.159","0.003","9.974","0.0013","15.121","0.0019","90","","111.024","0.002","90","","2837.9","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H46 Fe2 N2 -","- C34 H46 Fe2 N2 -","- C136 H184 Fe8 N8 -","4","1","","DeHope, Alan; Mendoza-Espinosa, Daniel; Donnadieu, Bruno; Bertrand, Guy","A persistent (amino)(ferrocenyl)carbene","New Journal of Chemistry","2011","35","10","2037","","10.1039/c1nj20170k","","","0.71073","MoKα","","0.1192","0.0495","","","0.0973","0.1187","","","","","","0.956","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052722","8.526","0.007","34.96","0.03","10.44","0.006","90","","126.26","0.04","90","","2509","4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H41 Fe N S -","- C26 H41 Fe N S -","- C104 H164 Fe4 N4 S4 -","4","1","","DeHope, Alan; Mendoza-Espinosa, Daniel; Donnadieu, Bruno; Bertrand, Guy","A persistent (amino)(ferrocenyl)carbene","New Journal of Chemistry","2011","35","10","2037","","10.1039/c1nj20170k","","","0.71073","MoKα","","0.0381","0.0321","","","0.1099","0.117","","","","","","0.955","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052723","10.513","0.002","15.638","0.001","7.496","0.001","90","","104.45","0.005","90","","1193.4","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H8 Cl2 Co N2 S2 -","- C8 H8 Cl2 Co N2 S2 -","- C32 H32 Cl8 Co4 N8 S8 -","4","0.5","","Lytvynenko, Anton S.; Kolotilov, Sergey V.; Cador, Olivier; Golhen, Stéphane; Ouahab, Lahcène; Pavlishchuk, Vitaly V.","Antiferromagnetic ordering in cobalt(ii) and nickel(ii) 1D coordination polymers with the dithioamide of 1,3-benzenedicarboxylic acid","New Journal of Chemistry","2011","35","10","2179","","10.1039/c1nj20173e","","","0.71069","MoKα","","0.0765","0.0545","","","0.1352","0.1508","","","","","","1.111","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052724","10.61","0.0005","16.175","0.0006","7.508","0.0005","90","","104.83","0.01","90","","1245.58","0.13","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H8 Br2 Co N2 S2 -","- C8 H8 Br2 Co N2 S2 -","- C32 H32 Br8 Co4 N8 S8 -","4","0.5","","Lytvynenko, Anton S.; Kolotilov, Sergey V.; Cador, Olivier; Golhen, Stéphane; Ouahab, Lahcène; Pavlishchuk, Vitaly V.","Antiferromagnetic ordering in cobalt(ii) and nickel(ii) 1D coordination polymers with the dithioamide of 1,3-benzenedicarboxylic acid","New Journal of Chemistry","2011","35","10","2179","","10.1039/c1nj20173e","","","0.71069","MoKα","","0.0791","0.0488","","","0.1144","0.1305","","","","","","1.071","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052725","7.912","0.001","10.124","0.002","13.225","0.002","90","","103.737","0.001","90","","1029","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Br2 N4 Ni S4 -","- C16 H16 Br2 N4 Ni S4 -","- C32 H32 Br4 N8 Ni2 S8 -","2","0.5","","Lytvynenko, Anton S.; Kolotilov, Sergey V.; Cador, Olivier; Golhen, Stéphane; Ouahab, Lahcène; Pavlishchuk, Vitaly V.","Antiferromagnetic ordering in cobalt(ii) and nickel(ii) 1D coordination polymers with the dithioamide of 1,3-benzenedicarboxylic acid","New Journal of Chemistry","2011","35","10","2179","","10.1039/c1nj20173e","","","0.71069","MoKα","","0.103","0.0538","","","0.1208","0.1432","","","","","","1.003","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052726","4.2779","0.0001","14.0489","0.0006","14.9941","0.0007","90","","95.425","0.003","90","","897.11","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N2 S2 -","- C8 H8 N2 S2 -","- C32 H32 N8 S8 -","4","1","","Lytvynenko, Anton S.; Kolotilov, Sergey V.; Cador, Olivier; Golhen, Stéphane; Ouahab, Lahcène; Pavlishchuk, Vitaly V.","Antiferromagnetic ordering in cobalt(ii) and nickel(ii) 1D coordination polymers with the dithioamide of 1,3-benzenedicarboxylic acid","New Journal of Chemistry","2011","35","10","2179","","10.1039/c1nj20173e","","","0.71069","MoKα","","0.1207","0.0602","","","0.1488","0.1849","","","","","","1.018","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052727","11.8868","0.001","9.2279","0.0009","12.5852","0.0007","90","","108.932","0.007","90","","1305.8","0.19","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 Mn O3 -","- C13 H15 Mn O3 -","- C52 H60 Mn4 O12 -","4","1","","Rose, Eric; Dubarle-Offner, Julien; Rose-Munch, Françoise; Gérard, Hélène","A combined experimental‒theoretical study on the lithiation/electrophilic quench reaction of benzylic position of (η5-tetramethylcyclohexadienyl)-Mn(CO)3","New Journal of Chemistry","2011","35","10","2375","","10.1039/c1nj20178f","","","0.71073","MoKα","","0.0593","0.0333","","","0.0727","0.0801","","","","","","1.045","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052728","15.352","0.001","5.7588","0.0003","22.802","0.002","90","","97.678","0.003","90","","1997.8","0.2","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 Fe2 Se2 -","- C22 H22 Fe2 Se2 -","- C88 H88 Fe8 Se8 -","4","1","","Ahmar, Siawash; Nitschke, Christian; Vijayaratnam, Niranjan; MacDonald, Daniel G.; Fenske, Dieter; Corrigan, John F.","A ferrocenylmethylselenolate complex of Ag(i): preparation of the polyferrocenyl cluster [Ag8(SeCH2Fc)8(PPh3)4] from the new silylated reagent FcCH2SeSiMe3","New Journal of Chemistry","2011","35","10","2013","","10.1039/c1nj20183b","","","0.71073","MoKα","","0.1215","0.0486","","","0.0807","0.0998","","","","","","0.94","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052729","17.346","0.004","42.44","0.009","12.596","0.003","90","","133.24","0.03","90","","6755","4","150","2","150","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C42 H62 Cl18 Fe2 N4 Se4 Zn2 -","- C42 H62 Cl18 Fe2 N4 Se4 Zn2 -","- C168 H248 Cl72 Fe8 N16 Se16 Zn8 -","4","1","","Ahmar, Siawash; Nitschke, Christian; Vijayaratnam, Niranjan; MacDonald, Daniel G.; Fenske, Dieter; Corrigan, John F.","A ferrocenylmethylselenolate complex of Ag(i): preparation of the polyferrocenyl cluster [Ag8(SeCH2Fc)8(PPh3)4] from the new silylated reagent FcCH2SeSiMe3","New Journal of Chemistry","2011","35","10","2013","","10.1039/c1nj20183b","","","0.71073","MoKα","","0.0495","0.0414","","","0.1058","0.1312","","","","","","1.148","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052730","29.884","0.0006","44.24","0.0007","22.015","0.0005","90","","130.463","0.001","90","","22144.1","0.8","200","2","200","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C169 H157 Ag8 Cl27 Fe8 P4 Se8 -","- C169 H148 Ag8 Cl27 Fe8 P4 Se8 -","- C676 H592 Ag32 Cl108 Fe32 P16 Se32 -","4","0.5","","Ahmar, Siawash; Nitschke, Christian; Vijayaratnam, Niranjan; MacDonald, Daniel G.; Fenske, Dieter; Corrigan, John F.","A ferrocenylmethylselenolate complex of Ag(i): preparation of the polyferrocenyl cluster [Ag8(SeCH2Fc)8(PPh3)4] from the new silylated reagent FcCH2SeSiMe3","New Journal of Chemistry","2011","35","10","2013","","10.1039/c1nj20183b","","","0.71073","MoKα","","0.1537","0.0791","","","0.2319","0.2922","","","","","","1.054","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052731","9.8776","0.0003","12.0035","0.0004","15.5669","0.0005","90","","92.127","0.002","90","","1844.43","0.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 Fe2 Si -","- C21 H22 Fe2 Si -","- C84 H88 Fe8 Si4 -","4","1","","Losada, José; García-Armada, Pilar; Robles, Víctor; Martínez, Ángel M.; Casado, Carmen M.; Alonso, Beatriz","Carbosilane based dendritic cores functionalized with interacting ferrocenyl units: synthesis and electrocatalytical properties","New Journal of Chemistry","2011","35","10","2187","","10.1039/c1nj20190e","","","1.54178","CuKα","","0.0447","0.0328","","","0.0808","0.0878","","","","","","1.017","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052732","8.766","0.004","9.139","0.004","17.493","0.008","88.637","0.008","82.993","0.007","87.624","0.007","1389.5","1.1","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27.5 H33 B Mn N3 O6 -","- C27.5 H33 B Mn N3 O6 -","- C55 H66 B2 Mn2 N6 O12 -","2","1","","Wu, Kan; Mukherjee, Debabrata; Ellern, Arkady; Sadow, Aaron D.; Geiger, William E.","Anodic electrochemistry of Mn and Re tricarbonyl complexes of tris(oxazolinyl)phenyl borate ligands: comparison to tris(pyrazolyl) borate complexes","New Journal of Chemistry","2011","35","10","2169","","10.1039/c1nj20222g","","","0.71073","MoKα","","0.1181","0.0878","","","0.2461","0.2832","","","","","","1.086","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052733","8.786","0.006","9.096","0.007","17.428","0.011","89.121","0.006","83.015","0.006","87.254","0.006","1380.8","1.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27.5 H33 B N3 O6 Re -","- C27.5 H33 B N3 O6 Re -","- C55 H66 B2 N6 O12 Re2 -","2","1","","Wu, Kan; Mukherjee, Debabrata; Ellern, Arkady; Sadow, Aaron D.; Geiger, William E.","Anodic electrochemistry of Mn and Re tricarbonyl complexes of tris(oxazolinyl)phenyl borate ligands: comparison to tris(pyrazolyl) borate complexes","New Journal of Chemistry","2011","35","10","2169","","10.1039/c1nj20222g","","","0.71073","MoKα","","0.0742","0.0542","","","0.1322","0.1634","","","","","","1.122","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052734","10.1721","0.0006","10.7282","0.0006","17.82","0.0011","90","","102.958","0.001","90","","1895.15","0.19","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","Sad179","","","- C39 H47 B Mn N3 O6 -","- C39 H47 B Mn N3 O6 -","- C78 H94 B2 Mn2 N6 O12 -","2","1","","Wu, Kan; Mukherjee, Debabrata; Ellern, Arkady; Sadow, Aaron D.; Geiger, William E.","Anodic electrochemistry of Mn and Re tricarbonyl complexes of tris(oxazolinyl)phenyl borate ligands: comparison to tris(pyrazolyl) borate complexes","New Journal of Chemistry","2011","35","10","2169","","10.1039/c1nj20222g","","","0.71073","MoKα","","0.036","0.0305","","","0.0754","0.0828","","","","","","1.022","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052735","10.228","0.0017","10.8316","0.0018","18.363","0.003","90","","100.083","0.002","90","","2002.9","0.6","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","Sad174","","","- C41 H51 B N3 O6 Re -","- C41 H51 B N3 O6 Re -","- C82 H102 B2 N6 O12 Re2 -","2","1","","Wu, Kan; Mukherjee, Debabrata; Ellern, Arkady; Sadow, Aaron D.; Geiger, William E.","Anodic electrochemistry of Mn and Re tricarbonyl complexes of tris(oxazolinyl)phenyl borate ligands: comparison to tris(pyrazolyl) borate complexes","New Journal of Chemistry","2011","35","10","2169","","10.1039/c1nj20222g","","","0.71073","MoKα","","0.026","0.0219","","","0.0504","0.0662","","","","","","0.983","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052736","11.882","0.0003","10.2423","0.0002","27.51","0.0007","90","","94.493","0.002","90","","3337.65","0.14","180","2","180","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C34 H40 B Cl F4 Fe N2 Ru S -","- C34 H40 B Cl F4 Fe N2 Ru S -","- C136 H160 B4 Cl4 F16 Fe4 N8 Ru4 S4 -","4","1","","Labande, Agnès; Daran, Jean-Claude; Long, Nicholas J.; White, Andrew J. P.; Poli, Rinaldo","Rhodium(iii) and ruthenium(ii) complexes of redox-active, chelating N-heterocyclic carbene/thioether ligands","New Journal of Chemistry","2011","35","10","2162","","10.1039/c1nj20224c","","","0.71073","MoKα","","0.0811","0.0512","","","0.0969","0.1072","","","","","","1.068","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052737","8.2431","0.0007","8.5307","0.0007","17.2481","0.0014","90","","91.802","0.002","90","","1212.28","0.17","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H35 Cl Ir P -","- C27 H35 Cl Ir P -","- C54 H70 Cl2 Ir2 P2 -","2","1","","Campos, Jesús; Álvarez, Eleuterio; Carmona, Ernesto","Synthesis and reactivity of half-sandwich (η5-C5Me5)Ir(iii) complexes of a cyclometallated aryl phosphine ligand","New Journal of Chemistry","2011","35","10","2122","","10.1039/c1nj20244h","","","0.71073","MoKα","","0.0586","0.0435","","","0.0934","0.0988","","","","","","1.051","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052738","18.1597","0.0009","8.2917","0.0004","16.8404","0.0007","90","","95.143","0.001","90","","2525.5","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 Ir N P S -","- C28 H35 Ir N P S -","- C112 H140 Ir4 N4 P4 S4 -","4","1","","Campos, Jesús; Álvarez, Eleuterio; Carmona, Ernesto","Synthesis and reactivity of half-sandwich (η5-C5Me5)Ir(iii) complexes of a cyclometallated aryl phosphine ligand","New Journal of Chemistry","2011","35","10","2122","","10.1039/c1nj20244h","","","0.71073","MoKα","","0.0397","0.0372","","","0.0988","0.1001","","","","","","1.093","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052739","17.9598","0.0005","8.2824","0.0002","17.0958","0.0005","90","","111.708","0.001","90","","2362.66","0.11","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H36 Ir P -","- C27 H36 Ir P -","- C108 H144 Ir4 P4 -","4","1","","Campos, Jesús; Álvarez, Eleuterio; Carmona, Ernesto","Synthesis and reactivity of half-sandwich (η5-C5Me5)Ir(iii) complexes of a cyclometallated aryl phosphine ligand","New Journal of Chemistry","2011","35","10","2122","","10.1039/c1nj20244h","","","0.71073","MoKα","","0.0326","0.0231","","","0.0519","0.0547","","","","","","1.046","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052740","8.459","0.004","8.524","0.004","17.285","0.008","90","","93.025","0.018","90","","1244.6","1","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H38 Ir P -","- C28 H38 Ir P -","- C56 H76 Ir2 P2 -","2","1","","Campos, Jesús; Álvarez, Eleuterio; Carmona, Ernesto","Synthesis and reactivity of half-sandwich (η5-C5Me5)Ir(iii) complexes of a cyclometallated aryl phosphine ligand","New Journal of Chemistry","2011","35","10","2122","","10.1039/c1nj20244h","","","0.71073","MoKα","","0.0585","0.0333","","","0.0498","0.0542","","","","","","0.87","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052741","9.393","0.0012","15.2074","0.0019","17.202","0.002","90","","98.626","0.002","90","","2429.4","0.5","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H43 Mg N5 Si2 -","- C17 H43 Mg N5 Si2 -","- C68 H172 Mg4 N20 Si8 -","4","1","","Buffet, Jean-Charles; Davin, Julien P.; Spaniol, Thomas P.; Okuda, Jun","Alkaline earth metal amide complexes containing a cyclen-derived (NNNN) macrocyclic ligand: synthesis, structure, and ring-opening polymerization activity towards lactide monomers","New Journal of Chemistry","2011","35","10","2253","","10.1039/c1nj20259f","","","0.71073","MoKα","","0.0624","0.0423","","","0.0976","0.105","","","","","","0.955","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052742","15.8305","0.001","14.9065","0.0009","21.3107","0.0013","90","","90","","90","","5028.8","0.5","130","2","130","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C17 H43 Ca N5 Si2 -","- C17 H43 Ca N5 Si2 -","- C136 H344 Ca8 N40 Si16 -","8","1","","Buffet, Jean-Charles; Davin, Julien P.; Spaniol, Thomas P.; Okuda, Jun","Alkaline earth metal amide complexes containing a cyclen-derived (NNNN) macrocyclic ligand: synthesis, structure, and ring-opening polymerization activity towards lactide monomers","New Journal of Chemistry","2011","35","10","2253","","10.1039/c1nj20259f","","","0.71073","MoKα","","0.0591","0.0358","","","0.0722","0.0778","","","","","","0.86","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052743","19.245","0.002","10.3101","0.001","15.582","0.003","90","","106.38","0.02","90","","2966.3","0.8","130","2","130","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H52 Ca N6 Si4 -","- C19 H52 Ca N6 Si4 -","- C76 H208 Ca4 N24 Si16 -","4","1","","Buffet, Jean-Charles; Davin, Julien P.; Spaniol, Thomas P.; Okuda, Jun","Alkaline earth metal amide complexes containing a cyclen-derived (NNNN) macrocyclic ligand: synthesis, structure, and ring-opening polymerization activity towards lactide monomers","New Journal of Chemistry","2011","35","10","2253","","10.1039/c1nj20259f","","","0.71073","MoKα","","0.0498","0.0392","","","0.0986","0.1085","","","","","","0.914","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052744","11.32","0.0003","14.2718","0.0004","16.4565","0.0004","105.105","0.001","107.197","0.001","95.493","0.001","2408.64","0.11","150","2","150","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C100 H116 Cl8 F12 Fe2 N2 P6 -","- C88 H88 Cl4 F12 Fe2 N2 P6 -","- C88 H88 Cl4 F12 Fe2 N2 P6 -","1","0.5","","Justaud, Frederic; Roisnel, Thierry; Lapinte, Claude","Novel 2,2′-bipyridine containing two (η2-dppe)(η5-C5Me5)Fe‒CC‒ redox-active units with an exceptionally spatially demanding substitution pattern","New Journal of Chemistry","2011","35","10","2219","","10.1039/c1nj20269c","","x-ray","0.71073","MoKα","","0.0846","0.0761","","","0.2255","0.2322","","","","","","1.063","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052745","20.827","0.002","8.7404","0.001","16.227","0.0018","90","","90","","90","","2953.9","0.5","110","2","110","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C32 H38 B F6 Fe P -","- C32 H38 B F6 Fe P -","- C128 H152 B4 F24 Fe4 P4 -","4","1","","Cao, Duxia; Zhao, Haiyan; Gabbaï, François P.","A sandwich complex of trimesitylborane Mes3B: synthesis, characterization and anion binding properties of Mes2B[(η6-Mes)FeCp]+","New Journal of Chemistry","2011","35","10","2299","","10.1039/c1nj20290a","","","0.71073","MoKα","","0.0554","0.0448","","","0.1041","0.1107","","","","","","1.029","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052746","17.1967","0.001","17.6328","0.001","8.535","0.0005","90","","90","","90","","2588","0.3","110","2","110","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C32 H38 B F Fe -","- C32 H38 B F Fe -","- C128 H152 B4 F4 Fe4 -","4","1","","Cao, Duxia; Zhao, Haiyan; Gabbaï, François P.","A sandwich complex of trimesitylborane Mes3B: synthesis, characterization and anion binding properties of Mes2B[(η6-Mes)FeCp]+","New Journal of Chemistry","2011","35","10","2299","","10.1039/c1nj20290a","","","0.71073","MoKα","","0.0508","0.0347","","","0.0581","0.0618","","","","","","0.863","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7052747","14.5594","0.0007","13.9523","0.0006","15.6438","0.0007","90","","96.531","0.001","90","","3157.2","0.2","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H39 B Cl3 Fe N -","- C34 H39 B Cl3 Fe N -","- C136 H156 B4 Cl12 Fe4 N4 -","4","1","","Cao, Duxia; Zhao, Haiyan; Gabbaï, François P.","A sandwich complex of trimesitylborane Mes3B: synthesis, characterization and anion binding properties of Mes2B[(η6-Mes)FeCp]+","New Journal of Chemistry","2011","35","10","2299","","10.1039/c1nj20290a","","","0.71073","MoKα","","0.0544","0.0397","","","0.0988","0.1077","","","","","","1.034","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7052748","11.07","0.005","11.504","0.004","14.202","0.006","90","","104.47","0.05","90","","1751.2","1.3","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H26 Co P -","- C19 H26 Co P -","- C76 H104 Co4 P4 -","4","1","","Janssen (née Kirleis), Karin; Butenschön, Holger","New cyclopentadienylethylphosphane chelate complexes with unsymmetrical phosphane substitution","New Journal of Chemistry","2011","35","10","2287","","10.1039/c1nj20292h","","","0.71073","MoKα","","0.0653","0.0301","","","0.0495","0.0534","","","","","","0.803","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052749","15.428","0.003","16.376","0.005","15.847","0.003","90","","115.182","0.019","90","","3623.2","1.6","297","","297","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 Cl2 Cr P -","- C17 H22 Cl2 Cr P -","- C136 H176 Cl16 Cr8 P8 -","8","2","","Janssen (née Kirleis), Karin; Butenschön, Holger","New cyclopentadienylethylphosphane chelate complexes with unsymmetrical phosphane substitution","New Journal of Chemistry","2011","35","10","2287","","10.1039/c1nj20292h","","","0.71073","MoKα","","0.0863","0.0343","","","0.0516","0.0558","","","","","","0.841","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052750","21.093","0.009","16.109","0.005","21.823","0.006","90","","90","","90","","7415","4","297","","297","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H25 I P Rh -","- C18 H25 I P Rh -","- C288 H400 I16 P16 Rh16 -","16","2","","Janssen (née Kirleis), Karin; Butenschön, Holger","New cyclopentadienylethylphosphane chelate complexes with unsymmetrical phosphane substitution","New Journal of Chemistry","2011","35","10","2287","","10.1039/c1nj20292h","","","0.71073","MoKα","","0.0609","0.0361","","","0.0835","0.0881","","","","","","0.95","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052751","12.144","0.0016","12.7445","0.0016","15.4458","0.0018","90.811","0.015","103.889","0.015","109.156","0.015","2180.9","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","BEDT-Trisphat","","","- C29 H10 Cl14 O6 P S8 -","- C29 H10 Cl14 O6 P S8 -","- C58 H20 Cl28 O12 P2 S16 -","2","1","","Riobé, François; Piron, Flavia; Réthoré, Céline; Madalan, Augustin M.; Gómez-García, Carlos J.; Lacour, Jérôme; Wallis, John D.; Avarvari, Narcis","Radical cation salts of BEDT-TTF, enantiopure tetramethyl-BEDT-TTF, and TTF-Oxazoline (TTF-Ox) donors with the homoleptic TRISPHAT anion","New Journal of Chemistry","2011","35","10","2279","","10.1039/c1nj20310j","","","0.71073","MoKα","","0.1218","0.0481","","","0.086","0.103","","","","","","0.827","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052752","10.2344","0.0012","14.6453","0.0018","16.1178","0.0019","81.546","0.014","75.286","0.014","79.334","0.014","2283.5","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","BEDT-Trisphat","","","- C32 H14 Cl12 N2 O6 P S8 -","- C32 H14 Cl12 N2 O6 P S8 -","- C64 H28 Cl24 N4 O12 P2 S16 -","2","1","","Riobé, François; Piron, Flavia; Réthoré, Céline; Madalan, Augustin M.; Gómez-García, Carlos J.; Lacour, Jérôme; Wallis, John D.; Avarvari, Narcis","Radical cation salts of BEDT-TTF, enantiopure tetramethyl-BEDT-TTF, and TTF-Oxazoline (TTF-Ox) donors with the homoleptic TRISPHAT anion","New Journal of Chemistry","2011","35","10","2279","","10.1039/c1nj20310j","","","0.71073","MoKα","","0.148","0.0496","","","0.0672","0.0799","","","","","","0.688","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052753","11.742","0.0008","12.2491","0.0008","16.3553","0.0012","96.874","0.008","101.997","0.008","104.32","0.007","2192.9","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","[{(R/S)-EDT-TTF-oxazoline}Trisphat]","","","- C32 H14 Cl12 N2 O7 P S6 -","- C32 H14 Cl12 N2 O7 P S6 -","- C64 H28 Cl24 N4 O14 P2 S12 -","2","1","","Riobé, François; Piron, Flavia; Réthoré, Céline; Madalan, Augustin M.; Gómez-García, Carlos J.; Lacour, Jérôme; Wallis, John D.; Avarvari, Narcis","Radical cation salts of BEDT-TTF, enantiopure tetramethyl-BEDT-TTF, and TTF-Oxazoline (TTF-Ox) donors with the homoleptic TRISPHAT anion","New Journal of Chemistry","2011","35","10","2279","","10.1039/c1nj20310j","","","0.7107","MoKα","","0.1562","0.059","","","0.1028","0.1278","","","","","","1.002","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052754","11.5872","0.0008","14.1039","0.0017","17.104","0.002","76.726","0.008","89.191","0.007","67.221","0.007","2499.6","0.5","293","2","293","2","","","","","","","","7","P 1","P 1","1","(S,S,S,S)-TMBEDT-TTF TRISPHAT","","","- C36 H22 Cl12 N2 O6 P S8 -","- C36 H22 Cl12 N2 O6 P S8 -","- C72 H44 Cl24 N4 O12 P2 S16 -","2","2","","Riobé, François; Piron, Flavia; Réthoré, Céline; Madalan, Augustin M.; Gómez-García, Carlos J.; Lacour, Jérôme; Wallis, John D.; Avarvari, Narcis","Radical cation salts of BEDT-TTF, enantiopure tetramethyl-BEDT-TTF, and TTF-Oxazoline (TTF-Ox) donors with the homoleptic TRISPHAT anion","New Journal of Chemistry","2011","35","10","2279","","10.1039/c1nj20310j","","","0.71073","MoKα","","0.1296","0.0522","","","0.0827","0.1034","","","","","","1.014","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052755","11.59","0.0007","14.1051","0.0009","17.1138","0.0008","76.714","0.004","89.17","0.004","67.16","0.005","2500.6","0.3","293","2","293","2","","","","","","","","7","P 1","P 1","1","(R,R,R,R)-TMBEDT-TTF TRISPHAT","","","- C36 H22 Cl12 N2 O6 P S8 -","- C36 H22 Cl12 N2 O6 P S8 -","- C72 H44 Cl24 N4 O12 P2 S16 -","2","2","","Riobé, François; Piron, Flavia; Réthoré, Céline; Madalan, Augustin M.; Gómez-García, Carlos J.; Lacour, Jérôme; Wallis, John D.; Avarvari, Narcis","Radical cation salts of BEDT-TTF, enantiopure tetramethyl-BEDT-TTF, and TTF-Oxazoline (TTF-Ox) donors with the homoleptic TRISPHAT anion","New Journal of Chemistry","2011","35","10","2279","","10.1039/c1nj20310j","","","0.71073","MoKα","","0.134","0.0557","","","0.0752","0.0934","","","","","","1.051","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052756","11.1361","0.0008","14.0517","0.0011","17.3518","0.0013","90","","100.951","0.001","90","","2665.8","0.3","105","","105","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H29 Cl3 N3 O Rh -","- C25 H29 Cl3 N3 O Rh -","- C100 H116 Cl12 N12 O4 Rh4 -","4","1","","Rosenberg, Marianne Lenes; Langseth, Eirin; Krivokapic, Alexander; Gupta, Nalinava Sen; Tilset, Mats","Investigation of ligand steric effects on a highly cis-selective Rh(i) cyclopropanation catalyst","New Journal of Chemistry","2011","35","10","2306","","10.1039/c1nj20343f","","","0.71073","MoKα","","0.0359","0.0268","","0.0374","0.027","0.0262","","","","","","1.1229","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052757","19.641","0.0007","47.28","0.0014","9.725","0.003","90","","90","","90","","9031","3","293","2","293","2","101","1","101","1","","","","6","F d d 2","F 2 -2d","43","","","","- C23 H25 Cl N3 O Rh -","- C23 H25 Cl N3 O Rh -","- C368 H400 Cl16 N48 O16 Rh16 -","16","1","","Rosenberg, Marianne Lenes; Langseth, Eirin; Krivokapic, Alexander; Gupta, Nalinava Sen; Tilset, Mats","Investigation of ligand steric effects on a highly cis-selective Rh(i) cyclopropanation catalyst","New Journal of Chemistry","2011","35","10","2306","","10.1039/c1nj20343f","","","0.71073","MoKα","","0.0253","0.0226","","","0.0515","0.053","","","","","","1.025","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052758","9.8035","0.0007","18.0936","0.0012","10.0847","0.0005","90","","97.542","0.003","90","","1773.35","0.19","110","2","110","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17 Br0.26 Cl0.74 Pd S2 -","- C20 H17 Br0.265 Cl0.735 Pd S2 -","- C80 H68 Br1.06 Cl2.94 Pd4 S8 -","4","1","","Pijnenburg, Niels J. M.; Lutz, Martin; Siegler, Maxime A.; Spek, Anthony; van Koten, Gerard; Gebbink, Robertus J. M. Klein","The role of the dendritic support in the catalytic performance of peripheral pincer Pd-complexes","New Journal of Chemistry","2011","35","10","2356","","10.1039/c1nj20366e","","","0.71073","MoKα","","0.0452","0.0271","","","0.0511","0.0556","","","","","","1.07","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052759","8.6141","0.0002","12.4476","0.0002","22.262","0.0004","90","","90","","90","","2387.04","0.08","110","2","110","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C25 H20 Br0.66 Cl0.34 N O4 Pd S2 -","- C25 H20 Br0.663 Cl0.337 N O4 Pd S2 -","- C100 H80 Br2.652 Cl1.348 N4 O16 Pd4 S8 -","4","1","","Pijnenburg, Niels J. M.; Lutz, Martin; Siegler, Maxime A.; Spek, Anthony; van Koten, Gerard; Gebbink, Robertus J. M. Klein","The role of the dendritic support in the catalytic performance of peripheral pincer Pd-complexes","New Journal of Chemistry","2011","35","10","2356","","10.1039/c1nj20366e","","","0.71073","MoKα","","0.0374","0.0296","","","0.0558","0.0578","","","","","","1.133","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052760","15.8584","0.0002","9.8059","0.0002","16.273","0.0003","90","","113.38","0.0007","90","","2322.77","0.07","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H26 Cl N O Pd S2 -","- C25 H26 Cl N O Pd S2 -","- C100 H104 Cl4 N4 O4 Pd4 S8 -","4","1","","Pijnenburg, Niels J. M.; Lutz, Martin; Siegler, Maxime A.; Spek, Anthony; van Koten, Gerard; Gebbink, Robertus J. M. Klein","The role of the dendritic support in the catalytic performance of peripheral pincer Pd-complexes","New Journal of Chemistry","2011","35","10","2356","","10.1039/c1nj20366e","","","0.71073","MoKα","","0.0493","0.035","","","0.0851","0.0932","","","","","","1.055","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052761","12.57","0.0004","8.7661","0.0003","13.9672","0.0005","90","","90","","90","","1539.04","0.09","90","0.1","90","0.1","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C14 H16 F6 Fe N P -","- C14 H16 F6 Fe N P -","- C56 H64 F24 Fe4 N4 P4 -","4","0.5","","Abd-El-Aziz, Alaa S.; Winram, Diana J.; Shipman, Patrick O.; Dalgakiran, Sibel Sezgin; Shipley, Paul; Bichler, Lukas; Patrick, Brian","Micro and nano-sized polysiloxanes containing organoiron moieties","New Journal of Chemistry","2011","35","10","2341","","10.1039/c1nj20477g","","","0.71073","MoKα","","0.0775","0.0633","","","0.1733","0.1868","","","","","","1.053","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052762","9.4943","0.0009","10.791","0.006","13.2079","0.0017","89.92","0.03","88.507","0.009","86.83","0.02","1350.7","0.8","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H25 Fe3 N O11 S -","- C20 H25 Fe3 N O11 S -","- C40 H50 Fe6 N2 O22 S2 -","2","1","","Miu, Chia-Yeh; Chi, Hsin-Hung; Chen, Szu-Wei; Cherng, Jiann-Jang; Hsu, Miao-Hsing; Huang, Yu-Xin; Shieh, Minghuey","Reactions of the μ3-sulfido triiron cluster [SFe3(CO)9]2− with functionalized organic halides and mercury salts: selective reactivity, electrochemistry, and theoretical calculations","New Journal of Chemistry","2011","35","11","2442","","10.1039/c1nj20279k","","","0.71073","Mokα","","0.0488","0.0261","","","0.0679","0.0761","","","","","","1.019","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052763","18.9216","0.0002","12.3679","0.0002","23.5577","0.0004","90","","92.5182","0.0005","90","","5507.66","0.14","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Cl Fe3 N O9 S -","- C20 H26 Cl Fe3 N O9 S -","- C160 H208 Cl8 Fe24 N8 O72 S8 -","8","2","","Miu, Chia-Yeh; Chi, Hsin-Hung; Chen, Szu-Wei; Cherng, Jiann-Jang; Hsu, Miao-Hsing; Huang, Yu-Xin; Shieh, Minghuey","Reactions of the μ3-sulfido triiron cluster [SFe3(CO)9]2− with functionalized organic halides and mercury salts: selective reactivity, electrochemistry, and theoretical calculations","New Journal of Chemistry","2011","35","11","2442","","10.1039/c1nj20279k","","","0.71073","MoKα","","0.0818","0.0412","","","0.0981","0.1197","","","","","","1.024","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052764","10.9444","0.0012","14.538","0.0016","18.351","0.002","90","","94.977","0.002","90","","2908.8","0.6","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H28 Fe3 I N O9 S -","- C21 H28 Fe3 I N O9 S -","- C84 H112 Fe12 I4 N4 O36 S4 -","4","1","","Miu, Chia-Yeh; Chi, Hsin-Hung; Chen, Szu-Wei; Cherng, Jiann-Jang; Hsu, Miao-Hsing; Huang, Yu-Xin; Shieh, Minghuey","Reactions of the μ3-sulfido triiron cluster [SFe3(CO)9]2− with functionalized organic halides and mercury salts: selective reactivity, electrochemistry, and theoretical calculations","New Journal of Chemistry","2011","35","11","2442","","10.1039/c1nj20279k","","","0.71073","MoKα","","0.0447","0.036","","","0.0801","0.0844","","","","","","1.035","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052765","13.0224","0.0002","8.5294","0.0001","22.1409","0.0003","90","","103.813","0.0009","90","","2388.14","0.06","298","2","298","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","","","- C34 H40 Fe6 Hg N2 O18 S2 -","- C34 H40 Fe6 Hg N2 O18 S2 -","- C68 H80 Fe12 Hg2 N4 O36 S4 -","2","0.5","","Miu, Chia-Yeh; Chi, Hsin-Hung; Chen, Szu-Wei; Cherng, Jiann-Jang; Hsu, Miao-Hsing; Huang, Yu-Xin; Shieh, Minghuey","Reactions of the μ3-sulfido triiron cluster [SFe3(CO)9]2− with functionalized organic halides and mercury salts: selective reactivity, electrochemistry, and theoretical calculations","New Journal of Chemistry","2011","35","11","2442","","10.1039/c1nj20279k","","","0.71073","MoKα","","0.0441","0.0348","","","0.0885","0.0978","","","","","","1.183","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052766","9.3653","0.0002","11.1757","0.0002","13.0749","0.0002","91.087","0.001","94.62","0.001","103.512","0.001","1325.26","0.04","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","","","- C34 H40 Fe6 Hg2 I2 N2 O18 S2 -","- C34 H40 Fe6 Hg2 I2 N2 O18 S2 -","- C34 H40 Fe6 Hg2 I2 N2 O18 S2 -","1","0.5","","Miu, Chia-Yeh; Chi, Hsin-Hung; Chen, Szu-Wei; Cherng, Jiann-Jang; Hsu, Miao-Hsing; Huang, Yu-Xin; Shieh, Minghuey","Reactions of the μ3-sulfido triiron cluster [SFe3(CO)9]2− with functionalized organic halides and mercury salts: selective reactivity, electrochemistry, and theoretical calculations","New Journal of Chemistry","2011","35","11","2442","","10.1039/c1nj20279k","","","0.71073","MoKα","","0.0373","0.0331","","","0.0844","0.0867","","","","","","1.088","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052767","9.834","0.005","10.871","0.005","25.8","0.01","88.42","0.02","83.77","0.02","79.06","0.02","2692","2","100","","100","","","","","","","","","3","P -1","-P 1","2","","","","- C64 H76 P2 -","- C64 H76 P2 -","- C128 H152 P4 -","2","1","","Lejeune, Manuel; Grosshans, Philippe; Berclaz, Théo; Sidorenkova, Helena; Besnard, Céline; Pattison, Phil; Geoffroy, Michel","Role of the aromatic bridge on radical ions formation during reduction of diphosphaalkenes","New Journal of Chemistry","2011","35","11","2510","","10.1039/c1nj20314b","","","0.7","","","0.0748","0.0659","","0.0941","0.0933","0.0941","","","","","","1.1263","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052768","10.185","0.01","17.94","0.005","29.06","0.02","90","","96.79","0.05","90","","5273","7","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C60 H74 P2 -","- C60 H74 P2 -","- C240 H296 P8 -","4","1","","Lejeune, Manuel; Grosshans, Philippe; Berclaz, Théo; Sidorenkova, Helena; Besnard, Céline; Pattison, Phil; Geoffroy, Michel","Role of the aromatic bridge on radical ions formation during reduction of diphosphaalkenes","New Journal of Chemistry","2011","35","11","2510","","10.1039/c1nj20314b","","","0.71073","MoKα","","0.0757","0.0501","","0.0811","0.0696","0.0811","","","","","","0.983","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052769","10.844","0.001","15.52","0.001","17.594","0.002","90","","100.868","0.001","90","","2907.9","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H49 Cl2 Cu2 N6 O8.5 P2 -","- C60 H48 Cl2 Cu2 N6 O8.5 P2 -","- C120 H96 Cl4 Cu4 N12 O17 P4 -","2","0.5","","Ni, Qing-Ling; Jiang, Xuan-Feng; Gui, Liu-Cheng; Wang, Xiu-Jian; Yang, Kun-Guo; Bi, Xian-Shu","Synthesis, structures and characterization of a series of Cu(i)-diimine complexes with labile N,N′-bis((diphenylphosphino)methyl)naphthalene-1,5-diamine: diverse structures directed by π‒π stacking interactions","New Journal of Chemistry","2011","35","11","2471","","10.1039/c1nj20355j","","","0.71073","MoKα","","0.0974","0.0693","","","0.2046","0.2513","","","","","","1.178","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052770","11.155","0.002","11.249","0.002","15.696","0.001","84.503","0.001","75.887","0.006","60.284","0.004","1658.2","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H70 Cl2 Cu2 N8 O10 P2 -","- C70 H70 Cl2 Cu2 N8 O10 P2 -","- C70 H70 Cl2 Cu2 N8 O10 P2 -","1","0.5","","Ni, Qing-Ling; Jiang, Xuan-Feng; Gui, Liu-Cheng; Wang, Xiu-Jian; Yang, Kun-Guo; Bi, Xian-Shu","Synthesis, structures and characterization of a series of Cu(i)-diimine complexes with labile N,N′-bis((diphenylphosphino)methyl)naphthalene-1,5-diamine: diverse structures directed by π‒π stacking interactions","New Journal of Chemistry","2011","35","11","2471","","10.1039/c1nj20355j","","","0.71073","MoKα","","0.1825","0.0956","","","0.1825","0.2136","","","","","","1.073","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052771","13.523","0.002","18.277","0.003","18.648","0.003","90","","90","","90","","4609","1.3","173","2","173","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C51 H47 Cl Cu N5 O5 P2 -","- C51 H47 Cl Cu N5 O5 P2 -","- C204 H188 Cl4 Cu4 N20 O20 P8 -","4","1","","Ni, Qing-Ling; Jiang, Xuan-Feng; Gui, Liu-Cheng; Wang, Xiu-Jian; Yang, Kun-Guo; Bi, Xian-Shu","Synthesis, structures and characterization of a series of Cu(i)-diimine complexes with labile N,N′-bis((diphenylphosphino)methyl)naphthalene-1,5-diamine: diverse structures directed by π‒π stacking interactions","New Journal of Chemistry","2011","35","11","2471","","10.1039/c1nj20355j","","","0.71073","MoKα","","0.0866","0.0565","","","0.1362","0.154","","","","","","1.075","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052772","11.357","0.003","37.356","0.006","12.909","0.002","90","","112.442","0.003","90","","5061.9","1.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48.72 H51.8 Cl2 Cu2 N7 O8.68 P2 -","- C46 H45 Cl2 Cu2 N7 O8 P2 -","- C184 H180 Cl8 Cu8 N28 O32 P8 -","4","1","","Ni, Qing-Ling; Jiang, Xuan-Feng; Gui, Liu-Cheng; Wang, Xiu-Jian; Yang, Kun-Guo; Bi, Xian-Shu","Synthesis, structures and characterization of a series of Cu(i)-diimine complexes with labile N,N′-bis((diphenylphosphino)methyl)naphthalene-1,5-diamine: diverse structures directed by π‒π stacking interactions","New Journal of Chemistry","2011","35","11","2471","","10.1039/c1nj20355j","","","0.71073","MoKα","","0.0781","0.0549","","","0.156","0.168","","","","","","1.079","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052773","10.913","0.001","17.535","0.001","22.068","0.001","86.442","0.001","84.066","0.001","77.951","0.001","4104.2","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C87 H91 Cl2 Cu2 N7 O12 P4 -","- C87 H91 Cl2 Cu2 N7 O12 P4 -","- C174 H182 Cl4 Cu4 N14 O24 P8 -","2","1","","Ni, Qing-Ling; Jiang, Xuan-Feng; Gui, Liu-Cheng; Wang, Xiu-Jian; Yang, Kun-Guo; Bi, Xian-Shu","Synthesis, structures and characterization of a series of Cu(i)-diimine complexes with labile N,N′-bis((diphenylphosphino)methyl)naphthalene-1,5-diamine: diverse structures directed by π‒π stacking interactions","New Journal of Chemistry","2011","35","11","2471","","10.1039/c1nj20355j","","","0.71073","MoKα","","0.1547","0.087","","","0.2211","0.3121","","","","","","1.149","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052774","7.5524","0.0004","12.9084","0.0007","13.112","0.0007","102.326","0.002","94.333","0.002","98.378","0.002","1227.94","0.11","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H17 Cl4 N3 O3 -","- C25 H17 Cl4 N3 O3 -","- C50 H34 Cl8 N6 O6 -","2","1","","Shin, Ji-Young; Dolphin, David","Synthesis of a class of 5-((5-(pyrrol-2-yl-methylene)-pyrrol-2-yl)methylene)furan-2-ones and the formation of a furanone dipyrrin imino ether","New Journal of Chemistry","2011","35","11","2483","","10.1039/c1nj20415g","","","0.71073","MoKα","","0.0574","0.0409","","","0.1008","0.1179","","","","","","1.075","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052775","7.0689","0.0013","9.6348","0.0019","16.074","0.003","94.959","0.007","95.467","0.007","106.429","0.007","1037.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H8 Cl2 F5 N3 O3 -","- C22 H8 Cl2 F5 N3 O3 -","- C44 H16 Cl4 F10 N6 O6 -","2","1","","Shin, Ji-Young; Dolphin, David","Synthesis of a class of 5-((5-(pyrrol-2-yl-methylene)-pyrrol-2-yl)methylene)furan-2-ones and the formation of a furanone dipyrrin imino ether","New Journal of Chemistry","2011","35","11","2483","","10.1039/c1nj20415g","","","0.71073","MoKα","","0.0456","0.0347","","","0.0926","0.1019","","","","","","0.99","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052776","24.575","0.005","13.191","0.003","31.096","0.006","90","","91.925","0.004","90","","10075","4","298","2","298","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C42 H44 F21 N0 O7 Yb -","- C42 H40.5 F21 O7 Yb -","- C336 H324 F168 O56 Yb8 -","8","2","","Lin, Yiji; Wan, Shigang; Zou, Fang; Wang, Yuekui; Zhang, Hui","Structure–chiroptical property relationship of kinetically labile camphor-derivative β-diketone Yb(iii) complexes: do the adducts coexist as diastereomers or not?","New Journal of Chemistry","2011","35","11","2584","","10.1039/c1nj20430k","","","0.71073","MoKα","","0.0636","0.0481","","","0.1055","0.111","","","","","","0.977","","","","has coordinates","282882","2023-04-27","15:29:02",""
"7052777","24.573","0.006","13.207","0.003","31.227","0.008","90","","92.072","0.005","90","","10128","4","298","2","298","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C42 H44 F21 N0 O7 Yb -","- C42 H40.5 F21 O7 Yb -","- C336 H324 F168 O56 Yb8 -","8","2","","Lin, Yiji; Wan, Shigang; Zou, Fang; Wang, Yuekui; Zhang, Hui","Structure–chiroptical property relationship of kinetically labile camphor-derivative β-diketone Yb(iii) complexes: do the adducts coexist as diastereomers or not?","New Journal of Chemistry","2011","35","11","2584","","10.1039/c1nj20430k","","","0.71073","MoKα","","0.1183","0.0716","","","0.1472","0.1616","","","","","","0.904","","","","has coordinates","282882","2023-04-27","15:29:03",""
"7052778","14.862","0.002","14.862","0.002","34.432","0.008","90","","90","","120","","6586","2","298","2","298","2","","","","","","","","7","P 31","P 31","144","","","","- C84.33 H78.33 Cl F21 O8 P2 Yb -","- C78 H69 F21 O8 P2 Yb -","- C234 H207 F63 O24 P6 Yb3 -","3","1","","Lin, Yiji; Wan, Shigang; Zou, Fang; Wang, Yuekui; Zhang, Hui","Structure–chiroptical property relationship of kinetically labile camphor-derivative β-diketone Yb(iii) complexes: do the adducts coexist as diastereomers or not?","New Journal of Chemistry","2011","35","11","2584","","10.1039/c1nj20430k","","","0.71073","MoKα","","0.0776","0.0653","","","0.1761","0.186","","","","","","1.009","","","","has coordinates,has disorder","282882","2023-04-27","15:29:03",""
"7052779","14.8","0.003","14.8","0.003","34.447","0.011","90","","90","","120","","6534","3","298","2","298","2","","","","","","","","8","P 32","P 32","145","","","","- C84.33 H78.33 Cl F21 N0 O8 P2 Yb -","- C78 H69 F21 O8 P2 Yb -","- C234 H207 F63 O24 P6 Yb3 -","3","1","","Lin, Yiji; Wan, Shigang; Zou, Fang; Wang, Yuekui; Zhang, Hui","Structure–chiroptical property relationship of kinetically labile camphor-derivative β-diketone Yb(iii) complexes: do the adducts coexist as diastereomers or not?","New Journal of Chemistry","2011","35","11","2584","","10.1039/c1nj20430k","","","0.71073","MoKα","","0.0713","0.0622","","","0.1677","0.1759","","","","","","1.164","","","","has coordinates","282882","2023-04-27","15:29:03",""
"7052780","13.5264","0.0013","13.5264","","24.608","0.002","90","","90","","120","","3899.2","0.5","100","2","100","2","","","","","","","synthesis as described","4","R 3 c :H","R 3 -2""c","161","","","","- C27 H15 N3 O3 -","- C27 H15 N3 O3 -","- C162 H90 N18 O18 -","6","0.333333","","Argouarch, Gilles; Veillard, Romain; Roisnel, Thierry; Amar, Anissa; Boucekkine, Abdou; Singh, Anu; Ledoux, Isabelle; Paul, Frédéric","Donor-substituted triaryl-1,3,5-triazinanes-2,4,6-triones: octupolar NLO-phores with a remarkable transparency‒nonlinearity trade-off","New Journal of Chemistry","2011","35","11","2409","","10.1039/c1nj20442d","","x-ray","0.71073","MoKα","","0.072","0.0693","","","0.1716","0.1732","","","","","","1.162","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052781","8.4168","0.0005","9.9909","0.0008","10.6003","0.0009","107.361","0.007","104.961","0.006","107.851","0.006","747.45","0.12","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H14 N P -","- C19 H14 N P -","- C38 H28 N2 P2 -","2","1","","Reis, Andreas; Dehe, Daniel; Farsadpour, Saeid; Munstein, Isabel; Sun, Yu; Thiel, Werner R.","Fluoride catalyzed P‒aryl-coupling—a mild approach to functionalized arylphosphines","New Journal of Chemistry","2011","35","11","2488","","10.1039/c1nj20448c","","","1.54184","CuKα","","0.0388","0.0321","","","0.0859","0.0881","","","","","","0.979","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052782","7.8941","0.0002","28.695","0.0007","7.0857","0.0002","90","","97.221","0.003","90","","1592.33","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 O2 P -","- C19 H15 O2 P -","- C76 H60 O8 P4 -","4","1","","Reis, Andreas; Dehe, Daniel; Farsadpour, Saeid; Munstein, Isabel; Sun, Yu; Thiel, Werner R.","Fluoride catalyzed P‒aryl-coupling—a mild approach to functionalized arylphosphines","New Journal of Chemistry","2011","35","11","2488","","10.1039/c1nj20448c","","","1.54184","CuKα","","0.049","0.0415","","","0.1164","0.1303","","","","","","1.123","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052783","13.6805","0.0003","14.5594","0.0003","17.2394","0.0004","77.117","0.001","71.508","0.001","71.698","0.001","3062.57","0.12","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C74 H66 Cl2 N O3 P3 Ru -","- C74 H66 Cl2 N O3 P3 Ru -","- C148 H132 Cl4 N2 O6 P6 Ru2 -","2","1","","Widaman, Andria K.; Rath, Nigam P.; Bauer, Eike B.","New five-coordinate Ru(ii) phosphoramidite complexes and their catalytic activity in propargylic amination reactions","New Journal of Chemistry","2011","35","11","2427","","10.1039/c1nj20520j","","","0.71073","MoKα","","0.0619","0.0445","","","0.1148","0.1334","","","","","","1.123","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052784","11.115","0.005","12.085","0.005","13.476","0.005","67.905","0.005","86.187","0.005","73.358","0.005","1605.2","1.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H26 Cl2 N2 S -","- C42 H26 Cl2 N2 S -","- C84 H52 Cl4 N4 S2 -","2","1","","Paul, Nidhin; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai","A green protocol for the synthesis of conformationally rigid sulfur linked bisquinolines by double Friedlander reaction in water","New Journal of Chemistry","2011","35","11","2607","","10.1039/c1nj20539k","","","0.71073","MoKα","","0.0913","0.0657","","","0.1754","0.2521","","","","","","1.173","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052785","20.036","0.003","8.2313","0.0013","21.197","0.005","90","","115.113","0.008","90","","3165.4","1","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H26 Cl2 N2 S -","- C42 H26 Cl2 N2 S -","- C168 H104 Cl8 N8 S4 -","4","1","","Paul, Nidhin; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai","A green protocol for the synthesis of conformationally rigid sulfur linked bisquinolines by double Friedlander reaction in water","New Journal of Chemistry","2011","35","11","2607","","10.1039/c1nj20539k","","","1.54178","CuKα","","0.0783","0.0496","","","0.1179","0.1304","","","","","","1.041","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052786","10.422","0.005","13.304","0.006","13.766","0.006","76.543","0.005","83.59","0.005","70.965","0.004","1753.5","1.4","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H24 Cl4 N2 S2 -","- C42 H24 Cl4 N2 S2 -","- C84 H48 Cl8 N4 S4 -","2","1","","Paul, Nidhin; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai","A green protocol for the synthesis of conformationally rigid sulfur linked bisquinolines by double Friedlander reaction in water","New Journal of Chemistry","2011","35","11","2607","","10.1039/c1nj20539k","","","0.71073","MoKα","","0.0463","0.0401","","","0.0951","0.0986","","","","","","1.028","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052787","10.77497","0.00019","6.30036","0.00011","12.5202","0.0007","90","","92.0681","0.0009","90","","849.4","0.05","93.1","","93.1","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H17 F3 N2 O3 -","- C18 H17 F3 N2 O3 -","- C36 H34 F6 N4 O6 -","2","1","","Huang, Yiyong; Suzuki, Satoru; Liu, Guokai; Tokunaga, Etsuko; Shiro, Motoo; Shibata, Norio","Asymmetric synthesis of chiral trifluoromethylated heliotridane via highly catalytic asymmetric Friedel‒Crafts alkylation with β-trifluoromethylated acrylates and pyrroles","New Journal of Chemistry","2011","35","11","2614","","10.1039/c1nj20550a","","","1.54187","CuKα","","","0.0243","","","","0.0617","","","","","","1.049","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052788","26.5305","0.0005","12.1202","0.0003","22.0169","0.0004","90","","94.01","0.002","90","","7062.3","0.3","180","2","180","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C85 H76 Cl2 I N4 P2 Rh -","- C85 H76 Cl2 I N4 P2 Rh -","- C340 H304 Cl8 I4 N16 P8 Rh4 -","4","0.5","","Bond, Andrew D.; Sanders, Jeremy K. M.; Stulz, Eugen","Ruthenium(ii) and rhodium(iii) porphyrin phosphine complexes: influence of substitution pattern on structure and electronic properties","New Journal of Chemistry","2011","35","11","2691","","10.1039/c1nj20598f","","","0.71073","MoKα","","0.0509","0.0342","","","0.0825","0.0979","","","","","","1.137","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052789","12.0257","0.0003","15.2154","0.0003","16.3438","0.0005","102.144","0.001","98.439","0.001","111.559","0.001","2635.21","0.12","220","2","220","2","","","","","","","","6","P -1","-P 1","2","","","","- C121 H134 I N4 P2 Rh -","- C121 H134 I N4 P2 Rh -","- C121 H134 I N4 P2 Rh -","1","0.5","","Bond, Andrew D.; Sanders, Jeremy K. M.; Stulz, Eugen","Ruthenium(ii) and rhodium(iii) porphyrin phosphine complexes: influence of substitution pattern on structure and electronic properties","New Journal of Chemistry","2011","35","11","2691","","10.1039/c1nj20598f","","","0.71073","MoKα","","0.0893","0.0713","","","0.1859","0.2173","","","","","","1.046","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052790","11.5833","0.0003","12.2478","0.0003","13.1535","0.0003","96.18","0.001","110.866","0.001","113.422","0.001","1530.94","0.07","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H74 N4 P2 Ru -","- C76 H74 N4 P2 Ru -","- C76 H74 N4 P2 Ru -","1","0.5","","Bond, Andrew D.; Sanders, Jeremy K. M.; Stulz, Eugen","Ruthenium(ii) and rhodium(iii) porphyrin phosphine complexes: influence of substitution pattern on structure and electronic properties","New Journal of Chemistry","2011","35","11","2691","","10.1039/c1nj20598f","","","0.71073","MoKα","","0.045","0.0366","","","0.0828","0.0868","","","","","","1.049","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052791","11.0429","0.0002","13.5072","0.0002","13.9191","0.0003","62.832","0.001","80.91","0.001","68.659","0.001","1720.36","0.06","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C85 H75 Cl3 N4 P2 Ru -","- C85 H75 Cl3 N4 P2 Ru -","- C85 H75 Cl3 N4 P2 Ru -","1","0.5","","Bond, Andrew D.; Sanders, Jeremy K. M.; Stulz, Eugen","Ruthenium(ii) and rhodium(iii) porphyrin phosphine complexes: influence of substitution pattern on structure and electronic properties","New Journal of Chemistry","2011","35","11","2691","","10.1039/c1nj20598f","","","0.7107","MoKα","","0.0579","0.0431","","","0.0862","0.0929","","","","","","1.032","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052792","23.561","0.0002","13.175","0.0001","61.8138","0.0005","90","","99.249","0.001","90","","18938.5","0.3","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C84 H58 N4 P2 Ru -","- C84 H58 N4 P2 Ru -","- C1008 H696 N48 P24 Ru12 -","12","1.5","","Bond, Andrew D.; Sanders, Jeremy K. M.; Stulz, Eugen","Ruthenium(ii) and rhodium(iii) porphyrin phosphine complexes: influence of substitution pattern on structure and electronic properties","New Journal of Chemistry","2011","35","11","2691","","10.1039/c1nj20598f","","","0.71073","MoKα","","0.0715","0.0455","","","0.1078","0.1205","","","","","","1.068","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052793","9.3459","0.0015","17.513","0.003","30.135","0.005","77.197","0.014","86.123","0.014","84.763","0.013","4783.9","1.4","210","2","210","2","","","","","","","","5","P -1","-P 1","2","Bis(hexadecyltrimethyammonium)tetrabromocuprate(ii)","Bis(hexadecyltrimethyammonium)tetrabromocuprate(II)","","- C38 H84 Br4 Cu N2 -","- C38 H84 Br4 Cu N2 -","- C152 H336 Br16 Cu4 N8 -","4","2","","Farra, Ramzi; Thiel, Kerstin; Winter, Alette; Klamroth, Tillmann; Pöppl, Andreas; Kelling, Alexandra; Schilde, Uwe; Taubert, Andreas; Strauch, Peter","Tetrahalidocuprates(ii)—structure and EPR spectroscopy. Part 1: Tetrabromidocuprates(ii)","New Journal of Chemistry","2011","35","12","2793","","10.1039/c1nj20271e","","","0.71073","MoKα","","0.2","0.0719","","","0.1516","0.193","","","","","","0.819","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052794","10.8617","0.0017","19.554","0.002","21.072","0.003","90","","91.914","0.012","90","","4473","1.1","210","2","210","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(tetraphenylphosphonium)tetrabromocuprate(II)","","- C48 H40 Br4 Cu P2 -","- C48 H40 Br4 Cu P2 -","- C192 H160 Br16 Cu4 P8 -","4","0.5","","Farra, Ramzi; Thiel, Kerstin; Winter, Alette; Klamroth, Tillmann; Pöppl, Andreas; Kelling, Alexandra; Schilde, Uwe; Taubert, Andreas; Strauch, Peter","Tetrahalidocuprates(ii)—structure and EPR spectroscopy. Part 1: Tetrabromidocuprates(ii)","New Journal of Chemistry","2011","35","12","2793","","10.1039/c1nj20271e","","","0.71073","MoKα","","0.0821","0.0457","","","0.0869","0.0961","","","","","","0.91","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052795","8.9966","0.0011","24.702","0.003","17.481","0.002","90","","101.553","0.01","90","","3806.2","0.8","210","2","210","2","","","","","","","","5","C 1 c 1","C -2yc","9","","Bis(methyltriphenylphosphonium)tetrabromocuprate(II)","","- C38 H36 Br4 Cu P2 -","- C38 H36 Br4 Cu P2 -","- C152 H144 Br16 Cu4 P8 -","4","1","","Farra, Ramzi; Thiel, Kerstin; Winter, Alette; Klamroth, Tillmann; Pöppl, Andreas; Kelling, Alexandra; Schilde, Uwe; Taubert, Andreas; Strauch, Peter","Tetrahalidocuprates(ii)—structure and EPR spectroscopy. Part 1: Tetrabromidocuprates(ii)","New Journal of Chemistry","2011","35","12","2793","","10.1039/c1nj20271e","","","0.71073","MoKα","","0.0705","0.0527","","","0.1301","0.1408","","","","","","0.993","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052796","18.6843","0.0011","10.2238","0.0006","28.5236","0.0015","90","","91.612","0.005","90","","5446.6","0.5","210","2","210","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(benzyltriphenylphosphonium)tetrabromocuprate(II) chloroform solvate","","- C52 H46 Br4 Cl6 Cu P2 -","- C52 H46 Br4 Cl6 Cu P2 -","- C208 H184 Br16 Cl24 Cu4 P8 -","4","1","","Farra, Ramzi; Thiel, Kerstin; Winter, Alette; Klamroth, Tillmann; Pöppl, Andreas; Kelling, Alexandra; Schilde, Uwe; Taubert, Andreas; Strauch, Peter","Tetrahalidocuprates(ii)—structure and EPR spectroscopy. Part 1: Tetrabromidocuprates(ii)","New Journal of Chemistry","2011","35","12","2793","","10.1039/c1nj20271e","","","0.71073","MoKα","","0.0543","0.0321","","","0.0662","0.0717","","","","","","0.91","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052797","9.4245","0.0002","9.9653","0.0002","13.9428","0.0003","84.353","0.001","88.257","0.001","89.524","0.001","1302.5","0.05","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H29 N5 O2 -","- C31 H29 N5 O2 -","- C62 H58 N10 O4 -","2","1","","Goswami, Shyamaprosad; Das, Nirmal Kumar; Sen, Debabrata; Hazra, Giridhari; Goh, Jia Hao; Sing, Yeap Chin; Fun, Hoong-Kun","Recognition of acids involved in Krebs cycle by 9-anthrylmethyl-di(6-acetylamino-2-picolyl)amine: a case of selective fluorescence enhancement for maleic acid","New Journal of Chemistry","2011","35","12","2811","","10.1039/c1nj20339h","","","0.71073","MoKα","","0.0944","0.0551","","","0.1365","0.1579","","","","","","1.055","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052798","9.368","0.0002","9.576","0.0003","16.6792","0.0005","79.7","0.002","77.133","0.002","66.303","0.002","1328.99","0.07","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H29 N5 O2 -","- C31 H29 N5 O2 -","- C62 H58 N10 O4 -","2","1","","Goswami, Shyamaprosad; Das, Nirmal Kumar; Sen, Debabrata; Hazra, Giridhari; Goh, Jia Hao; Sing, Yeap Chin; Fun, Hoong-Kun","Recognition of acids involved in Krebs cycle by 9-anthrylmethyl-di(6-acetylamino-2-picolyl)amine: a case of selective fluorescence enhancement for maleic acid","New Journal of Chemistry","2011","35","12","2811","","10.1039/c1nj20339h","","","0.71073","MoKα","","0.0867","0.0538","","","0.1276","0.1453","","","","","","1.054","","","","has coordinates","180081","2020-10-21","18:00:00",""
"7052799","13.9724","0.0004","32.9044","0.0009","8.6563","0.0002","90","","101.086","0.002","90","","3905.5","0.18","100","0.1","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C41 H41 N5 O13 -","- C41 H41 N5 O13 -","- C164 H164 N20 O52 -","4","1","","Goswami, Shyamaprosad; Das, Nirmal Kumar; Sen, Debabrata; Hazra, Giridhari; Goh, Jia Hao; Sing, Yeap Chin; Fun, Hoong-Kun","Recognition of acids involved in Krebs cycle by 9-anthrylmethyl-di(6-acetylamino-2-picolyl)amine: a case of selective fluorescence enhancement for maleic acid","New Journal of Chemistry","2011","35","12","2811","","10.1039/c1nj20339h","","","0.71073","MoKα","","0.1429","0.0872","","","0.2207","0.257","","","","","","1.047","","","","has coordinates,has disorder","180081","2020-10-21","18:00:00",""
"7052800","16.404","0.005","8.524","0.005","24.609","0.005","90","0.005","105.465","0.005","90","0.005","3316","2","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","LMBNa","","","- C32 H28 B2 Na2 O14 -","- C32 H24 B2 Na2 O14 -","- C128 H96 B8 Na8 O56 -","4","1","","Sun, Zhihua; Chen, Tianliang; Cai, Ning-ning; Chen, Jing-wei; Li, Lina; Wang, Yan; Luo, Junhua; Hong, Maochun","Synthesis, growth and characterization of a third-order nonlinear optical crystal based on the borate ester with sodium supporting its structural framework","New Journal of Chemistry","2011","35","12","2804","","10.1039/c1nj20420c","","","0.71069","MoKα","","0.0875","0.0719","","","0.1977","0.2171","","","","","","1.066","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052801","16.2846","0.0019","8.488","0.001","24.322","0.003","90","","105.077","0.001","90","","3246.2","0.7","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","LMBNa","","","- C16 H14.5 B Na O7.25 -","- C16 H12 B Na O7.25 -","- C128 H96 B8 Na8 O58 -","8","2","","Sun, Zhihua; Chen, Tianliang; Cai, Ning-ning; Chen, Jing-wei; Li, Lina; Wang, Yan; Luo, Junhua; Hong, Maochun","Synthesis, growth and characterization of a third-order nonlinear optical crystal based on the borate ester with sodium supporting its structural framework","New Journal of Chemistry","2011","35","12","2804","","10.1039/c1nj20420c","","","0.71073","MoKα","","0.0495","0.0391","","","0.0907","0.097","","","","","","1.03","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44",""
"7052802","10.9096","0.0006","11.1052","0.0005","20.2561","0.001","102.897","0.003","94.369","0.003","107.657","0.002","2252","0.2","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C56 H53 Fe P3 -","- C56 H53 Fe P3 -","- C112 H106 Fe2 P6 -","2","1","","Grelaud, Guillaume; Tohmé, Ayham; Argouarch, Gilles; Roisnel, Thierry; Paul, Frédéric","Stille-type aryl‒aryl cross-coupling catalysis using triarylphosphine ligands with electron-rich Fe(ii)-alkynyl substituents","New Journal of Chemistry","2011","35","12","2740","","10.1039/c1nj20480g","","x-ray","0.71073","MoKα","","0.1037","0.0634","","","0.1103","0.1268","","","","","","1.017","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052803","12.278","0.0004","21.9742","0.001","16.8487","0.0007","90","","103.994","0.002","90","","4410.9","0.3","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C56 H53 Fe P3 -","- C56 H53 Fe P3 -","- C224 H212 Fe4 P12 -","4","1","","Grelaud, Guillaume; Tohmé, Ayham; Argouarch, Gilles; Roisnel, Thierry; Paul, Frédéric","Stille-type aryl‒aryl cross-coupling catalysis using triarylphosphine ligands with electron-rich Fe(ii)-alkynyl substituents","New Journal of Chemistry","2011","35","12","2740","","10.1039/c1nj20480g","","x-ray","0.71073","MoKα","","0.0721","0.0497","","","0.0943","0.1038","","","","","","1.031","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052804","24.921","0.004","25.341","0.004","41.507","0.007","90","","90","","90","","26213","7","150","2","150","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C52 H108 Lu N9 O6 S4 -","- C52 H108 Lu N9 O6 S4 -","- C832 H1728 Lu16 N144 O96 S64 -","16","0.5","","Lozano-Rodriguez, M. J.; Copping, R.; Petit, S.; Solari, P. L.; Guilbaud, P.; Mustre de Leon, J.; Den Auwer, C.","Crystal structure versus solution for two new lutetium thiocyanato complexes","New Journal of Chemistry","2011","35","12","2755","","10.1039/c1nj20494g","","","0.71073","MoKα","","0.0324","0.028","","","0.0723","0.0761","","","","","","1.056","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052805","24.969","0.003","6.4026","0.0007","20.031","0.002","90","","122.367","0.001","90","","2704.8","0.5","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C7 H12 K4 Lu N7 O6 S7 -","- C7 H12 K4 Lu N7 O6 S7 -","- C28 H48 K16 Lu4 N28 O24 S28 -","4","0.5","","Lozano-Rodriguez, M. J.; Copping, R.; Petit, S.; Solari, P. L.; Guilbaud, P.; Mustre de Leon, J.; Den Auwer, C.","Crystal structure versus solution for two new lutetium thiocyanato complexes","New Journal of Chemistry","2011","35","12","2755","","10.1039/c1nj20494g","","","0.71073","MoKα","","0.0138","0.0137","","","0.0326","0.0327","","","","","","1.174","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052806","25.262","0.005","6.4877","0.0012","20.045","0.004","90","","122.25","0.001","90","","2778.4","0.9","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C7 H12 K4 N7 Nd O6 S7 -","- C7 H12 K4 N7 Nd O6 S7 -","- C28 H48 K16 N28 Nd4 O24 S28 -","4","0.5","","Lozano-Rodriguez, M. J.; Copping, R.; Petit, S.; Solari, P. L.; Guilbaud, P.; Mustre de Leon, J.; Den Auwer, C.","Crystal structure versus solution for two new lutetium thiocyanato complexes","New Journal of Chemistry","2011","35","12","2755","","10.1039/c1nj20494g","","","0.71073","MoKα","","0.0194","0.0173","","","0.0408","0.0415","","","","","","1.091","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052807","7.5153","0.0003","12.426","0.0004","8.7794","0.0003","90","","90.94","0.002","90","","819.75","0.05","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","3-acetyl-4-oxopentanoic acid","3-acetyl-4-oxopentanoic acid","","- C7 H10 O4 -","- C7 H10 O4 -","- C28 H40 O16 -","4","1","","Ferrari, Erika; Saladini, Monica; Pignedoli, Francesca; Spagnolo, Ferdinando; Benassi, Rois","Solvent effect on keto‒enol tautomerism in a new β-diketone: a comparison between experimental data and different theoretical approaches","New Journal of Chemistry","2011","35","12","2840","","10.1039/c1nj20576e","","","0.71073","MoKα","","0.0647","0.0453","","","0.1485","0.1718","","","","","","0.772","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052808","10.7684","0.0004","11.9449","0.0006","11.2266","0.0006","90","","96.833","0.002","90","","1433.79","0.12","203","","203","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H38 Cu2 N2 O6 P2 S4 -","- C16 H38 Cu2 N2 O6 P2 S4 -","- C32 H76 Cu4 N4 O12 P4 S8 -","2","0.5","","Afzaal, Mohammad; Rosenberg, Chico L.; Malik, Mohammad A.; White, Andrew J. P.; O'Brien, Paul","Phosphine stabilized copper(i) complexes of dithiocarbamates and xanthates and their decomposition pathways","New Journal of Chemistry","2011","35","12","2773","","10.1039/c1nj20586b","","","1.54178","CuKα","","0.0393","0.0334","","","0.0814","0.084","","","","","","1.054","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052809","10.1476","0.0006","12.1434","0.0008","12.1663","0.0009","90","","111.287","0.004","90","","1396.92","0.17","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H38 Cu2 N2 P2 S4 -","- C16 H38 Cu2 N2 P2 S4 -","- C32 H76 Cu4 N4 P4 S8 -","2","0.5","","Afzaal, Mohammad; Rosenberg, Chico L.; Malik, Mohammad A.; White, Andrew J. P.; O'Brien, Paul","Phosphine stabilized copper(i) complexes of dithiocarbamates and xanthates and their decomposition pathways","New Journal of Chemistry","2011","35","12","2773","","10.1039/c1nj20586b","","","1.54178","CuKα","","0.0658","0.0512","","","0.1329","0.1413","","","","","","1.055","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052810","11.0675","0.0012","11.4557","0.0013","12.6537","0.0017","90","","92.088","0.008","90","","1603.2","0.3","183","","183","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H50 Cu2 N2 P2 S4 -","- C22 H50 Cu2 N2 P2 S4 -","- C44 H100 Cu4 N4 P4 S8 -","2","0.5","","Afzaal, Mohammad; Rosenberg, Chico L.; Malik, Mohammad A.; White, Andrew J. P.; O'Brien, Paul","Phosphine stabilized copper(i) complexes of dithiocarbamates and xanthates and their decomposition pathways","New Journal of Chemistry","2011","35","12","2773","","10.1039/c1nj20586b","","","0.71073","MoKα","","0.0499","0.0353","","","0.0761","0.0804","","","","","","1.021","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052811","11.1882","0.0003","12.8593","0.0003","23.246","0.0006","90","","94.891","0.001","90","","3332.28","0.15","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H49 Ir N2 O2 P2 -","- C33 H49 Ir N2 O2 P2 -","- C132 H196 Ir4 N8 O8 P8 -","4","1","","Walter, Marc D.; White, Peter S.; Schauer, Cynthia K.; Brookhart, Maurice","The quest for stable σ-methane complexes: computational and experimental studies","New Journal of Chemistry","2011","35","12","2884","","10.1039/c1nj20602h","","","1.54178","CuKα","","0.0313","0.0257","","","0.0616","0.0641","","","","","","1.028","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052812","13.7687","0.0005","23.5697","0.0009","19.7027","0.0007","90","","98.591","0.002","90","","6322.3","0.4","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C55 H56 B Cl2 F24 N O2 P2 Pd -","- C55 H56 B Cl2 F24 N O2 P2 Pd -","- C220 H224 B4 Cl8 F96 N4 O8 P8 Pd4 -","4","1","","Walter, Marc D.; White, Peter S.; Schauer, Cynthia K.; Brookhart, Maurice","The quest for stable σ-methane complexes: computational and experimental studies","New Journal of Chemistry","2011","35","12","2884","","10.1039/c1nj20602h","","","1.54178","CuKα","","0.0502","0.0463","","","0.1241","0.1273","","","","","","1.034","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052813","11.1948","0.0004","12.7179","0.0005","14.3447","0.0009","100.145","0.002","102.482","0.002","110.403","0.001","1796.98","0.15","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C71 H99 I2 N4 O4 P4 Rh2 -","- C71 H99 I2 N4 O4 P4 Rh2 -","- C71 H99 I2 N4 O4 P4 Rh2 -","1","0.5","","Walter, Marc D.; White, Peter S.; Schauer, Cynthia K.; Brookhart, Maurice","The quest for stable σ-methane complexes: computational and experimental studies","New Journal of Chemistry","2011","35","12","2884","","10.1039/c1nj20602h","","","1.54178","CuKα","","0.028","0.0274","","","0.0699","0.0704","","","","","","1.06","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052814","11.1771","0.0002","12.8681","0.0003","23.2854","0.0005","90","","94.739","0.001","90","","3337.64","0.12","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H49 N2 O2 P2 Rh -","- C33 H49 N2 O2 P2 Rh -","- C132 H196 N8 O8 P8 Rh4 -","4","1","","Walter, Marc D.; White, Peter S.; Schauer, Cynthia K.; Brookhart, Maurice","The quest for stable σ-methane complexes: computational and experimental studies","New Journal of Chemistry","2011","35","12","2884","","10.1039/c1nj20602h","","","1.54178","CuKα","","0.0244","0.0232","","","0.0604","0.0613","","","","","","1.065","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052816","11.3107","0.0003","12.3575","0.0004","13.5089","0.0004","82.643","0.001","73.201","0.001","74.766","0.001","1741.29","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H36 Cl2 N2 O7 -","- C40 H36 Cl2 N2 O7 -","- C80 H72 Cl4 N4 O14 -","2","1","","Roche, Cécile; Sauvage, Jean-Pierre; Sour, Angélique; Strutt, Nathan L.","A [3]rotaxane composed of a zinc porphyrin tetra-substituted with coordinating macrocycles and of two short rigid axles","New Journal of Chemistry","2011","35","12","2820","","10.1039/c1nj20734b","","","0.71073","MoKα","","0.0671","0.051","","","0.1219","0.1371","","","","","","1.024","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052817","13.4651","0.0003","13.477","0.0003","13.6637","0.0004","98.499","0.001","93.21","0.001","98.034","0.001","2420.79","0.1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C56 H64 N2 O10 -","- C56 H64 N2 O10 -","- C112 H128 N4 O20 -","2","1","","McConnell, Anna J.; Serpell, Christopher J.; Beer, Paul D.","Extending the family of heteroditopic calix[4]diquinone receptors for cooperative AND ion-pair recognition","New Journal of Chemistry","2012","36","1","102","","10.1039/c1nj20708c","","","0.71073","MoKα","","0.172","0.0794","","","0.1673","0.2052","","","","","","1.014","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052818","11.503","0.0003","13.4039","0.0004","14.5562","0.0005","76.3517","0.0014","82.0783","0.0015","81.4218","0.0014","2144.24","0.11","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C46.04 H42.59 Cl2.87 N2.54 O10 -","- C46.043 H42.586 Cl2.871 N2.543 O10 -","- C92.086 H85.172 Cl5.742 N5.086 O20 -","2","1","","McConnell, Anna J.; Serpell, Christopher J.; Beer, Paul D.","Extending the family of heteroditopic calix[4]diquinone receptors for cooperative AND ion-pair recognition","New Journal of Chemistry","2012","36","1","102","","10.1039/c1nj20708c","","","0.71073","MoKα","","0.1077","0.0656","","0.1747","0.1499","0.1747","","","","","","1.0028","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052819","12.5858","0.0002","20.2654","0.0002","17.1345","0.0002","90","","99.8495","0.0005","90","","4305.85","0.1","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H46 N2 O10 -","- C52 H46 N2 O10 -","- C208 H184 N8 O40 -","4","1","","McConnell, Anna J.; Serpell, Christopher J.; Beer, Paul D.","Extending the family of heteroditopic calix[4]diquinone receptors for cooperative AND ion-pair recognition","New Journal of Chemistry","2012","36","1","102","","10.1039/c1nj20708c","","","0.71073","MoKα","","0.0757","0.035","","0.0718","0.0393","0.0393","","","","","","1.1083","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052820","13.379","0.0001","15.0967","0.0002","20.7767","0.0003","90","","103.767","0.0005","90","","4075.89","0.09","150","","150","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C46.5 H50 N3 O12 -","- C46.5 H50 N3 O12 -","- C186 H200 N12 O48 -","4","1","","McConnell, Anna J.; Serpell, Christopher J.; Beer, Paul D.","Extending the family of heteroditopic calix[4]diquinone receptors for cooperative AND ion-pair recognition","New Journal of Chemistry","2012","36","1","102","","10.1039/c1nj20708c","","","0.71073","MoKα","","0.1113","0.0519","","0.0847","0.0595","0.0595","","","","","","1.0808","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052821","28.803","0.004","28.803","0.004","44.831","0.009","90","","90","","120","","32210","9","180","2","180","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C114 H111 Cl15 N54 O76 Sm6 -","- C113.98 H84 Cl14.97 N54.005 O75.97 Sm6 -","- C683.88 H504 Cl89.82 N324.03 O455.82 Sm36 -","6","0.333333","","Wu, Xiao; Lin, Zhihua; He, Cheng; Duan, Chunying","Catalytic performance of lanthanide molecular solids containing well-modified metal‒organic octahedra","New Journal of Chemistry","2012","36","1","161","","10.1039/c1nj20736a","","","0.71073","MoKα","","0.1788","0.0791","","","0.2111","0.2605","","","","","","0.952","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052822","7.6902","0.0007","14.229","0.0015","14.8521","0.0015","91.645","0.005","90.598","0.005","90.643","0.005","1624.3","0.3","173","2","174","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H74 N8 O14 Pd -","- C68 H76 N8 O14 Pd -","- C68 H76 N8 O14 Pd -","1","0.5","","Cho, Youngje; Lee, Ji Ha; Jaworski, Justyn; Park, Sunhong; Lee, Shim Sung; Jung, Jong Hwa","The influence of ultrasound on porphyrin-based metallogel formation: efficient control of H- and J-type aggregations","New Journal of Chemistry","2012","36","1","32","","10.1039/c1nj20781d","","","0.71073","MoKα","","0.0444","0.042","","","0.123","0.1255","","","","","","1.111","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052823","10.5331","0.0012","12.31","0.0011","14.9616","0.0013","98.283","0.007","110.587","0.009","106.472","0.009","1676.1","0.3","150","1","150","1","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C76 H62 Cl8 Cr Fe N8 -","- C76 H62 Cl8 Cr Fe N8 -","- C76 H62 Cl8 Cr Fe N8 -","1","0.5","","Konarev, Dmitri V.; Zorina, Leokadia V.; Khasanov, Salavat S.; Hakimova, El'za U.; Lyubovskaya, Rimma N.","Structure and magnetic properties of ionic compound (Cp*2Cr+)·(FeIPc−)·(C6H4Cl2)4 containing negatively charged iron phthalocyanine","New Journal of Chemistry","2012","36","1","48","","10.1039/c1nj20858f","","","0.71073","MoKα","","0.1396","0.0974","","","0.2153","0.2338","","","","","","1.071","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052824","31.823","0.007","31.823","0.007","21.495","0.005","90","","90","","120","","18852","7","100","2","100","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","NA","","","- C132 H138 N24 O33 Ru3 -","- C120 H90 N21 O12 Ru3 -","- C720 H540 N126 O72 Ru18 -","6","0.333333","","Wang, Jin-Liang; Li, Xiaopeng; Shreiner, Carol D.; Lu, Xiaocun; Moorefield, Charles N.; Tummalapalli, Sreedhar R.; Medvetz, Douglas A.; Panzner, Matthew J.; Fronczek, Frank R.; Wesdemiotis, Chrys; Newkome, George R.","Shape-persistent, ruthenium(ii)- and iron(ii)-bisterpyridine metallodendrimers: synthesis, traveling-wave ion-mobility mass spectrometry, and photophysical properties","New Journal of Chemistry","2012","36","2","484","","10.1039/c2nj20799k","","","0.71073","MoKα","","0.0797","0.0603","","","0.1271","0.135","","","","","","0.989","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052825","7.1447","0.0009","7.5795","0.0009","13.441","0.0016","83.394","0.002","78.094","0.002","70.208","0.002","669.34","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","ethyl (2Z)-2-cyano-3-((3-fluoro-4-methoxyphenyl)amino)prop-2- enoate","ethyl (2Z)-2-cyano-3-[(3-fluoro-4-methoxyphenyl)amino]prop-2-enoate","","- C13 H13 F N2 O3 -","- C13 H13 F N2 O3 -","- C26 H26 F2 N4 O6 -","2","1","","Zhang, Zhenfeng; Tong, Hongbo; Wu, Yanbo; Zhang, Guisheng","C⋯π interaction of non-hydrogen bond type","New Journal of Chemistry","2012","36","1","44","","10.1039/c2nj20903a","","","0.71073","MoKα","","0.0509","0.034","","","0.0872","0.0975","","","","","","1.013","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052826","10.5897","0.0006","10.5897","0.0006","26.8588","0.0016","90","","90","","90","","3012","0.3","150","2","150","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C56 H40 Cl2 Cr5 N24 -","- C56 H40 Cl2 Cr5 N24 -","- C112 H80 Cl4 Cr10 N48 -","2","0.125","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Huang, Yi-Lin; Yeh, Chen-Yu; Fu, Ming-Dung; Chen, Chun-hsien; Peng, Shie-Ming","Fine tuning of pentachromium(ii) metal string complexes through elaborate design of ligand","New Journal of Chemistry","2012","36","3","632","","10.1039/c1nj20512a","","","0.71073","MoKα","","0.0813","0.0708","","","0.1664","0.1737","","","","","","1.031","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052827","10.4539","0.0002","12.7977","0.0003","25.2298","0.0005","90","","101.325","0.0013","90","","3309.66","0.12","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H36 Cl2 Cr5 N28 -","- C52 H36 Cl2 Cr5.001 N28 -","- C104 H72 Cl4 Cr10.002 N56 -","2","0.5","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Huang, Yi-Lin; Yeh, Chen-Yu; Fu, Ming-Dung; Chen, Chun-hsien; Peng, Shie-Ming","Fine tuning of pentachromium(ii) metal string complexes through elaborate design of ligand","New Journal of Chemistry","2012","36","3","632","","10.1039/c1nj20512a","","","0.71073","MoKα","","0.0942","0.067","","","0.1874","0.2045","","","","","","0.914","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052828","14.8488","0.0002","31.4891","0.0004","15.963","0.0002","90","","95.5875","0.0006","90","","7428.44","0.17","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H56 Cl4 Cr5 N26 S2 -","- C72 H56 Cl4 Cr5 N26 S2 -","- C288 H224 Cl16 Cr20 N104 S8 -","4","1","","Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Huang, Yi-Lin; Yeh, Chen-Yu; Fu, Ming-Dung; Chen, Chun-hsien; Peng, Shie-Ming","Fine tuning of pentachromium(ii) metal string complexes through elaborate design of ligand","New Journal of Chemistry","2012","36","3","632","","10.1039/c1nj20512a","","","0.71073","MoKα","","0.1169","0.0543","","","0.1443","0.1684","","","","","","1.054","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052829","10.756","0.002","5.926","0.0012","18.84","0.004","90","","99.58","0.03","90","","1184.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-(2-pyridyl)N-benzylaminoethanol","","- C14 H16 N2 O -","- C14 H16 N2 O -","- C56 H64 N8 O4 -","4","1","","Chmielewski, Marcin K.; Tykarska, Ewa; Markiewicz, Wojciech T.; Rypniewski, Wojciech","Engineering N-(2-pyridyl)aminoethyl alcohols as potential precursors of thermolabile protecting groups","New Journal of Chemistry","2012","36","3","603","","10.1039/c1nj20584f","","","0.8162","synchrotron","","0.0454","0.0449","","","0.1207","0.1213","","","","","","1.092","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052830","8.841","0.0018","9.053","0.0018","8.63","0.0017","90","","90","","90","","690.7","0.2","100","2","100","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","N-(2-pyridyl)amino-1-ethanol","","- C7 H10 N2 O -","- C7 H10 N2 O -","- C28 H40 N8 O4 -","4","1","","Chmielewski, Marcin K.; Tykarska, Ewa; Markiewicz, Wojciech T.; Rypniewski, Wojciech","Engineering N-(2-pyridyl)aminoethyl alcohols as potential precursors of thermolabile protecting groups","New Journal of Chemistry","2012","36","3","603","","10.1039/c1nj20584f","","","0.71073","synchrotron","","0.0443","0.0435","","","0.1213","0.1231","","","","","","1.078","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052831","6.048","0.0012","7.315","0.0015","24.334","0.005","90","","90","","90","","1076.6","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(2-pyridyl)amino-1-phenyloethanol","","- C13 H14 N2 O -","- C13 H14 N2 O -","- C52 H56 N8 O4 -","4","1","","Chmielewski, Marcin K.; Tykarska, Ewa; Markiewicz, Wojciech T.; Rypniewski, Wojciech","Engineering N-(2-pyridyl)aminoethyl alcohols as potential precursors of thermolabile protecting groups","New Journal of Chemistry","2012","36","3","603","","10.1039/c1nj20584f","","","0.8162","synchrotron","","0.0449","0.0442","","","0.1229","0.1238","","","","","","1.059","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052832","5.605","0.0011","20.972","0.004","9.5","0.0019","90","","108.11","0.03","90","","1061.4","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(2-pyrimidyl)amino-1-phenyloethanol","N-(2-pyrimidyl)amino-1-phenyloethanol","","- C12 H13 N3 O -","- C12 H13 N3 O -","- C48 H52 N12 O4 -","4","1","","Chmielewski, Marcin K.; Tykarska, Ewa; Markiewicz, Wojciech T.; Rypniewski, Wojciech","Engineering N-(2-pyridyl)aminoethyl alcohols as potential precursors of thermolabile protecting groups","New Journal of Chemistry","2012","36","3","603","","10.1039/c1nj20584f","","","0.8162","synchrotron","","0.048","0.0471","","","0.1321","0.1357","","","","","","1.1","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052833","32.334","0.007","5.791","0.0012","16.392","0.003","90","","104.42","0.03","90","","2972.6","1.1","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","bis{N-(2-pyridyl)aminoethyl}carbonate","","- C15 H18 N4 O3 -","- C15 H18 N4 O3 -","- C120 H144 N32 O24 -","8","1","","Chmielewski, Marcin K.; Tykarska, Ewa; Markiewicz, Wojciech T.; Rypniewski, Wojciech","Engineering N-(2-pyridyl)aminoethyl alcohols as potential precursors of thermolabile protecting groups","New Journal of Chemistry","2012","36","3","603","","10.1039/c1nj20584f","","","0.808","synchrotron","","0.0462","0.0451","","","0.1283","0.1298","","","","","","1.086","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052834","10.674","0.006","8.769","0.004","11.811","0.004","90","","116.21","0.02","90","","991.8","0.8","105","2","105","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H26 N2 O4 -","- C21 H26 N2 O4 -","- C42 H52 N4 O8 -","2","1","","Alba, Andrea-Nekane R.; Valero, Guillem; Calbet, Teresa; Font-Bardía, Mercé; Moyano, Albert; Rios, Ramon","Enantioselective addition of oxazolones to maleimides. An easy entry to quaternary aminoacids","New Journal of Chemistry","2012","36","3","613","","10.1039/c1nj20659a","","","0.71073","MoKα","","0.0364","0.0363","","","0.0968","0.0969","","","","","","1.27","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052835","43.982","0.011","8.85","0.002","9.627","0.002","90","","90","","90","","3747.2","1.5","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C15 H8.5 N8.5 O10.5 -","- C15 H8.5 N8.5 O10.5 -","- C120 H68 N68 O84 -","8","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.0928","0.0678","","","0.1268","0.1367","","","","","","1.065","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052836","6.0755","0.0019","15.089","0.005","14.771","0.004","90","","90.949","0.005","90","","1353.9","0.7","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C11 H11 N5 O7 -","- C11 H11 N5 O7 -","- C44 H44 N20 O28 -","4","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.023","0.0228","","","0.059","0.0593","","","","","","1.104","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052837","7.863","0.0014","13.001","0.002","7.9711","0.0014","90","","111.871","0.003","90","","756.2","0.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H9 N3 O3 -","- C5 H9 N3 O3 -","- C20 H36 N12 O12 -","4","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.0412","0.0343","","","0.0877","0.0918","","","","","","1.068","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052838","7.2105","0.0015","9.615","0.002","10.265","0.002","78.308","0.003","82.099","0.004","85.773","0.004","689.5","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","1,3-dimethylimidazolium picrate","","","- C11 H11 N5 O7 -","- C11 H11 N5 O7 -","- C22 H22 N10 O14 -","2","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.0592","0.0472","","","0.1224","0.1305","","","","","","1.044","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052839","6.2866","0.001","11.646","0.002","10.3067","0.0017","90","","93.367","0.003","90","","753.3","0.2","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H7 N7 O11 -","- C10 H7 N7 O11 -","- C20 H14 N14 O22 -","2","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.0255","0.0236","","","0.0558","0.0581","","","","","","0.506","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052840","8.957","0.007","9.917","0.007","7.143","0.006","90","","96.046","0.012","90","","631","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-methyl-3-H-imidazolium nitrate","","","- C4 H7 N3 O3 -","- C4 H7 N3 O3 -","- C16 H28 N12 O12 -","4","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.0415","0.0347","","","0.088","0.0929","","","","","","0.985","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052841","8.018","0.002","5.8847","0.0015","27.215","0.007","90","","94.798","0.005","90","","1279.6","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1-methyl-3-H-imidazolium picrate","","","- C10 H9 N5 O7 -","- C10 H9 N5 O7 -","- C40 H36 N20 O28 -","4","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.0909","0.058","","","0.1107","0.1216","","","","","","1.072","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052842","7.25","0.002","9.107","0.003","11.946","0.004","83.27","0.005","74.608","0.005","79.684","0.005","746.1","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H13 N5 O7 -","- C12 H13 N5 O7 -","- C24 H26 N10 O14 -","2","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Vincek, Adam S.; Katritzky, Alan R.; Thrasher, Joseph S.; Sun, Luyi; McCrary, Parker D.; Beasley, Preston A.; Kelley, Steven P.; Rogers, Robin D.","Synthesis, limitations, and thermal properties of energetically-substituted, protonated imidazolium picrate and nitrate salts and further comparison with their methylated analogs","New Journal of Chemistry","2012","36","3","702","","10.1039/c1nj20677j","","","0.71073","MoKα","","0.04","0.0352","","","0.0887","0.0913","","","","","","1.054","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052843","11.0164","0.0017","11.8961","0.0018","18.841","0.003","81.814","0.003","84.93","0.003","69.902","0.003","2293.1","0.6","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C127.5 H84 Cl N4 O0.8 -","- C127.5 H84 Cl N4 O0.8 -","- C127.5 H84 Cl N4 O0.8 -","1","0.5","","Zhou, Xie; Li, Haiyin; Chi, Zhenguo; Zhang, Xiqi; Zhang, Jianyong; Xu, Bingjia; Zhang, Yi; Liu, Siwei; Xu, Jiarui","Piezofluorochromism and morphology of a new aggregation-induced emission compound derived from tetraphenylethylene and carbazole","New Journal of Chemistry","2012","36","3","685","","10.1039/c1nj20782b","","","0.71073","MoKα","","0.1071","0.0581","","","0.1601","0.1972","","","","","","1.011","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052844","8.2045","0.0016","11.888","0.002","17.949","0.004","90","","99.79","0.03","90","","1725.2","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Marc Fourmigue","","","- C13 H20 O5 S4 -","- C13 H20 O5 S4 -","- C52 H80 O20 S16 -","4","1","","Famengo, Alessia; Pinero, Dalice; Jeannin, Olivier; Guizouarn, Thierry; Piekara-Sady, Lidia; Fourmigué, Marc","Dithiolene complexes as metallo-ligands: a crown-ether approach","New Journal of Chemistry","2012","36","3","638","","10.1039/c1nj20870e","","","0.71073","MoKα","","0.0691","0.0357","","","0.075","0.0916","","","","","","1.088","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052845","23.6588","0.0014","10.192","0.0006","17.5265","0.0012","90","","127.742","0.002","90","","3342","0.4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H40 Na Ni O8 S8 -","- C24 H40 Na Ni O8 S8 -","- C96 H160 Na4 Ni4 O32 S32 -","4","0.5","","Famengo, Alessia; Pinero, Dalice; Jeannin, Olivier; Guizouarn, Thierry; Piekara-Sady, Lidia; Fourmigué, Marc","Dithiolene complexes as metallo-ligands: a crown-ether approach","New Journal of Chemistry","2012","36","3","638","","10.1039/c1nj20870e","","x-ray","0.71073","MoKα","","0.0829","0.0417","","","0.1053","0.1568","","","","","","1.044","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052846","13.4074","0.0004","14.0031","0.0004","19.1875","0.0006","90","","104.593","0.001","90","","3486.15","0.18","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H40 Ni1.5 O8.5 S8 -","- C24 H40 Ni1.5 O8.5 S8 -","- C96 H160 Ni6 O34 S32 -","4","0.5","","Famengo, Alessia; Pinero, Dalice; Jeannin, Olivier; Guizouarn, Thierry; Piekara-Sady, Lidia; Fourmigué, Marc","Dithiolene complexes as metallo-ligands: a crown-ether approach","New Journal of Chemistry","2012","36","3","638","","10.1039/c1nj20870e","","x-ray","0.71073","MoKα","","0.0637","0.0528","","","0.1552","0.1811","","","","","","1.061","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052847","9.1918","0.0004","9.5486","0.0004","10.6697","0.0004","67.459","0.001","74.151","0.002","84.463","0.002","832.01","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H40 Ni O8 S8 -","- C24 H40 Ni O8 S8 -","- C24 H40 Ni O8 S8 -","1","0.5","","Famengo, Alessia; Pinero, Dalice; Jeannin, Olivier; Guizouarn, Thierry; Piekara-Sady, Lidia; Fourmigué, Marc","Dithiolene complexes as metallo-ligands: a crown-ether approach","New Journal of Chemistry","2012","36","3","638","","10.1039/c1nj20870e","","","0.71073","MoKα","","0.0263","0.0233","","","0.0685","0.0809","","","","","","1.206","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052848","7.4285","0.0004","5.748","0.0002","7.6305","0.0004","90","","118.462","0.006","90","","286.43","0.03","110","2","110","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C7 H6 N2 -","- C7 H6 N2 -","- C14 H12 N4 -","2","1","","González, J. J. L.; Ureña, F. P.; Moreno, J. R. A.; Mata, I.; Molins, E.; Claramunt, R. M.; López, C.; Alkorta, I.; Elguero, J.","The chiral structure of 1H-indazoles in the solid state: a crystallographic, vibrational circular dichroism and computational study","New Journal of Chemistry","2012","36","3","749","","10.1039/c2nj20820b","","","1.5418","CuKα","","0.0477","0.0475","","","0.1297","0.1298","","","","","","1.134","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052849","4.5663","0.0002","9.6254","0.0005","30.3857","0.0014","90","","91.668","0.005","90","","1334.96","0.11","105","","105","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N3 O3 -","- C15 H15 N3 O3 -","- C60 H60 N12 O12 -","4","1","","Seifert, Susan; Seifert, Andreas; Brunklaus, Gunther; Hofmann, Katja; Rüffer, Tobias; Lang, Heinrich; Spange, Stefan","Probing the surface polarity of inorganic oxides using merocyanine-type dyes derived from barbituric acid","New Journal of Chemistry","2012","36","3","674","","10.1039/c2nj20835k","","","1.54184","CuKα","","0.0694","0.0565","","","0.146","0.153","","","","","","0.958","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052850","14.8274","0.0003","15.2591","0.0003","14.0991","0.0003","90","","106.703","0.001","90","","3055.37","0.11","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H44 N2 O Si2 -","- C28 H44 N2 O Si2 -","- C112 H176 N8 O4 Si8 -","4","1","","Coombs, Benjamin A.; Lindner, Benjamin D.; Edkins, Robert M.; Rominger, Frank; Beeby, Andrew; Bunz, Uwe H. F.","Photophysical property trends for a homologous series of bis-ethynyl-substituted benzochalcogendiazoles","New Journal of Chemistry","2012","36","3","550","","10.1039/c2nj20847d","","","0.71073","MoKα","","0.0906","0.0628","","","0.1687","0.1935","","","","","","1.041","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052851","14.336","0.0014","14.9701","0.0015","14.9722","0.0016","90","","97.892","0.002","90","","3182.8","0.6","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 N2 S Si2 -","- C28 H44 N2 S Si2 -","- C112 H176 N8 S4 Si8 -","4","1","","Coombs, Benjamin A.; Lindner, Benjamin D.; Edkins, Robert M.; Rominger, Frank; Beeby, Andrew; Bunz, Uwe H. F.","Photophysical property trends for a homologous series of bis-ethynyl-substituted benzochalcogendiazoles","New Journal of Chemistry","2012","36","3","550","","10.1039/c2nj20847d","","","0.71073","MoKα","","0.1112","0.0728","","","0.2099","0.2437","","","","","","1.035","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052852","14.751","0.003","14.938","0.003","15.035","0.003","90","","105.604","0.005","90","","3190.9","1.1","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 N2 Se Si2 -","- C28 H44 N2 Se Si2 -","- C112 H176 N8 Se4 Si8 -","4","1","","Coombs, Benjamin A.; Lindner, Benjamin D.; Edkins, Robert M.; Rominger, Frank; Beeby, Andrew; Bunz, Uwe H. F.","Photophysical property trends for a homologous series of bis-ethynyl-substituted benzochalcogendiazoles","New Journal of Chemistry","2012","36","3","550","","10.1039/c2nj20847d","","","0.71073","MoKα","","0.0711","0.0485","","","0.1217","0.1348","","","","","","1.05","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052853","27.455","0.007","36.891","0.009","9.656","0.002","90","","90","","90","","9780","4","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C22 H26 N2 O13 -","- C22 H16 N2 O8 -","- C352 H256 N32 O128 -","16","1","","Hill, Yennifer; Linares, Maholy; Briceño, Alexander","Combining topochemical [2+2] photoreactions and hydrothermal isomerisation for the regioselective and quantitative preparation ofrtct-pyridylcyclobutanes","New Journal of Chemistry","2012","36","3","554","","10.1039/c2nj20855e","","","0.7107","MoKα","","0.0664","0.0578","","","0.1561","0.1635","","","","","","1.05","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052854","11.207","0.0018","10.5278","0.0015","17.198","0.003","90","","96.718","0.004","90","","2015.2","0.6","293","2","293","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C44 H34.56 N4 O17.28 -","- C44 H34.556 N4 O17.278 -","- C88 H69.112 N8 O34.556 -","2","0.5","","Hill, Yennifer; Linares, Maholy; Briceño, Alexander","Combining topochemical [2+2] photoreactions and hydrothermal isomerisation for the regioselective and quantitative preparation ofrtct-pyridylcyclobutanes","New Journal of Chemistry","2012","36","3","554","","10.1039/c2nj20855e","","","0.7107","MoKα","","0.0789","0.0581","","","0.1503","0.1665","","","","","","1.043","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052855","10.254","0.003","10.381","0.003","13.085","0.005","86.63","0.03","87.56","0.03","75.388","0.017","1344.9","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H47.24 Cl4 N4 O8.62 -","- C62 H46 Cl4 N4 O8.62 -","- C62 H46 Cl4 N4 O8.62 -","1","0.5","","Hill, Yennifer; Linares, Maholy; Briceño, Alexander","Combining topochemical [2+2] photoreactions and hydrothermal isomerisation for the regioselective and quantitative preparation ofrtct-pyridylcyclobutanes","New Journal of Chemistry","2012","36","3","554","","10.1039/c2nj20855e","","","0.7107","MoKα","","0.0649","0.0524","","","0.1413","0.1538","","","","","","1.045","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052856","9.6451","0.0011","9.7718","0.0011","13.576","0.0013","99.752","0.008","98.148","0.008","115.368","0.008","1106","0.2","230","","230","","","","","","","","","5","P -1","-P 1","2","1,5-bis(benzimidazolonium)pentane bis(dihydrogenophosphate)","1,5-bis(benzimidazolonium)pentane bis(dihydrogenophosphate)","","- C19 H26 N4 O8 P2 -","- C19 H26 N4 O8 P2 -","- C38 H52 N8 O16 P4 -","2","1","","Clifford, Sarah E.; Runowski, Marcin; Parthasarathy, Nalini; Besnard, Céline; Melich, Xavier; Williams, Alan F.","Unusual solidification and phosphate binding to benzimidazole cations in the presence of water","New Journal of Chemistry","2012","36","3","823","","10.1039/c2nj20897k","","","0.71073","MoKα","","0.055","0.0384","","0.0613","0.0573","0.0613","","","","","","1.0613","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052857","6.9865","0.0008","17.368","0.001","15.847","0.001","90","","94.68","0.03","90","","1916.5","0.3","220","","200","","","","","","","","","5","P 1 n 1","P -2yac","7","1,2-bis(benzimidazolonium)ethane sulphate trihydrate","1,2-bis(benzimidazolonium)ethane sulphate trihydrate","","- C34 H48 N8 O14 S2 -","- C34 H48 N8 O14 S2 -","- C68 H96 N16 O28 S4 -","2","1","","Clifford, Sarah E.; Runowski, Marcin; Parthasarathy, Nalini; Besnard, Céline; Melich, Xavier; Williams, Alan F.","Unusual solidification and phosphate binding to benzimidazole cations in the presence of water","New Journal of Chemistry","2012","36","3","823","","10.1039/c2nj20897k","","","0.71073","MoKα","","0.0388","0.0356","","0.0536","0.053","0.0536","","","","","","1.702","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052858","9.8599","0.0005","12.9049","0.0008","18.8173","0.0006","95.255","0.004","103.115","0.004","102.98","0.005","2246.5","0.2","200","","200","","","","","","","","","5","P -1","-P 1","2","Bis(1,5-bis(benzimidazolonium)pentane) bis(dihydrogenophosphate)monohydrogenophosphate tetrahydrate","Bis(1,5-bis(benzimidazolonium)pentane) bis(dihydrogenophosphate)monohydrogenophosphate tetrahydrate","","- C38 H57 N8 O16 P3 -","- C38 H57 N8 O16 P3 -","- C76 H114 N16 O32 P6 -","2","1","","Clifford, Sarah E.; Runowski, Marcin; Parthasarathy, Nalini; Besnard, Céline; Melich, Xavier; Williams, Alan F.","Unusual solidification and phosphate binding to benzimidazole cations in the presence of water","New Journal of Chemistry","2012","36","3","823","","10.1039/c2nj20897k","","","1.5418","CuKα","","0.0415","0.0385","","","0.1075","0.1114","","","","","","1.021","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052859","7.5072","0.0014","9.1676","0.0017","10.705","0.002","79.845","0.004","84.056","0.004","72.958","0.003","692.3","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H13 Au Cl N3 -","- C14 H13 Au Cl N3 -","- C28 H26 Au2 Cl2 N6 -","2","1","","Adhikary, Sirsendu Das; Bose, Dipayan; Mitra, Partha; Saha, Krishna Das; Bertolasi, Valerio; Dinda, Joydev","Au(i)- and Pt(ii)-N-heterocyclic carbene complexes with picoline functionalized benzimidazolin-2-ylidene ligands; synthesis, structures, electrochemistry and cytotoxicity studies","New Journal of Chemistry","2012","36","3","759","","10.1039/c2nj20928d","","","0.71073","MoKα","","0.0371","0.0356","","","0.0966","0.0976","","","","","","1.139","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052860","15.6488","0.0011","13.2247","0.0011","7.1603","0.0005","90","","99.624","0.002","90","","1460.97","0.19","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H13 Cl2 N3 Pt -","- C14 H13 Cl2 N3 Pt -","- C56 H52 Cl8 N12 Pt4 -","4","1","","Adhikary, Sirsendu Das; Bose, Dipayan; Mitra, Partha; Saha, Krishna Das; Bertolasi, Valerio; Dinda, Joydev","Au(i)- and Pt(ii)-N-heterocyclic carbene complexes with picoline functionalized benzimidazolin-2-ylidene ligands; synthesis, structures, electrochemistry and cytotoxicity studies","New Journal of Chemistry","2012","36","3","759","","10.1039/c2nj20928d","","","0.71073","MoKα","","0.0371","0.028","","","0.0502","0.054","","","","","","0.884","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052861","14.606","0.001","14.212","0.001","25.06","0.002","90","","106.091","0.007","90","","4998.2","0.7","110","","110","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 B Br2 F2 N3 S2 -","- C28 H16 B Br2 F2 N3 S2 -","- C224 H128 B8 Br16 F16 N24 S16 -","8","2","","Bellier, Quentin; Dalier, Fabrice; Jeanneau, Erwann; Maury, Olivier; Andraud, Chantal","Thiophene-substituted aza-bodipy as a strategic synthon for the design of near-infrared dyes","New Journal of Chemistry","2012","36","3","768","","10.1039/c2nj20943h","","","1.5418","CuKα","","0.0418","0.0402","","0.1129","0.1118","0.1129","","","","","","1.0071","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052862","15.5428","0.0004","16.207","0.0005","28.1062","0.0009","78.135","0.002","88.922","0.002","62.066","0.002","6096.8","0.3","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C64 H92 O14 -","- C64 H92 O14 -","- C256 H368 O56 -","4","2","","Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija","Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles","New Journal of Chemistry","2012","36","3","789","","10.1039/c2nj20981k","","","1.54178","CuKα","","0.1516","0.0792","","","0.1761","0.2167","","","","","","1.063","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052863","14.0441","0.0005","16.3664","0.0006","16.578","0.0006","99.948","0.002","104.812","0.002","112.067","0.002","3256.7","0.2","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C68 H100 O14 -","- C68 H100 O14 -","- C136 H200 O28 -","2","1","","Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija","Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles","New Journal of Chemistry","2012","36","3","789","","10.1039/c2nj20981k","","","1.54178","CuKα","","0.1294","0.0852","","","0.2238","0.2614","","","","","","1.025","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052864","36.7201","0.0007","19.6013","0.0005","19.4874","0.0006","90","","116.801","0.001","90","","12519.6","0.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H76 F12 K2 O14 P2 -","- C56 H76 F12 K2 O14 P2 -","- C448 H608 F96 K16 O112 P16 -","8","1","","Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija","Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles","New Journal of Chemistry","2012","36","3","789","","10.1039/c2nj20981k","","","1.54178","CuKα","","0.1319","0.0788","","","0.2001","0.2399","","","","","","1.029","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052865","12.5169","0.0003","17.8145","0.0005","18.0005","0.0005","70.468","0.0019","79.987","0.0016","82.768","0.0014","3715.26","0.18","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H98 Cs2 F12 O17 P2 -","- C64 H96 Cs2 F12 O17 P2 -","- C128 H192 Cs4 F24 O34 P4 -","2","1","","Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija","Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles","New Journal of Chemistry","2012","36","3","789","","10.1039/c2nj20981k","","","1.54178","CuKα","","0.0482","0.0449","","","0.1125","0.1152","","","","","","1.044","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052866","10.1107","0.0005","17.0139","0.001","22.9177","0.0011","109.33","0.003","95.789","0.003","89.952","0.003","3698.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H100 F12 K2 O14 P2 -","- C68 H100 F12 K2 O14 P2 -","- C136 H200 F24 K4 O28 P4 -","2","1","","Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija","Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles","New Journal of Chemistry","2012","36","3","789","","10.1039/c2nj20981k","","","1.54178","CuKα","","0.1565","0.0969","","","0.2355","0.2834","","","","","","1.074","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052867","10.4675","0.0004","16.8329","0.0007","27.588","0.001","96.549","0.002","97.404","0.002","93.961","0.002","4771.6","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H140 Cs2 F12 O14 P2 -","- C88 H140 Cs2 F12 O14 P2 -","- C176 H280 Cs4 F24 O28 P4 -","2","1","","Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija","Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles","New Journal of Chemistry","2012","36","3","789","","10.1039/c2nj20981k","","","1.54178","CuKα","","0.1581","0.0824","","","0.1649","0.2038","","","","","","1.056","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052868","9.1783","0.0017","11.032","0.002","14.83","0.003","108.315","0.012","90.603","0.01","100.772","0.009","1396.6","0.5","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C40 H32 N4 -","- C40 H32 N4 -","- C80 H64 N8 -","2","1","","Sarkar, Parantap; Jeon, Ie-Rang; Durola, Fabien; Bock, Harald","Tetraazaarenes by the ceramidonine approach","New Journal of Chemistry","2012","36","3","570","","10.1039/c2nj21033a","","","0.71073","MoKα","","0.1629","0.0721","","","0.1831","0.2308","","","","","","0.984","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052869","18.669","0.005","18.669","0.005","16.853","0.005","90","0.005","90","0.005","120","0.005","5087","2","100","2","100","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C13 H16 N2 -","- C13 H16 N2 -","- C234 H288 N36 -","18","1","","Sarkar, Parantap; Jeon, Ie-Rang; Durola, Fabien; Bock, Harald","Tetraazaarenes by the ceramidonine approach","New Journal of Chemistry","2012","36","3","570","","10.1039/c2nj21033a","","","0.71073","MoKα","","0.0522","0.043","","","0.1245","0.1388","","","","","","1.049","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052870","11.524","0.005","9.41","0.005","9.133","0.005","90","","90","","90","","990.4","0.9","150","2","150","2","","","","","","","","4","C m c m","-C 2c 2","63","cobaltocenium triiodide","","","- C10 H10 Co I -","- C10 H10 Co I -","- C40 H40 Co4 I4 -","4","0.25","","Diana, Eliano; Chierotti, Michele R.; Marchese, Edoardo M. C.; Croce, Gianluca; Milanesio, Marco; Stanghellini, Pier Luigi","Blue and red shift hydrogen bonds in crystalline cobaltocinium complexes","New Journal of Chemistry","2012","36","4","1099","","10.1039/c2nj20760e","","","0.71073","MoKα","","0.0364","0.0356","","","0.1089","0.1095","","","","","","1.32","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052871","9.2135","0.0014","9.2135","0.0014","12.344","0.0011","90","","90","","120","","907.5","0.2","150","2","150","2","","","","","","","","5","P 32 2 1","P 32 2""","154","cobaltocenium hexafluoridophosphate","","","- C10 H10 Co F6 Sb -","- C10 H10 Co F6 Sb -","- C30 H30 Co3 F18 Sb3 -","3","0.5","","Diana, Eliano; Chierotti, Michele R.; Marchese, Edoardo M. C.; Croce, Gianluca; Milanesio, Marco; Stanghellini, Pier Luigi","Blue and red shift hydrogen bonds in crystalline cobaltocinium complexes","New Journal of Chemistry","2012","36","4","1099","","10.1039/c2nj20760e","","","0.71073","MoKα","","0.0303","0.0286","","","0.0726","0.0741","","","","","","0.963","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052872","9.7276","0.0018","10.3244","0.0019","16.045","0.003","106.364","0.003","100.64","0.003","99.983","0.003","1475.5","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H58 Cu2 F18 N4 Ni4 O22 -","- C38 H58 Cu2 F18 N4 Ni4 O22 -","- C38 H58 Cu2 F18 N4 Ni4 O22 -","1","0.5","","Sultan, Muhammad; Tahir, Asif Ali; Mazhar, Muhammad; Zeller, Matthias; Wijayantha, K. G. Upul","Hexanuclear copper‒nickel and copper‒cobalt complexes for thin film deposition of ceramic oxide composites","New Journal of Chemistry","2012","36","4","911","","10.1039/c2nj20789c","","","0.71073","MoKα","","0.0445","0.0363","","","0.0985","0.1087","","","","","","1.087","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052873","9.7417","0.0011","10.3399","0.0012","16.1733","0.0018","106.594","0.002","100.096","0.002","99.876","0.002","1494.1","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H58 Co4 Cu2 F18 N4 O22 -","- C38 H58 Co4 Cu2 F18 N4 O22 -","- C38 H58 Co4 Cu2 F18 N4 O22 -","1","0.5","","Sultan, Muhammad; Tahir, Asif Ali; Mazhar, Muhammad; Zeller, Matthias; Wijayantha, K. G. Upul","Hexanuclear copper‒nickel and copper‒cobalt complexes for thin film deposition of ceramic oxide composites","New Journal of Chemistry","2012","36","4","911","","10.1039/c2nj20789c","","","0.71073","MoKα","","0.0464","0.0391","","","0.1033","0.1078","","","","","","1.166","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052874","9.6376","0.0004","13.6428","0.0006","29.0057","0.0009","101.577","0.002","91.754","0.002","104.734","0.002","3599.9","0.2","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H44 N4 O3 -","- C45 H44 N4 O3 -","- C180 H176 N16 O12 -","4","2","","Eseola, Abiodun O.; Adepitan, Oluseyi; Görls, Helmar; Plass, Winfried","Electronic/substituents influence on imidazole ring donor‒acceptor capacities using 1H-imidazo[4,5-f][1,10]phenanthroline frameworks","New Journal of Chemistry","2012","36","4","891","","10.1039/c2nj20880f","","","0.71073","MoKα","","0.1226","0.089","","","0.1584","0.1773","","","","","","1.202","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052875","14.181","0.003","12.54","0.003","16.598","0.003","90","","107.48","0.03","90","","2815.3","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H28 N4 O -","- C37 H28 N4 O -","- C148 H112 N16 O4 -","4","1","","Eseola, Abiodun O.; Adepitan, Oluseyi; Görls, Helmar; Plass, Winfried","Electronic/substituents influence on imidazole ring donor‒acceptor capacities using 1H-imidazo[4,5-f][1,10]phenanthroline frameworks","New Journal of Chemistry","2012","36","4","891","","10.1039/c2nj20880f","","","0.71073","MoKα","","0.1106","0.0699","","","0.1472","0.1759","","","","","","1.136","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052876","12.3937","0.0007","19.33","0.0009","17.2992","0.0007","90","","95.75","","90","","4123.5","0.3","187","2","187","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H40 Ag4 N6 O16 -","- C34 H40 Ag4 N6 O16 -","- C136 H160 Ag16 N24 O64 -","4","1","","Song, Xue-Zhi; Qin, Chao; Guan, Wei; Song, Shu-Yan; Zhang, Hong-Jie","An unusual three-dimensional self-penetrating network derived from cross-linking of two-fold interpenetrating nets via ligand-unsupported Ag‒Ag bonds: synthesis, structure, luminescence, and theoretical study","New Journal of Chemistry","2012","36","4","877","","10.1039/c2nj20888a","","","0.71073","MoKα","","0.0716","0.0396","","","0.0798","0.0933","","","","","","1.022","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052877","7.6395","0.0004","21.1972","0.0011","9.8455","0.0005","90","","97.683","0.001","90","","1580.03","0.14","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 N3 O6 -","- C18 H15 N3 O6 -","- C72 H60 N12 O24 -","4","1","","Song, Xue-Zhi; Qin, Chao; Guan, Wei; Song, Shu-Yan; Zhang, Hong-Jie","An unusual three-dimensional self-penetrating network derived from cross-linking of two-fold interpenetrating nets via ligand-unsupported Ag‒Ag bonds: synthesis, structure, luminescence, and theoretical study","New Journal of Chemistry","2012","36","4","877","","10.1039/c2nj20888a","","","0.71073","MoKα","","0.0751","0.0656","","","0.235","0.2431","","","","","","1.068","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052878","33.741","0.006","17.823","0.003","21.667","0.004","90","","90","","90","","13030","4","100","2","100","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C72 H88 N6 O9 -","- C72 H88 N6 O9 -","- C576 H704 N48 O72 -","8","1","","Patra, Subrata; Gunupuru, Ravi; Lo, Rabindranath; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Cation-induced fluorescent excimer emission in calix[4]arene-chemosensors bearing quinoline as a fluorogenic unit: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2012","36","4","988","","10.1039/c2nj20904g","","","0.71073","MoKα","","0.1104","0.0899","","","0.2024","0.215","","","","","","1.198","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052879","10.1151","0.0018","12.632","0.002","20.705","0.004","106.85","0.003","90.681","0.003","103.566","0.003","2452.2","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H42 Cl6 N4 O6 -","- C52 H42 Cl6 N4 O6 -","- C104 H84 Cl12 N8 O12 -","2","1","","Patra, Subrata; Gunupuru, Ravi; Lo, Rabindranath; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Cation-induced fluorescent excimer emission in calix[4]arene-chemosensors bearing quinoline as a fluorogenic unit: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2012","36","4","988","","10.1039/c2nj20904g","","","0.71073","MoKα","","0.1182","0.088","","","0.2291","0.2498","","","","","","1.049","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052880","28.539","0.004","17.712","0.002","36.055","0.004","90","","90","","90","","18225","4","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C56 H52 N4 O6 -","- C56 H52 N4 O6 -","- C896 H832 N64 O96 -","16","2","","Patra, Subrata; Gunupuru, Ravi; Lo, Rabindranath; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Cation-induced fluorescent excimer emission in calix[4]arene-chemosensors bearing quinoline as a fluorogenic unit: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2012","36","4","988","","10.1039/c2nj20904g","","","0.71073","MoKα","","0.135","0.0967","","","0.1662","0.1797","","","","","","1.186","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052881","15.4628","0.0009","24.0204","0.0016","13.4669","0.0009","90","","103.638","0.001","90","","4860.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C51 H44 Cl4 Hg2 N4 O7 -","- C51 H44 Cl4 Hg2 N4 O7 -","- C204 H176 Cl16 Hg8 N16 O28 -","4","1","","Patra, Subrata; Gunupuru, Ravi; Lo, Rabindranath; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Cation-induced fluorescent excimer emission in calix[4]arene-chemosensors bearing quinoline as a fluorogenic unit: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2012","36","4","988","","10.1039/c2nj20904g","","","0.71073","MoKα","","0.1067","0.0656","","","0.1847","0.2121","","","","","","1.031","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052882","15.618","0.004","17.009","0.004","19.256","0.005","90","","95.062","0.004","90","","5095","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H53 Cl5 Hg N4 O7 -","- C57 H53 Cl5 Hg N4 O7 -","- C228 H212 Cl20 Hg4 N16 O28 -","4","1","","Patra, Subrata; Gunupuru, Ravi; Lo, Rabindranath; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Cation-induced fluorescent excimer emission in calix[4]arene-chemosensors bearing quinoline as a fluorogenic unit: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2012","36","4","988","","10.1039/c2nj20904g","","","0.71073","MoKα","","0.1703","0.1255","","","0.2909","0.3127","","","","","","1.127","","","","has coordinates,has disorder","180082","2020-10-21","18:00:00",""
"7052883","9.5611","0.001","24.392","0.003","20.327","0.002","90","","91.353","0.003","90","","4739.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H76 N5 Nd Si6 -","- C31 H76 N5 Nd Si6 -","- C124 H304 N20 Nd4 Si24 -","4","1","","Wang, Yibin; Luo, Yunjie; Chen, Jue; Xue, Hanming; Liang, Hongze","Synthesis of mono(guanidinate) rare earth metal bis(amide) complexes and their performance in the ring-opening polymerization of l-lactide and rac-lactide","New Journal of Chemistry","2012","36","4","933","","10.1039/c2nj20925j","","","0.7107","MoKα","","0.0769","0.0543","","","0.1071","0.1166","","","","","","1.12","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052884","9.6391","0.0014","24.143","0.004","20.157","0.003","90","","91.219","0.003","90","","4689.8","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H76 Lu N5 Si6 -","- C31 H76 Lu N5 Si6 -","- C124 H304 Lu4 N20 Si24 -","4","1","","Wang, Yibin; Luo, Yunjie; Chen, Jue; Xue, Hanming; Liang, Hongze","Synthesis of mono(guanidinate) rare earth metal bis(amide) complexes and their performance in the ring-opening polymerization of l-lactide and rac-lactide","New Journal of Chemistry","2012","36","4","933","","10.1039/c2nj20925j","","","0.7107","MoKα","","0.0518","0.0419","","","0.0843","0.0881","","","","","","1.173","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052885","9.5883","0.0016","24.23","0.004","20.194","0.003","90","","91.177","0.005","90","","4690.6","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H76 N5 Si6 Y -","- C31 H76 N5 Si6 Y -","- C124 H304 N20 Si24 Y4 -","4","1","","Wang, Yibin; Luo, Yunjie; Chen, Jue; Xue, Hanming; Liang, Hongze","Synthesis of mono(guanidinate) rare earth metal bis(amide) complexes and their performance in the ring-opening polymerization of l-lactide and rac-lactide","New Journal of Chemistry","2012","36","4","933","","10.1039/c2nj20925j","","","0.7107","MoKα","","0.1394","0.107","","","0.1692","0.1803","","","","","","1.272","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052886","12.0258","0.0013","19.1155","0.0019","20.642","0.002","75.965","0.005","87.006","0.006","85.555","0.006","4586.9","0.8","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H76 N5 O Si6 Y -","- C31 H76 N5 O Si6 Y -","- C124 H304 N20 O4 Si24 Y4 -","4","2","","Wang, Yibin; Luo, Yunjie; Chen, Jue; Xue, Hanming; Liang, Hongze","Synthesis of mono(guanidinate) rare earth metal bis(amide) complexes and their performance in the ring-opening polymerization of l-lactide and rac-lactide","New Journal of Chemistry","2012","36","4","933","","10.1039/c2nj20925j","","","0.71075","MoKα","","0.1048","0.0753","","","0.1266","0.1381","","","","","","1.141","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052887","13.912","0.004","31.687","0.009","15.107","0.004","90","","94.072","0.004","90","","6643","3","296","2","296","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C30 H56 Fe Mo6 N2 O19 -","- C30 H56 Fe Mo6 N2 O19 -","- C180 H336 Fe6 Mo36 N12 O114 -","6","3","","Xiong, Jun; Niu, Yujuan; Xu, Haisheng; Cao, Guolei; Liu, Bin; Hu, Huaiming; Xue, Ganglin","Charge-transfer salts based on Lindqvist and Keggin polyoxoanion acceptors and ferrocenyl cationic donors","New Journal of Chemistry","2012","36","5","1224","","10.1039/c2nj20911j","","","0.71073","MoKα","","0.13","0.0808","","","0.2007","0.2358","","","","","","1.008","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052888","10.9641","0.0009","12.2111","0.001","13.3301","0.0011","82.048","0.001","69.008","0.001","63.409","0.001","1489.5","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H52 Fe2 Mo6 O19 P2 -","- C58 H52 Fe2 Mo6 O19 P2 -","- C58 H52 Fe2 Mo6 O19 P2 -","1","0.5","","Xiong, Jun; Niu, Yujuan; Xu, Haisheng; Cao, Guolei; Liu, Bin; Hu, Huaiming; Xue, Ganglin","Charge-transfer salts based on Lindqvist and Keggin polyoxoanion acceptors and ferrocenyl cationic donors","New Journal of Chemistry","2012","36","5","1224","","10.1039/c2nj20911j","","","0.71073","MoKα","","0.0335","0.0275","","","0.0653","0.0702","","","","","","1.05","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052889","10.959","0.002","12.295","0.004","13.315","0.003","79.488","0.004","69.27","0.002","63.598","0.002","1502.2","0.7","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H52 Fe2 O19 P2 W6 -","- C58 H52 Fe2 O19 P2 W6 -","- C58 H52 Fe2 O19 P2 W6 -","1","0.5","","Xiong, Jun; Niu, Yujuan; Xu, Haisheng; Cao, Guolei; Liu, Bin; Hu, Huaiming; Xue, Ganglin","Charge-transfer salts based on Lindqvist and Keggin polyoxoanion acceptors and ferrocenyl cationic donors","New Journal of Chemistry","2012","36","5","1224","","10.1039/c2nj20911j","","","0.71073","MoKα","","0.0431","0.0348","","","0.0782","0.0846","","","","","","1.042","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052890","12.8828","0.001","12.9682","0.001","25.7657","0.0019","90","","99.404","0.001","90","","4246.7","0.6","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C60 H88 Fe4 Mo12 N4 O40 P -","- C60 H88 Fe4 Mo12 N4 O40 P -","- C120 H176 Fe8 Mo24 N8 O80 P2 -","2","0.5","","Xiong, Jun; Niu, Yujuan; Xu, Haisheng; Cao, Guolei; Liu, Bin; Hu, Huaiming; Xue, Ganglin","Charge-transfer salts based on Lindqvist and Keggin polyoxoanion acceptors and ferrocenyl cationic donors","New Journal of Chemistry","2012","36","5","1224","","10.1039/c2nj20911j","","","0.71073","MoKα","","0.0421","0.0354","","","0.0766","0.0809","","","","","","1.074","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052891","10.4784","0.0014","17.878","0.002","18.967","0.0018","71.198","0.001","87.749","0.003","76.002","0.002","3260.8","0.6","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C61 H68 Cr Mn3 N12 O12 -","- C61 H68 Cr Mn3 N12 O12 -","- C122 H136 Cr2 Mn6 N24 O24 -","2","1","","Shen, Xiaoping; Zhang, Qian; Zhou, Hongbo; Zhou, Hu; Yuan, Aihua","Syntheses, crystal structures and magnetic properties of two low-dimensional cyano-bridged CrIII‒MnII/III assemblies","New Journal of Chemistry","2012","36","5","1180","","10.1039/c2nj20966g","","","0.71073","MoKα","","0.0818","0.0534","","","0.0998","0.1043","","","","","","1.093","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052892","10.1986","0.0012","18.9137","0.0013","13.8337","0.0019","90","","90","","90","","2668.4","0.5","291","2","291","2","","","","","","","","7","P n n 2","P 2 -2n","34","","","","- C46 H38 Cl Cr Mn2 N14 O3 -","- C46 H38 Cl Cr Mn2 N14 O3 -","- C92 H76 Cl2 Cr2 Mn4 N28 O6 -","2","0.5","","Shen, Xiaoping; Zhang, Qian; Zhou, Hongbo; Zhou, Hu; Yuan, Aihua","Syntheses, crystal structures and magnetic properties of two low-dimensional cyano-bridged CrIII‒MnII/III assemblies","New Journal of Chemistry","2012","36","5","1180","","10.1039/c2nj20966g","","","0.71073","MoKα","","0.0739","0.057","","","0.1047","0.1078","","","","","","1.042","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052893","12.036","0.005","23.769","0.009","10.114","0.004","90","","99.954","0.006","90","","2850","2","223","","223","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H8 Cl2 N2 O2 -","- C15 H8 Cl2 N2 O2 -","- C120 H64 Cl16 N16 O16 -","8","2","","Batista, Victor S.; Crabtree, Robert H.; Konezny, Steven J.; Luca, Oana R.; Praetorius, Jeremy M.","Oxidative functionalization of benzylic C‒H bonds by DDQ","New Journal of Chemistry","2012","36","5","1141","","10.1039/c2nj40021a","","","0.71075","MoKα","","","0.0568","","","","0.1481","","","","","","1.045","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052894","8.197","0.0008","12.4418","0.00014","21.9418","0.0003","90","","90","","90","","2237.7","0.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H15 B Zr -","- C13 H15 B Zr -","- C104 H120 B8 Zr8 -","8","1","","Glöckner, Andreas; Cui, Peng; Chen, Yaofeng; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Boratatrozircenes: cycloheptatrienyl zirconium boratabenzene sandwich complexes ‒ evaluation of potential η6‒η5 hapticity interconversions","New Journal of Chemistry","2012","36","6","1392","","10.1039/c2nj40059f","","","1.54184","CuKα","","0.0187","0.018","","","0.0475","0.048","","","","","","1.088","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052895","10.5081","0.0002","11.2379","0.0004","14.8903","0.0004","90","","90","","90","","1758.38","0.09","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 B N2 Zr -","- C20 H25 B N2 Zr -","- C80 H100 B4 N8 Zr4 -","4","1","","Glöckner, Andreas; Cui, Peng; Chen, Yaofeng; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Boratatrozircenes: cycloheptatrienyl zirconium boratabenzene sandwich complexes ‒ evaluation of potential η6‒η5 hapticity interconversions","New Journal of Chemistry","2012","36","6","1392","","10.1039/c2nj40059f","","","0.71073","MoKα","","0.0298","0.0236","","","0.0449","0.0466","","","","","","1.06","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052896","17.093","0.0004","15.9788","0.0002","12.2654","0.0002","90","","108.696","0.002","90","","3173.22","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 B P Zr -","- C16 H24 B P Zr -","- C128 H192 B8 P8 Zr8 -","8","2","","Glöckner, Andreas; Cui, Peng; Chen, Yaofeng; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Boratatrozircenes: cycloheptatrienyl zirconium boratabenzene sandwich complexes ‒ evaluation of potential η6‒η5 hapticity interconversions","New Journal of Chemistry","2012","36","6","1392","","10.1039/c2nj40059f","","","1.54184","CuKα","","0.0372","0.0316","","","0.0809","0.0838","","","","","","1.061","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052897","17.5992","0.0006","8.0986","0.0003","11.9967","0.0005","90","","102.029","0.004","90","","1672.33","0.11","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 B Si Zr -","- C17 H21 B Si Zr -","- C68 H84 B4 Si4 Zr4 -","4","1","","Glöckner, Andreas; Cui, Peng; Chen, Yaofeng; Daniliuc, Constantin G.; Jones, Peter G.; Tamm, Matthias","Boratatrozircenes: cycloheptatrienyl zirconium boratabenzene sandwich complexes ‒ evaluation of potential η6‒η5 hapticity interconversions","New Journal of Chemistry","2012","36","6","1392","","10.1039/c2nj40059f","","","1.54184","CuKα","","0.0642","0.0567","","","0.1505","0.1571","","","","","","1.064","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052898","12.1722","0.0007","6.1586","0.0003","12.0356","0.0006","90","","90.762","0.003","90","","902.15","0.08","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 Cl F5 N -","- C7 H5 Cl F5 N -","- C28 H20 Cl4 F20 N4 -","4","1","","Giese, Michael; Albrecht, Markus; Wiemer, Katharina; Valkonen, Arto; Rissanen, Kari","Controlling the position of anions relative to a pentafluorophenyl group","New Journal of Chemistry","2012","36","6","1368","","10.1039/c2nj40089h","","","0.71073","MoKα","","0.0482","0.0366","","","0.0853","0.0895","","","","","","1.026","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052899","14.8569","0.0005","5.4919","0.0003","23.4876","0.001","90","","90","","90","","1916.41","0.15","123","2","123","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C8 H7 Cl F5 N -","- C8 H7 Cl F5 N -","- C64 H56 Cl8 F40 N8 -","8","2","","Giese, Michael; Albrecht, Markus; Wiemer, Katharina; Valkonen, Arto; Rissanen, Kari","Controlling the position of anions relative to a pentafluorophenyl group","New Journal of Chemistry","2012","36","6","1368","","10.1039/c2nj40089h","","","0.71073","MoKα","","0.0622","0.0462","","","0.1098","0.1201","","","","","","1.048","","","","has coordinates","180082","2020-10-21","18:00:00",""
"7052900","10.369","0.007","12.645","0.009","14.307","0.009","102.839","0.013","92.253","0.014","102.395","0.011","1779","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Catena-(bis(mu2-4,4-trimethylenedipyridine)) copper(ii) dinitrate 1,2-dichlorobenzene methanol solvate","Catena-(bis(mu2-4,4-trimethylenedipyridine)) copper(ii) dinitrate 1,2-dichlorobenzene methanol solvate","","- C33.75 H39 Cl2 Cu N6 O7.75 -","- C33.75 H39 Cl2 Cu N6 O7.75 -","- C67.5 H78 Cl4 Cu2 N12 O15.5 -","2","1","","Liu, Shisi; Ananthoji, Ramakanth; Han, Sungyub; Knudsen, Bernard; Li, Xiao; Wojtas, Lukasz; Massing, Justin; Gauthier, Carmen Valdez; Harmon, Julie P.","Poly(methyl methacrylate) composites of copper-4,4′-trimethylenedipyridine","New Journal of Chemistry","2012","36","7","1449","","10.1039/c2nj20745a","","","0.71073","MoKα","","0.1486","0.0771","","","0.1639","0.193","","","","","","1.013","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052901","9.5655","0.0009","8.3881","0.0007","10.9272","0.0011","90","","91.718","0.008","90","","876.36","0.14","173","2","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Sodium 1-(Carboxylatomethyl-3,5-diaminotriazole dihydrate)","Sodium 1-(Carboxylatomethyl-3,5-diaminotriazole dihydrate)","","- C4 H10 N5 Na O4 -","- C4 H10 N5 Na O4 -","- C16 H40 N20 Na4 O16 -","4","1","","Klapötke, Thomas M.; Nordheider, Andreas; Stierstorfer, Jörg","Synthesis and reactivity of an unexpected highly sensitive 1-carboxymethyl-3-diazonio-5-nitrimino-1,2,4-triazole","New Journal of Chemistry","2012","36","7","1463","","10.1039/c2nj40044h","","","0.71073","MoKα","","0.0547","0.0313","","","0.0492","0.0519","","","","","","0.801","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052902","5.9153","0.0005","9.196","0.0008","9.4344","0.0008","93.949","0.007","90.503","0.007","104.609","0.007","495.25","0.08","173","2","173","","","","","","","","","4","P -1","-P 1","2","","","","- C4 H7 N7 O6 -","- C4 H7 N7 O6 -","- C8 H14 N14 O12 -","2","1","","Klapötke, Thomas M.; Nordheider, Andreas; Stierstorfer, Jörg","Synthesis and reactivity of an unexpected highly sensitive 1-carboxymethyl-3-diazonio-5-nitrimino-1,2,4-triazole","New Journal of Chemistry","2012","36","7","1463","","10.1039/c2nj40044h","","","0.71073","MoKα","","0.0625","0.0322","","","0.0513","0.0556","","","","","","0.802","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052903","10.3123","0.0007","6.8821","0.0005","12.2305","0.0009","90","","98.873","0.007","90","","857.61","0.11","173","2","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H4 N8 O4 -","- C4 H4 N8 O4 -","- C16 H16 N32 O16 -","4","1","","Klapötke, Thomas M.; Nordheider, Andreas; Stierstorfer, Jörg","Synthesis and reactivity of an unexpected highly sensitive 1-carboxymethyl-3-diazonio-5-nitrimino-1,2,4-triazole","New Journal of Chemistry","2012","36","7","1463","","10.1039/c2nj40044h","","","0.71073","MoKα","","0.0557","0.033","","","0.0665","0.0705","","","","","","0.859","","","","has coordinates","276334","2022-06-28","15:34:06",""
"7052904","23.681","0.008","4.9756","0.0018","33.914","0.012","90","","94.726","0.005","90","","3982","2","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 O4 -","- C24 H22 O4 -","- C192 H176 O32 -","8","1","","Boiani, Mattia; Baschieri, Andrea; Cesari, Cristiana; Mazzoni, Rita; Stagni, Stefano; Zacchini, Stefano; Sambri, Letizia","A new tetraarylcyclopentadienone based low molecular weight gelator: synthesis, self-assembly properties and anion recognition","New Journal of Chemistry","2012","36","7","1469","","10.1039/c2nj40073a","","","0.71073","MoKα","","0.1309","0.0986","","","0.2606","0.2948","","","","","","1.02","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052905","6.0489","0.0017","13.222","0.004","20.272","0.006","73.883","0.004","86.839","0.004","77.762","0.004","1522.2","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C39 H32 O3 -","- C39 H32 O3 -","- C78 H64 O6 -","2","1","","Boiani, Mattia; Baschieri, Andrea; Cesari, Cristiana; Mazzoni, Rita; Stagni, Stefano; Zacchini, Stefano; Sambri, Letizia","A new tetraarylcyclopentadienone based low molecular weight gelator: synthesis, self-assembly properties and anion recognition","New Journal of Chemistry","2012","36","7","1469","","10.1039/c2nj40073a","","","0.71073","MoKα","","0.231","0.1055","","","0.2703","0.3554","","","","","","1.008","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052906","8.7424","0.0002","8.9246","0.0002","11.6251","0.0003","90","","108.592","0.001","90","","859.68","0.04","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis(μ-amino-ethanolato-κN,O:O)-dibromido-tricopper(II)","","- C8 H24 Br2 Cu3 N4 O4 -","- C8 H24 Br2 Cu3 N4 O4 -","- C16 H48 Br4 Cu6 N8 O8 -","2","0.5","","Maclaren, Jana K.; Sanchiz, Joaquín; Gili, Pedro; Janiak, Christoph","Hydrophobic-exterior layer structures and magnetic properties of trinuclear copper complexes with chiral amino alcoholate ligands","New Journal of Chemistry","2012","36","8","1596","","10.1039/c2nj40063d","","","0.71073","MoKα","","0.0473","0.0366","","","0.0924","0.0991","","","","","","1.042","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052907","9.0782","0.0018","11.603","0.002","12.489","0.003","102.76","0.03","100.94","0.03","90","0.03","1258.5","0.5","118","2","118","2","","","","","","","","6","P 1","P 1","1","","Tetrakis(μ-(R)-2-amino-butan-1-olato-κN,O:O)-dibromido-tricopper(II)","","- C16 H40 Br2 Cu3 N4 O4 -","- C16 H40 Br2 Cu3 N4 O4 -","- C32 H80 Br4 Cu6 N8 O8 -","2","2","","Maclaren, Jana K.; Sanchiz, Joaquín; Gili, Pedro; Janiak, Christoph","Hydrophobic-exterior layer structures and magnetic properties of trinuclear copper complexes with chiral amino alcoholate ligands","New Journal of Chemistry","2012","36","8","1596","","10.1039/c2nj40063d","","","0.71073","MoKα","","0.1358","0.0994","","","0.2423","0.273","","","","","","0.994","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052908","10.27","0.0017","12.8186","0.0016","20.588","0.003","90","","93.281","0.008","90","","2705.9","0.7","103","2","103","2","","","","","","","","6","P 1 21 1","P 2yb","4","Bis(bis(mu-(R)-2-amino-butan-1-olato-kappaN,O:O)-dibromido- dicopper(ii))-(bis((R)-2-amino-butan-1-ol-kappaN,O)-dibromido- copper(ii))-(((R)-2-amino-butan-1-ol-kappaN,O)-dibromido-methanol- copper(ii))","Bis[bis(μ-(R)-2-amino-butan-1-olato-κN,O:O)-dibromido-dicopper(II)]- [bis((R)-2-amino-butan-1-ol-κN,O)-dibromido-copper(II)]- [((R)-2-amino-butan-1-ol-κN,O)-dibromido-methanol-copper(II)]","","- C29 H77 Br8 Cu6 N7 O8 -","- C29 H77 Br8 Cu6 N7 O8 -","- C58 H154 Br16 Cu12 N14 O16 -","2","1","","Maclaren, Jana K.; Sanchiz, Joaquín; Gili, Pedro; Janiak, Christoph","Hydrophobic-exterior layer structures and magnetic properties of trinuclear copper complexes with chiral amino alcoholate ligands","New Journal of Chemistry","2012","36","8","1596","","10.1039/c2nj40063d","","","0.71073","MoKα","","0.1149","0.0649","","","0.126","0.1502","","","","","","1.039","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052909","10.3649","0.0003","12.7064","0.0003","19.3781","0.0005","90","","92.255","0.002","90","","2550.13","0.12","103","2","103","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Bis[bis(μ-(R)-2-amino-butan-1-olato-κN,O:O)-dibromido-dicopper(II)]- bis[((R)-2-amino-butan-1-ol-κN,O)-dibromido-ethanol-copper(II)]","","- C28 H74 Cl8 Cu6 N6 O8 -","- C28 H74 Cl8 Cu6 N6 O8 -","- C56 H148 Cl16 Cu12 N12 O16 -","2","1","","Maclaren, Jana K.; Sanchiz, Joaquín; Gili, Pedro; Janiak, Christoph","Hydrophobic-exterior layer structures and magnetic properties of trinuclear copper complexes with chiral amino alcoholate ligands","New Journal of Chemistry","2012","36","8","1596","","10.1039/c2nj40063d","","","0.71073","MoKα","","0.096","0.0494","","","0.0912","0.1095","","","","","","1.04","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052910","16.226","0.0003","16.2256","0.0003","5.601","0.0001","90","","90","","90","","1474.61","0.05","100","2","100","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","Bis[rac-(2-amino-butan-1-olato-κN,O)-rac-(2-amino-butan-1-ol-κN,O)-aqua- copper(II)] di-perchlorate","","- C16 H46 Cl2 Cu2 N4 O14 -","- C16 H45.77 Cl2 Cu2 N4 O14 -","- C32 H91.54 Cl4 Cu4 N8 O28 -","2","0.5","","Maclaren, Jana K.; Sanchiz, Joaquín; Gili, Pedro; Janiak, Christoph","Hydrophobic-exterior layer structures and magnetic properties of trinuclear copper complexes with chiral amino alcoholate ligands","New Journal of Chemistry","2012","36","8","1596","","10.1039/c2nj40063d","","","0.71073","MoKα","","0.0602","0.0558","","","0.155","0.1606","","","","","","1.058","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7052911","16.0982","0.0007","8.9954","0.0006","30.894","0.0018","90","","101.433","0.004","90","","4385","0.4","120","2","120","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H36 N2 O3 S Si -","- C17 H36 N2 O3 S Si -","- C136 H288 N16 O24 S8 Si8 -","8","1","","Baranowska, Katarzyna; Piwowarska, Natalia; Herman, Aleksander; Dołęga, Anna","Imidazolium silanethiolates relevant to the active site of cysteine proteases. A cooperative effect in a chain of NH+⋯S− hydrogen bonds","New Journal of Chemistry","2012","36","8","1574","","10.1039/c2nj40114b","","x-ray","0.71073","MoKα","","0.089","0.0644","","","0.1578","0.1742","","","","","","1.332","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052912","15.8343","0.0004","9.0503","0.0001","15.8977","0.0006","90","","109.061","0.004","90","","2153.31","0.11","120","2","120","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H34 N2 O3 S Si -","- C16 H34 N2 O3 S Si -","- C64 H136 N8 O12 S4 Si4 -","4","1","","Baranowska, Katarzyna; Piwowarska, Natalia; Herman, Aleksander; Dołęga, Anna","Imidazolium silanethiolates relevant to the active site of cysteine proteases. A cooperative effect in a chain of NH+⋯S− hydrogen bonds","New Journal of Chemistry","2012","36","8","1574","","10.1039/c2nj40114b","","x-ray","0.71073","MoKα","","0.0465","0.0409","","","0.1077","0.1161","","","","","","1.117","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052913","15.691","0.008","9.7022","0.0009","31.2081","0.0012","90","","103.24","0.05","90","","4625","3","120","2","120","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H38 N2 O3 S Si -","- C18 H38 N2 O3 S Si -","- C144 H304 N16 O24 S8 Si8 -","8","1","","Baranowska, Katarzyna; Piwowarska, Natalia; Herman, Aleksander; Dołęga, Anna","Imidazolium silanethiolates relevant to the active site of cysteine proteases. A cooperative effect in a chain of NH+⋯S− hydrogen bonds","New Journal of Chemistry","2012","36","8","1574","","10.1039/c2nj40114b","","x-ray","0.71073","MoKα","","0.0496","0.0437","","","0.1094","0.1122","","","","","","1.089","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052914","9.1371","0.0014","9.2116","0.0015","10.2632","0.0017","63.521","0.008","68.961","0.007","72.657","0.007","711.7","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Cu2 N4 O12 -","- C26 H28 Cu2 N4 O12 -","- C26 H28 Cu2 N4 O12 -","1","0.5","","Kopylovich, Maximilian N.; Gajewska, Malgorzata J.; Mahmudov, Kamran T.; Kirillova, Marina V.; Figiel, Paweł J.; Guedes da Silva, M. Fátima C.; Gil-Hernández, Beatriz; Sanchiz, Joaquin; Pombeiro, Armando J. L.","Copper(ii) complexes with a new carboxylic-functionalized arylhydrazone of β-diketone as effective catalysts for acid-free oxidations","New Journal of Chemistry","2012","36","8","1646","","10.1039/c2nj40210f","","","0.71069","MoKα","","0.0896","0.0442","","","0.1041","0.1243","","","","","","0.976","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052915","8.6358","0.0002","10.3215","0.0002","10.8552","0.0003","85.894","0.001","71.985","0.002","66.528","0.001","842.52","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H19 Cu N3 O7 -","- C15 H19 Cu N3 O7 -","- C30 H38 Cu2 N6 O14 -","2","1","","Kopylovich, Maximilian N.; Gajewska, Malgorzata J.; Mahmudov, Kamran T.; Kirillova, Marina V.; Figiel, Paweł J.; Guedes da Silva, M. Fátima C.; Gil-Hernández, Beatriz; Sanchiz, Joaquin; Pombeiro, Armando J. L.","Copper(ii) complexes with a new carboxylic-functionalized arylhydrazone of β-diketone as effective catalysts for acid-free oxidations","New Journal of Chemistry","2012","36","8","1646","","10.1039/c2nj40210f","","","0.71069","MoKα","","0.028","0.025","","","0.0689","0.0716","","","","","","0.973","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7052916","11.277","0.001","15.661","0.001","19.109","0.002","90","","96.66","0.01","90","","3352","0.5","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","iodo-(2,9-dimetyl-1,10-phenanthroline-N,N')- (tris(thiomorpholinomethyl) phosphine-P)-copper(i) hydrate","iodo-(2,9-dimetyl-1,10-phenanthroline-N,N')-(tris(thiomorpholinomethyl) phosphine-P)-copper(i) hydrate","","- C29 H42.4 Cu I N5 O0.2 P S3 -","- C29 H42 Cu I N5 O0.2 P S3 -","- C116 H168 Cu4 I4 N20 O0.8 P4 S12 -","4","1","","Starosta, Radosław; Komarnicka, Urszula K.; Puchalska, Małgorzata; Barys, Maciej","Solid state luminescence of copper(i) (pseudo)halide complexes with neocuproine and aminomethylphosphanes derived from morpholine and thiomorpholine","New Journal of Chemistry","2012","36","8","1673","","10.1039/c2nj40229g","","","0.71073","MoKα","","0.0501","0.0297","","","0.0664","0.0696","","","","","","0.923","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052917","8.067","0.001","13.205","0.001","16.127","0.002","86.1","0.02","76.29","0.01","77.52","0.01","1629.3","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","Isothiocyanato-(2,9-dimetyl-1,10-phenanthroline-N,N') -(tris(morpholinomethyl)phosphine-P)-copper(i)","","- C30 H42 Cu N6 O3 P S -","- C30 H42 Cu N6 O3 P S -","- C60 H84 Cu2 N12 O6 P2 S2 -","2","1","","Starosta, Radosław; Komarnicka, Urszula K.; Puchalska, Małgorzata; Barys, Maciej","Solid state luminescence of copper(i) (pseudo)halide complexes with neocuproine and aminomethylphosphanes derived from morpholine and thiomorpholine","New Journal of Chemistry","2012","36","8","1673","","10.1039/c2nj40229g","","","0.71073","MoKα","","0.1108","0.0453","","","0.0711","0.0804","","","","","","0.822","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052918","9.313","0.001","13.258","0.005","14.436","0.002","87.45","0.01","84.99","0.01","71.36","0.02","1682.2","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","isothiocyanato-(2,9-dimetyl-1,10-phenanthroline-N,N')- (tris(thiomorpholinomethyl) phosphine-P)-copper(i)","","- C30 H42 Cu N6 P S4 -","- C30 H42 Cu N6 P S4 -","- C60 H84 Cu2 N12 P2 S8 -","2","1","","Starosta, Radosław; Komarnicka, Urszula K.; Puchalska, Małgorzata; Barys, Maciej","Solid state luminescence of copper(i) (pseudo)halide complexes with neocuproine and aminomethylphosphanes derived from morpholine and thiomorpholine","New Journal of Chemistry","2012","36","8","1673","","10.1039/c2nj40229g","","","0.71073","MoKα","","0.1647","0.0615","","","0.117","0.1398","","","","","","0.809","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052919","9.2902","0.0002","13.6836","0.0003","16.069","0.0003","85.521","0.001","80.357","0.001","88.534","0.001","2007.57","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H27 D8 N7.5 O5 -","- C51.25 H27 D8 N7.25 O5 -","- C102.5 H54 D16 N14.5 O10 -","2","1","","Fernández-Mato, Antonio; Quintela, José M.; Peinador, Carlos","Novel naphthyridine-based compounds in small molecular non-doped OLEDs: synthesis, properties and their versatile applications for organic light-emitting diodes","New Journal of Chemistry","2012","36","8","1634","","10.1039/c2nj40279c","","","0.71073","MoKα","","0.0762","0.0533","","","0.1468","0.1686","","","","","","1.062","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052920","6.98977","0.00007","20.8653","0.0002","14.1374","0.0001","90","","92.862","0.001","90","","2059.28","0.03","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 B F4 N4 Pd -","- C20 H23 B F4 N4 Pd -","- C80 H92 B4 F16 N16 Pd4 -","4","1","","Khlebnikov, Vsevolod; Meduri, Angelo; Mueller-Bunz, Helge; Milani, Barbara; Albrecht, Martin","Synthesis of a sterically modulated pyridine‒NHC palladium complex and its reactivity towards ethylene","New Journal of Chemistry","2012","36","8","1552","","10.1039/c2nj40287d","","","0.71073","MoKα","","0.0255","0.0209","","","0.0484","0.0509","","","","","","1.074","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052921","13.8296","0.0005","6.6323","0.0002","35.6388","0.0012","90","","90.16","0.003","90","","3268.85","0.19","100","","100","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C15 H14 N6 O6 -","- C15 H14 N6 O6 -","- C120 H112 N48 O48 -","8","2","","Hofmann, Katja; Brumm, Susann; Mende, Carola; Nagel, Kevin; Seifert, Andreas; Roth, Isabelle; Schaarschmidt, Dieter; Lang, Heinrich; Spange, Stefan","Solvatochromism and acidochromism of azobenzene-functionalized poly(vinyl amines)","New Journal of Chemistry","2012","36","8","1655","","10.1039/c2nj40313g","","","1.54184","CuKα","","0.0325","0.0283","","","0.0673","0.0683","","","","","","0.995","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052922","11.6164","0.0011","7.8216","0.0006","22.019","0.0019","90","","100.544","0.011","90","","1966.8","0.3","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H17 Fe N3 O4 -","- C23 H17 Fe N3 O4 -","- C92 H68 Fe4 N12 O16 -","4","1","","Gasser, Gilles; Mari, Cristina; Burkart, Michelle; Green, Stephen J.; Ribas, Joan; Stoeckli-Evans, Helen; Tucker, James H. R.","Electrochemical, spectroscopic, magnetic and structural studies of complexes bearing ferrocenyl ligands of N-(3-hydroxypicolinoyl)picolinamide","New Journal of Chemistry","2012","36","9","1819","","10.1039/c2nj40177k","","","0.71073","MoKα","","0.0791","0.0453","","","0.0973","0.1038","","","","","","0.901","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052923","16.391","0.005","18.117","0.005","13.078","0.005","90","","91.029","0.005","90","","3883","2","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H26 Cl6 Fe N6 O8 -","- C38 H26 Cl6 Fe N6 O8 -","- C152 H104 Cl24 Fe4 N24 O32 -","4","1","","Gasser, Gilles; Mari, Cristina; Burkart, Michelle; Green, Stephen J.; Ribas, Joan; Stoeckli-Evans, Helen; Tucker, James H. R.","Electrochemical, spectroscopic, magnetic and structural studies of complexes bearing ferrocenyl ligands of N-(3-hydroxypicolinoyl)picolinamide","New Journal of Chemistry","2012","36","9","1819","","10.1039/c2nj40177k","","","0.71073","MoKα","","0.0722","0.0439","","","0.0888","0.0961","","","","","","1.005","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052924","20.0421","0.0016","14.6971","0.0007","15.7895","0.001","90","","97.747","0.006","90","","4608.5","0.5","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H35 Cu2 Fe2 I2 N7 O8 -","- C46 H32 Cu2 Fe2 I2 N6 O8 -","- C184 H128 Cu8 Fe8 I8 N24 O32 -","4","1","","Gasser, Gilles; Mari, Cristina; Burkart, Michelle; Green, Stephen J.; Ribas, Joan; Stoeckli-Evans, Helen; Tucker, James H. R.","Electrochemical, spectroscopic, magnetic and structural studies of complexes bearing ferrocenyl ligands of N-(3-hydroxypicolinoyl)picolinamide","New Journal of Chemistry","2012","36","9","1819","","10.1039/c2nj40177k","","","0.71073","MoKα","","0.0699","0.0458","","","0.1066","0.1196","","","","","","1.013","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052925","21.131","0.002","15.2094","0.001","11.9706","0.0012","90","","97.344","0.008","90","","3815.7","0.6","153","2","153","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C39.5 H27.25 Cu2 Fe I2 N7.75 O8 -","- C36 H22 Cu2 Fe I2 N6 O8 -","- C144 H88 Cu8 Fe4 I8 N24 O32 -","4","0.5","","Gasser, Gilles; Mari, Cristina; Burkart, Michelle; Green, Stephen J.; Ribas, Joan; Stoeckli-Evans, Helen; Tucker, James H. R.","Electrochemical, spectroscopic, magnetic and structural studies of complexes bearing ferrocenyl ligands of N-(3-hydroxypicolinoyl)picolinamide","New Journal of Chemistry","2012","36","9","1819","","10.1039/c2nj40177k","","","0.71073","MoKα","","0.075","0.0529","","","0.1233","0.1323","","","","","","1.032","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052926","6.485","0.004","5.583","0.003","10.854","0.006","90","","90.786","0.008","90","","392.9","0.4","153","2","153","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C2 H4 N12 -","- C2 H4 N12 -","- C4 H8 N24 -","2","0.5","","Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao","1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound","New Journal of Chemistry","2012","36","10","1953","","10.1039/c2nj40109f","","","0.71073","MoKα","","0.0463","0.0371","","","0.0826","0.0874","","","","","","1.001","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052927","8.661","0.003","8.102","0.002","10.043","0.003","90","","115.001","0.003","90","","638.7","0.3","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C8 H12 N12 -","- C8 H12 N12 -","- C16 H24 N24 -","2","0.5","","Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao","1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound","New Journal of Chemistry","2012","36","10","1953","","10.1039/c2nj40109f","","","0.71073","MoKα","","0.0498","0.0386","","","0.0949","0.1006","","","","","","0.998","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052928","7.533","0.003","7.408","0.002","12.029","0.004","90","","96.629","0.004","90","","666.8","0.4","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C4 H8 N6 -","- C4 H8 N6 -","- C16 H32 N24 -","4","1","","Li, Fang; Cong, Xiaomin; Du, Zhiming; He, Chunlin; Zhao, Linshuang; Meng, Lingqiao","1,1′-Diamino-5,5′-azotetrazole: a nitrogen rich compound","New Journal of Chemistry","2012","36","10","1953","","10.1039/c2nj40109f","","","0.71073","MoKα","","0.0645","0.0433","","","0.08","0.0878","","","","","","0.999","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052929","8.779","0.0002","24.3199","0.0006","30.6605","0.0008","71.677","0.002","84.871","0.002","83.43","0.002","6163.5","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","(cyclopropanecarboxylic acid).(isonicotinamide)","(cyclopropanecarboxylic acid).(isonicotinamide)","","- C10 H12 N2 O3 -","- C10 H12 N2 O3 -","- C240 H288 N48 O72 -","24","12","","Lemmerer, Andreas; Fernandes, Manuel A.","Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide","New Journal of Chemistry","2012","36","11","2242","","10.1039/c2nj40186j","","","0.71073","MoKα","","0.1278","0.0627","","","0.1644","0.2002","","","","","","1.027","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052930","16.1822","0.0011","4.8068","0.0003","21.7053","0.0015","90","","102.36","0.004","90","","1649.21","0.19","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(cyclobutanecarboxylic acid).(isonicotinamide) Form I","bis(cyclobutanecarboxylic acid).(isonicotinamide) Form I","","- C16 H22 N2 O5 -","- C16 H22 N2 O5 -","- C64 H88 N8 O20 -","4","1","","Lemmerer, Andreas; Fernandes, Manuel A.","Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide","New Journal of Chemistry","2012","36","11","2242","","10.1039/c2nj40186j","","","0.71073","MoKα","","0.1093","0.0517","","","0.1145","0.1403","","","","","","0.984","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052931","10.505","0.0008","12.843","0.001","13.081","0.001","101.339","0.003","90.243","0.003","101.687","0.003","1692.7","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","bis(cyclobutanecarboxylic acid).(isonicotinamide) Form II","bis(cyclobutanecarboxylic acid).(isonicotinamide) Form II","","- C16 H22 N2 O5 -","- C16 H22 N2 O5 -","- C64 H88 N8 O20 -","4","2","","Lemmerer, Andreas; Fernandes, Manuel A.","Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide","New Journal of Chemistry","2012","36","11","2242","","10.1039/c2nj40186j","","","0.71073","MoKα","","0.1566","0.0574","","","0.1196","0.1592","","","","","","0.975","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052932","6.9305","0.0007","8.9843","0.0008","10.836","0.001","113.556","0.003","95.236","0.003","97.39","0.003","605.75","0.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","(cylopentanecarboxylic acid).(isonicotinamide) Form II","(cylopentanecarboxylic acid).(isonicotinamide) Form II","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C24 H32 N4 O6 -","2","1","","Lemmerer, Andreas; Fernandes, Manuel A.","Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide","New Journal of Chemistry","2012","36","11","2242","","10.1039/c2nj40186j","","","0.71073","MoKα","","0.0754","0.0491","","","0.1284","0.1451","","","","","","1.025","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052933","6.991","0.0001","8.981","0.0001","11.398","0.0001","67.479","0.001","81.065","0.001","83.458","0.001","651.877","0.014","173","2","173","2","","","","","","","","4","P -1","-P 1","2","(cyclohexanecarboxylic acid).(isonicotinamide) Form II","(cyclohexanecarboxylic acid).(isonicotinamide) Form II","","- C13 H18 N2 O3 -","- C13 H18 N2 O3 -","- C26 H36 N4 O6 -","2","1","","Lemmerer, Andreas; Fernandes, Manuel A.","Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide","New Journal of Chemistry","2012","36","11","2242","","10.1039/c2nj40186j","","","0.71073","MoKα","","0.0669","0.0389","","","0.0937","0.1063","","","","","","1.002","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052934","6.9587","0.0004","9.0375","0.0005","12.3302","0.0008","68.763","0.003","76.211","0.003","82.636","0.003","701.2","0.07","336","2","336","2","","","","","","","","4","P -1","-P 1","2","(cyclohexanecarboxylic acid).(isonicotinamide) Form I","(cyclohexanecarboxylic acid).(isonicotinamide) Form I","","- C13 H18 N2 O3 -","- C13 H18 N2 O3 -","- C26 H36 N4 O6 -","2","1","","Lemmerer, Andreas; Fernandes, Manuel A.","Adventures in co-crystal land: high Z′, stoichiometric variations, polymorphism and phase transitions in the co-crystals of four liquid and solid cyclic carboxylic acids with the supramolecular reagent isonicotinamide","New Journal of Chemistry","2012","36","11","2242","","10.1039/c2nj40186j","","","0.71073","MoKα","","0.1331","0.0739","","","0.2275","0.2788","","","","","","1.056","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052935","6.3808","0.0003","7.4452","0.0003","12.7044","0.0005","90","","90","","90","","603.54","0.04","293","","293","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Cu H4.8 N6.8 O1.2 -","- Cu H4.8 N6.8 O1.2 -","- Cu4 H19.2 N27.2 O4.8 -","4","0.5","","Tommasino, Jean-Bernard; Chastanet, Guillaume; Guennic, Boris Le; Robert, Vincent; Pilet, Guillaume","A 1D coordination polymer built on asymmetric μ1,1,3-azide bridge: from unusual topology to magnetic properties and Cu(ii)/Cu(i) redox reversibility","New Journal of Chemistry","2012","36","11","2228","","10.1039/c2nj40302a","","","0.71073","MoKα","","0.029","0.0237","","0.0298","0.027","0.0256","","","","","","1.1142","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052936","26.907","0.004","29.784","0.004","20.352","0.003","90","","90","","90","","16310","4","133","2","133","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","heptakis(2,6-di-O-methyl)-beta-cyclodextrin.6,7,8,9,10,10 - hexachloro-1,5,5a,6,9,9a-hexahydro-6,9-methano-2,4,3-benzodioxathiepin 3-oxide","heptakis(2,6-di-O-methyl)-beta-cyclodextrin.6,7,8,9,10,10 -hexachloro-1,5,5a,6,9,9a-hexahydro-6,9-methano-2,4,3- benzodioxathiepin 3-oxide","","- C65 H106.08 Cl6 O39.04 S -","- C65 H103 Cl6 O39.045 S -","- C520 H824 Cl48 O312.36 S8 -","8","2","","Cruickshank, Dyanne L.; Bourne, Susan A.; Caira, Mino R.","A solid-state study of the inclusion of endosulfan in native and derivatised cyclodextrins using X-ray diffraction and thermoanalytical methods","New Journal of Chemistry","2012","36","10","2007","","10.1039/c2nj40364a","","","0.71073","MoKα","","0.185","0.1023","","","0.2548","0.3065","","","","","","0.974","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052937","11.408","0.003","8.848","0.002","18.193","0.005","90","","97.562","0.011","90","","1820.4","0.8","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 B F2 N2 O2 -","- C20 H19 B F2 N2 O2 -","- C80 H76 B4 F8 N8 O8 -","4","1","","Tsay, Olga G.; Lee, Kang Mun; Churchill, David G.","Selective and competitive cysteine chemosensing: resettable fluorescent “turn on” aqueous detection via Cu2+ displacement and salicylaldimine hydrolysis","New Journal of Chemistry","2012","36","10","1949","","10.1039/c2nj40387k","","","0.71073","MoKα","","0.0691","0.0504","","","0.1167","0.1272","","","","","","1.032","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052938","13.996","0.002","11.0508","0.0017","14.095","0.002","90","","100.373","0.007","90","","2144.4","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H25 B F2 N2 O2 -","- C23 H25 B F2 N2 O2 -","- C92 H100 B4 F8 N8 O8 -","4","1","","Tsay, Olga G.; Lee, Kang Mun; Churchill, David G.","Selective and competitive cysteine chemosensing: resettable fluorescent “turn on” aqueous detection via Cu2+ displacement and salicylaldimine hydrolysis","New Journal of Chemistry","2012","36","10","1949","","10.1039/c2nj40387k","","","0.71073","MoKα","","0.1","0.0844","","","0.2186","0.2299","","","","","","1.07","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052939","5.3358","0.0006","13.3538","0.0013","13.894","0.0018","101.26","0.01","90.396","0.01","101.111","0.009","951.72","0.19","160","","160","","","","","","","","","4","P -1","-P 1","2","","","","- C32 H60 Ni S8 -","- C32 H60 Ni S8 -","- C32 H60 Ni S8 -","1","0.5","","Bui, Thanh-Tuan; Vuong, Minh Ha; Bonneval, Bénédicte Garreau-de; Alary, Fabienne; Kane, Jacob; Duhayon, Carine; Sournia-Saquet, Alix; Moineau-Chane-Ching, Kathleen I.","Synthesis, X-ray crystal structures, optical properties and modelling data of neutral bis(1,2-dithiolene) nickel complexes of the “non-cyclic SR” family","New Journal of Chemistry","2012","36","10","2033","","10.1039/c2nj40398f","","","0.71073","MoKα","","0.1399","0.0457","","0.1185","0.0508","0.0508","","","","","","1.0969","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052940","26.182","0.002","6.4642","0.0006","19.9353","0.0011","90","","107.729","0.006","90","","3213.7","0.4","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C24 H44 Ni S8 -","- C24 H44 Ni S8 -","- C96 H176 Ni4 S32 -","4","0.5","","Bui, Thanh-Tuan; Vuong, Minh Ha; Bonneval, Bénédicte Garreau-de; Alary, Fabienne; Kane, Jacob; Duhayon, Carine; Sournia-Saquet, Alix; Moineau-Chane-Ching, Kathleen I.","Synthesis, X-ray crystal structures, optical properties and modelling data of neutral bis(1,2-dithiolene) nickel complexes of the “non-cyclic SR” family","New Journal of Chemistry","2012","36","10","2033","","10.1039/c2nj40398f","","","0.71073","MoKα","","0.0628","0.0316","","0.0653","0.0361","0.0361","","","","","","1.0474","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052941","6.8273","0.0006","12.263","0.0011","7.4173","0.0007","90","","97.954","0.002","90","","615.03","0.1","273","2","273","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","","","- C14 H12 N4 -","- C14 H12 N4 -","- C28 H24 N8 -","2","0.5","","Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun","Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups","New Journal of Chemistry","2012","36","12","2520","","10.1039/c2nj40399d","","","0.71073","MoKα","","0.0472","0.0434","","","0.1277","0.1329","","","","","","1.088","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052942","9.1806","0.0019","16.9307","0.0009","11.4029","0.0011","90","","112.485","0.014","90","","1637.7","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 Ag N5 O4.5 -","- C14 H14 Ag N5 O4.5 -","- C56 H56 Ag4 N20 O18 -","4","1","","Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun","Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups","New Journal of Chemistry","2012","36","12","2520","","10.1039/c2nj40399d","","","0.71073","MoKα","","0.0537","0.037","","","0.0957","0.1052","","","","","","1.019","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052943","9.3461","0.0013","16.2898","0.0015","12.2215","0.0015","90","","108.782","0.009","90","","1761.6","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 Ag Cl N4 O5 -","- C15 H15 Ag Cl N4 O5 -","- C60 H60 Ag4 Cl4 N16 O20 -","4","1","","Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun","Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups","New Journal of Chemistry","2012","36","12","2520","","10.1039/c2nj40399d","","","0.71073","MoKα","","0.1071","0.0497","","","0.0972","0.118","","","","","","1.01","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052944","9.3243","0.0008","16.2532","0.0008","12.1352","0.0007","90","","109.483","0.005","90","","1733.8","0.2","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 Ag B F4 N4 O -","- C15 H16 Ag B F4 N4 O -","- C60 H64 Ag4 B4 F16 N16 O4 -","4","1","","Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun","Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups","New Journal of Chemistry","2012","36","12","2520","","10.1039/c2nj40399d","","x-ray","0.71073","MoKα","","0.0512","0.0378","","","0.0903","0.0969","","","","","","1.035","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052945","5.8153","0.0006","12.6387","0.0012","16.3614","0.0015","90","","92.692","0.002","90","","1201.2","0.2","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N4 -","- C14 H12 N4 -","- C56 H48 N16 -","4","1","","Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun","Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups","New Journal of Chemistry","2012","36","12","2520","","10.1039/c2nj40399d","","","0.71073","MoKα","","0.0628","0.0453","","","0.1207","0.1342","","","","","","1.043","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052946","8.4131","0.0006","12.2429","0.001","15.7364","0.0012","90.055","0.001","98.513","0.002","107.133","0.002","1530.2","0.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H24 Ag2 N10 O6 -","- C28 H24 Ag2 N10 O6 -","- C56 H48 Ag4 N20 O12 -","2","1","","Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun","Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups","New Journal of Chemistry","2012","36","12","2520","","10.1039/c2nj40399d","","","0.71073","MoKα","","0.0594","0.0385","","","0.0892","0.0984","","","","","","1.031","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052947","8.909","0.0011","11.0665","0.0014","14.3207","0.0017","99.183","0.002","101.952","0.002","91.228","0.002","1361.4","0.3","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H24.5 Ag N8 O2 S0.5 -","- C28 H24.5 Ag N8 O2 S0.5 -","- C56 H49 Ag2 N16 O4 S -","2","1","","Yeh, Chun-Wei; Chang, Wen-Jung; Suen, Maw-Cherng; Jou, Chi-Hsiung; Wang, Ju-Chun","Silver(i) supramolecular complexes generated from polydentate ligands containing cyano and pyridyl groups","New Journal of Chemistry","2012","36","12","2520","","10.1039/c2nj40399d","","","0.71073","MoKα","","0.1349","0.0977","","","0.2666","0.336","","","","","","1.162","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7052948","8.3257","0.0007","11.2037","0.0009","15.5132","0.0013","70.668","0.004","75.604","0.004","84.442","0.004","1322.42","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H27 N6 O9 -","- C27 H27 N6 O9 -","- C54 H54 N12 O18 -","2","1","","Jung, Sung Ho; Lee, Hyejin; Park, Sunhong; Jung, Jong Hwa","A cyanurate gel derived from two different hydrogen-bonding interactions in a binary system: evidence for the driving forces in gel formation","New Journal of Chemistry","2012","36","10","1957","","10.1039/c2nj40405b","","","0.71073","MoKα","","0.0549","0.0488","","","0.1392","0.1459","","","","","","1.047","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052949","11.9596","0.0003","12.1855","0.0002","19.6639","0.0002","90","","90","","90","","2865.69","0.09","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H42 Co2 N4 O14 -","- C20 H34 Co2 N4 O14 -","- C80 H136 Co8 N16 O56 -","4","1","","Prikhod'ko, Alexander; Pointillart, Fabrice; Golhen, Stéphane; Gavrilenko, Konstantin S.; Ouahab, Lahcène; Kolotilov, Sergey V.","Synthesis, structure, circular dichroism of a Δ(−)546-di-μ-hydroxo-tetrakis(S-prolinato)dicobalt(iii) complex and NMR study of its interaction with chiral and non-chiral probes in solutions","New Journal of Chemistry","2012","36","10","2070","","10.1039/c2nj40447h","","","0.71073","MoKα","","0.0563","0.045","","","0.1168","0.1241","","","","","","1.097","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052950","22.602","0.008","5.5689","0.0019","20.209","0.007","90","","109.72","0.006","90","","2394.5","1.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Z-4-phenyl-1-(pyridine-2-ylmethylene)semicarbazide","","","- C13 H12 N4 O -","- C13 H12 N4 O -","- C104 H96 N32 O8 -","8","2","","Lin, Lirong; Fan, Weizhen; Chen, Shui; Ma, Jie; Hu, Wangxia; Lin, Yiji; Zhang, Hui; Huang, Rongbin","Photochromism of (E)-4-phenyl-1-(pyridine-2-ylmethylene)semicarbazide","New Journal of Chemistry","2012","36","12","2562","","10.1039/c2nj40468k","","","0.71073","MoKα","","0.0999","0.0711","","","0.1566","0.1723","","","","","","1.085","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052951","17.889","0.003","8.6684","0.0009","18.288","0.002","90","","90","","90","","2835.9","0.6","153","2","153","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C29 H30 N8 O3 -","- C29 H30 N8 O3 -","- C116 H120 N32 O12 -","4","0.5","","Lin, Lirong; Fan, Weizhen; Chen, Shui; Ma, Jie; Hu, Wangxia; Lin, Yiji; Zhang, Hui; Huang, Rongbin","Photochromism of (E)-4-phenyl-1-(pyridine-2-ylmethylene)semicarbazide","New Journal of Chemistry","2012","36","12","2562","","10.1039/c2nj40468k","","","0.71073","MoKα","","0.1005","0.0759","","","0.2082","0.2268","","","","","","1.073","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052952","5.1873","0.0003","9.245","0.0005","25.3594","0.0011","90","","90","","90","","1216.15","0.11","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H12 N4 O -","- C13 H12 N4 O -","- C52 H48 N16 O4 -","4","1","","Lin, Lirong; Fan, Weizhen; Chen, Shui; Ma, Jie; Hu, Wangxia; Lin, Yiji; Zhang, Hui; Huang, Rongbin","Photochromism of (E)-4-phenyl-1-(pyridine-2-ylmethylene)semicarbazide","New Journal of Chemistry","2012","36","12","2562","","10.1039/c2nj40468k","","","0.71073","MoKα","","0.0732","0.0338","","","0.0544","0.062","","","","","","0.816","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052953","12.3212","0.0007","40.491","0.002","12.8009","0.0007","90","","97.002","0.001","90","","6338.7","0.6","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C67 H90 In N5 O6 -","- C67 H90 In N5 O6 -","- C268 H360 In4 N20 O24 -","4","2","","Ilyakina, Ekaterina V.; Poddel'sky, Andrey I.; Piskunov, Alexandr V.; Fukin, Georgii K.; Bogomyakov, Artem S.; Cherkasov, Vladimir K.; Abakumov, Gleb A.","The interaction of N,N′-bis(2,6-dimethylphenyl)imidazol-2-ylidene with o-benzosemiquinonato zinc(ii) and indium(iii) complexes","New Journal of Chemistry","2012","36","10","1944","","10.1039/c2nj40490g","","","0.71073","MoKα","","0.0727","0.0633","","","0.1562","0.1621","","","","","","1.034","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052954","12.0425","0.0006","6.0319","0.0003","12.6615","0.0006","90","","106.214","0.005","90","","883.14","0.08","294","2","294","2","","","","","","","","3","P 1 21 1","P 2yb","4","2-(hydroxy(4-methylphenyl)methyl)cyclododecanone","2-[hydroxy(4-methylphenyl)methyl]cyclododecanone","","- C20 H30 O2 -","- C20 H30 O2 -","- C40 H60 O4 -","2","1","","Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer","Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design","New Journal of Chemistry","2012","36","11","2292","","10.1039/c2nj40499k","","","0.71073","MoKα","","0.0706","0.0432","","","0.0846","0.0917","","","","","","0.942","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052955","12.5731","0.0003","5.9925","0.0001","23.9975","0.0005","90","","104.709","0.002","90","","1748.82","0.06","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-((4-chlorophenyl)(hydroxy)methyl)cyclododecanone","2-[(4-chlorophenyl)(hydroxy)methyl]cyclododecanone","","- C19 H27 Cl O2 -","- C19 H27 Cl O2 -","- C76 H108 Cl4 O8 -","4","1","","Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer","Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design","New Journal of Chemistry","2012","36","11","2292","","10.1039/c2nj40499k","","","0.71073","MoKα","","0.072","0.043","","","0.1124","0.1204","","","","","","1.067","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052956","12.5505","0.0008","6.0048","0.0005","24.4004","0.0015","90","","104.889","0.007","90","","1777.2","0.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-((4-bromophenyl)(hydroxy)methyl)cyclododecanone","2-[(4-bromophenyl)(hydroxy)methyl]cyclododecanone","","- C19 H27 Br O2 -","- C19 H27 Br O2 -","- C76 H108 Br4 O8 -","4","1","","Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer","Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design","New Journal of Chemistry","2012","36","11","2292","","10.1039/c2nj40499k","","","0.71073","MoKα","","0.0788","0.032","","","0.0655","0.0703","","","","","","0.85","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052957","12.665","0.014","5.829","0.0018","25.713","0.009","90","","100.94","0.05","90","","1864","2","294","2","294","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2-((4-ethylphenyl)(hydroxy)methyl)cyclododecanone","2-[(4-ethylphenyl)(hydroxy)methyl]cyclododecanone","","- C21 H32 O2 -","- C21 H32 O2 -","- C84 H128 O8 -","4","1","","Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer","Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design","New Journal of Chemistry","2012","36","11","2292","","10.1039/c2nj40499k","","","0.71073","MoKα","","0.1003","0.0676","","","0.1733","0.2113","","","","","","1.039","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052958","8.0433","0.0006","9.0769","0.001","12.4273","0.001","103.78","0.008","92.678","0.006","92.933","0.007","878.4","0.14","294","2","294","2","","","","","","","","4","P -1","-P 1","2","2-(2,4-dichlorobenzylidene)cyclododecanone","2-(2,4-dichlorobenzylidene)cyclododecanone","","- C19 H24 Cl2 O -","- C19 H24 Cl2 O -","- C38 H48 Cl4 O2 -","2","1","","Sathesh, Venkatesan; Umamahesh, Balijapalli; Ramachandran, Gunasekar; Rathore, Ravindranath S.; Sathiyanarayanan, Kulathu Iyer","Direct anti and regio-specific aldol reactions of cyclododecanone catalyzed by alkali metal hydroxides: implications for supramolecular helical design","New Journal of Chemistry","2012","36","11","2292","","10.1039/c2nj40499k","","","0.71073","MoKα","","0.0455","0.0359","","","0.0889","0.0949","","","","","","1.01","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052959","36.9262","0.0005","36.9262","0.0005","14.7933","0.0008","90","","90","","90","","20171.3","1.2","120","2","120","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C220 H238 Fe4 N4 O P8 Zn -","- C220 H238 Fe4 N4 O P8 Zn -","- C880 H952 Fe16 N16 O4 P32 Zn4 -","4","0.25","","Drouet, Samuel; Merhi, Areej; Grelaud, Guillaume; Cifuentes, Marie P.; Humphrey, Mark G.; Matczyszyn, Katarzyna; Samoc, Marek; Toupet, Loïc; Paul-Roth, Christine O.; Paul, Frédéric","Enhanced two-photon absorption cross-sections of zinc(II) tetraphenylporphyrins peripherally substituted with d6-metal alkynyl complexes","New Journal of Chemistry","2012","36","11","2192","","10.1039/c2nj40589j","","","0.71073","MoKα","","0.1684","0.1141","","","0.2885","0.3241","","","","","","1.133","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052960","29.7377","0.0012","9.6031","0.0006","22.5784","0.0009","90","","104.967","0.004","90","","6229.1","0.5","140","1","140","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Y0907","","","- C69 H81 N9 O9 -","- C69 H81 N9 O9 -","- C276 H324 N36 O36 -","4","1","","Jin, Cheng-Cheng; Kinoshita, Takashi; Cong, Hang; Ni, Xin-Long; Zeng, Xi; Hughes, David L.; Redshaw, Carl; Yamato, Takehiko","Synthesis and inclusion properties of C3-symmetric triazole derivatives based on hexahomotrioxacalix[3]arene","New Journal of Chemistry","2012","36","12","2580","","10.1039/c2nj40599g","","","0.71073","Mo-Kα","","0.1263","0.0762","","","0.1252","0.1439","","","","","","1.175","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052961","11.8572","0.0002","11.8572","0.0002","12.3816","0.0003","90","","90","","90","","1740.77","0.06","150","2","150","2","","","","","","","","5","P 41","P 4w","76","","","","- C20 H20 N P S -","- C20 H20 N P S -","- C80 H80 N4 P4 S4 -","4","1","","Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K.","N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere","New Journal of Chemistry","2012","36","11","2280","","10.1039/c2nj40646b","","","1.54184","CuKα","","0.0336","0.0321","","","0.0811","0.0827","","","","","","1.07","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052962","9.068","0.005","19.055","0.005","20.228","0.005","90","0.005","90","0.005","90","0.005","3495","2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 N O P -","- C20 H20 N O P -","- C160 H160 N8 O8 P8 -","8","2","","Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K.","N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere","New Journal of Chemistry","2012","36","11","2280","","10.1039/c2nj40646b","","","0.71069","MoKα","","0.0402","0.0385","","","0.1023","0.1043","","","","","","1.036","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052963","14.2392","0.0012","14.631","0.0018","18.0321","0.0017","90","","90","","90","","3756.7","0.7","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C176 H180 Cl4 N4 P4 Zr4 -","- C176 H180 Cl4 N4 P4 Zr4 -","- C176 H180 Cl4 N4 P4 Zr4 -","1","0.125","","Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K.","N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere","New Journal of Chemistry","2012","36","11","2280","","10.1039/c2nj40646b","","","1.54184","CuKα","","0.0674","0.0509","","","0.1186","0.1304","","","","","","1.047","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052964","11.8869","0.0002","11.8869","0.0002","12.6006","0.0003","90","","90","","90","","1780.44","0.06","150","2","150","2","","","","","","","","5","P 43","P 4cw","78","","","","- C20 H20 N P Se -","- C20 H20 N P Se -","- C80 H80 N4 P4 Se4 -","4","1","","Naktode, Kishor; Kottalanka, Ravi K.; Panda, Tarun K.","N-(2,6-Dimethylphenyl)diphenylphosphinamine chalcogenides (S, Se) and a zirconium complex possessing phosphanylamide in the coordination sphere","New Journal of Chemistry","2012","36","11","2280","","10.1039/c2nj40646b","","","1.54184","CuKα","","0.0296","0.0292","","","0.0783","0.0786","","","","","","1.059","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052965","13.9583","0.0013","25.467","0.002","15.4276","0.0015","90","","103.572","0.006","90","","5331","0.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C40 H44 Cl2 Cu4 N14 O18 S4 -","- C40 H44 Cl2 Cu4 N14 O18 S4 -","- C160 H176 Cl8 Cu16 N56 O72 S16 -","4","0.5","","Li, Xin; Li, Xue-Jie; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei","Syntheses and structures of tetracopper(ii) complexes with an N-benzoate-N′-[3-(2-hydroxylethylammino)propyl]oxamide ligand: reactivity towards DNA, cytotoxic and antimicrobial activities","New Journal of Chemistry","2012","36","12","2472","","10.1039/c2nj40682a","","","0.71073","MoKα","","0.0605","0.0398","","","0.1056","0.1163","","","","","","1.022","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052966","11.8016","0.0015","11.884","0.0014","12.652","0.003","103.236","0.003","101.213","0.003","117.145","0.002","1442.6","0.4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H26 Cl Cu2 N5 O10 S2 -","- C22 H26 Cl Cu2 N5 O10 S2 -","- C44 H52 Cl2 Cu4 N10 O20 S4 -","2","1","","Li, Xin; Li, Xue-Jie; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei","Syntheses and structures of tetracopper(ii) complexes with an N-benzoate-N′-[3-(2-hydroxylethylammino)propyl]oxamide ligand: reactivity towards DNA, cytotoxic and antimicrobial activities","New Journal of Chemistry","2012","36","12","2472","","10.1039/c2nj40682a","","","0.71073","MoKα","","0.1297","0.0599","","","0.1233","0.1525","","","","","","0.995","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052967","7.0325","0.0017","9.919","0.0012","12.475","0.0006","90","","90","","90","","870.2","0.2","291","2","291","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C4 H6 N10 -","- C4 H6 N10 -","- C16 H24 N40 -","4","1","","Tang, Yongxing; Yang, Hongwei; Shen, Jianhua; Wu, Bo; Ju, Xuehai; Lu, Chunxu; Cheng, Guangbin","Synthesis and characterization of 1,1′-azobis(5-methyltetrazole)","New Journal of Chemistry","2012","36","12","2447","","10.1039/c2nj40731k","","","0.71073","MoKα","","0.032","0.031","","","0.0745","0.0751","","","","","","1.049","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052968","11.336","0.003","10.813","0.003","16.926","0.005","90","","129.643","0.006","90","","1597.6","0.8","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 N2 O5 -","- C16 H24 N2 O5 -","- C64 H96 N8 O20 -","4","1","","Sleem, Hisham Fathy; Dawe, Louise Nicole; Georghiou, Paris Elias","A tetraamido isophthaloyl-based macrocyclic calcium chloride and strontium chloride tritopic receptor","New Journal of Chemistry","2012","36","12","2451","","10.1039/c2nj40751e","","","0.71075","MoKα","","0.0393","0.0389","","","0.0988","0.0992","","","","","","1.064","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052969","5.0083","0.0018","9.048","0.003","17.725","0.006","85.179","0.008","82.023","0.009","75.645","0.009","769.6","0.5","163","2","163","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H44 N4 O8 -","- C32 H44 N4 O8 -","- C32 H44 N4 O8 -","1","0.5","","Sleem, Hisham Fathy; Dawe, Louise Nicole; Georghiou, Paris Elias","A tetraamido isophthaloyl-based macrocyclic calcium chloride and strontium chloride tritopic receptor","New Journal of Chemistry","2012","36","12","2451","","10.1039/c2nj40751e","","","0.71075","MoKα","","0.2347","0.1365","","","0.2533","0.3084","","","","","","1.107","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052970","4.8685","0.0003","17.2207","0.0012","17.2062","0.0015","90","","91.668","0.007","90","","1441.94","0.18","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H20 N2 O12 -","- C8 H16 N2 O12 -","- C32 H64 N8 O48 -","4","1","","Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia","From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid","New Journal of Chemistry","2013","37","1","97","","10.1039/c2nj40379j","","","0.71073","MoKα","","0.1464","0.1065","","","0.2271","0.2465","","","","","","1.255","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052971","14.3723","0.0008","6.2614","0.0004","9.1815","0.0005","90","","92.112","0.004","90","","825.69","0.08","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","from C:/Iacopo_serina_ox/lserox_best1.cif","","","- C5 N O7 -","- C5 H7.5 N O7 -","- C20 H30 N4 O28 -","4","2","","Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia","From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid","New Journal of Chemistry","2013","37","1","97","","10.1039/c2nj40379j","powder diffraction","","1.5406","CuKα","","","","","","","","","","2.85","","","","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052972","4.8832","0.0006","11.9276","0.0014","12.4798","0.0015","90","","92.018","0.01","90","","726.43","0.15","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C8 H20 N2 O12 -","- C8 H16 N2 O12 -","- C16 H32 N4 O24 -","2","1","","Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia","From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid","New Journal of Chemistry","2013","37","1","97","","10.1039/c2nj40379j","","","0.71073","MoKα","","0.1904","0.0963","","","0.136","0.1693","","","","","","1.149","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052973","12.5711","0.0006","11.2144","0.0005","5.2079","0.0002","90","","100.529","0.003","90","","721.83","0.06","293","","293","","","","","","","","","3","P 1 21 1","P 2yb","4","from C:/2_1mono/sol2acqua_best8.cif","","","- C8 N2 O12 -","- C8 H16 N2 O12 -","- C16 H32 N4 O24 -","2","1","","Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia","From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid","New Journal of Chemistry","2013","37","1","97","","10.1039/c2nj40379j","powder diffraction","","1.5406","CuKα","","","","","","","","","","1.78","","","","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052974","11.7238","0.0011","11.7563","0.0011","13.1508","0.0012","109.956","0.001","94.499","0.002","110.922","0.002","1549.4","0.3","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H30 F12 N6 P2 Ru S3 -","- C21 H30 F12 N6 P2 Ru S3 -","- C42 H60 F24 N12 P4 Ru2 S6 -","2","1","","Todd, Adam M.; Swinburne, Adam N.; Goeta, Andrés E.; Steed, Jonathan W.","Anion receptor coordination tripods capped by [9]ane-S3","New Journal of Chemistry","2013","37","1","89","","10.1039/c2nj40401j","","","0.71073","MoKα","","0.0348","0.0296","","","0.0703","0.073","","","","","","1.028","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052975","7.7341","0.0006","8.1924","0.0004","20.4587","0.0014","90","","98.448","0.006","90","","1282.22","0.15","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2,6-bis(3-(trimethoxysilyl)propyl)pyrrolo(3,4-f)isoindole - 1,3,5,7(2H,6H)- tetraone","2,6-bis(3-(trimethoxysilyl)propyl)pyrrolo[3,4-f]isoindole -1,3,5,7(2H,6H)-tetraone","","- C22 H32 N2 O10 Si2 -","- C22 H32 N2 O10 Si2 -","- C44 H64 N4 O20 Si4 -","2","0.5","","Pfeifer, Stefan; Schwarzer, Anke; Schmidt, Dana; Brendler, Erica; Veith, Michael; Kroke, Edwin","Precursors for pyromellit-bridged silica sol‒gel hybrid materials","New Journal of Chemistry","2013","37","1","169","","10.1039/c2nj40538e","","","0.71073","MoKα","","0.0468","0.0403","","","0.1053","0.109","","","","","","1.085","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052976","14.2971","0.0004","7.7793","0.0003","25.6231","0.0007","90","","99.546","0.002","90","","2810.38","0.16","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","2,6-bis((triethoxysilyl)methyl)pyrrolo(3,4-f) isoindole-1,3,5,7(2H,6H)-tetraone","2,6-bis((triethoxysilyl)methyl)pyrrolo[3,4-f] isoindole-1,3,5,7(2H,6H)-tetraone","","- C24 H36 N2 O10 Si2 -","- C24 H36 N2 O10 Si2 -","- C96 H144 N8 O40 Si8 -","4","1","","Pfeifer, Stefan; Schwarzer, Anke; Schmidt, Dana; Brendler, Erica; Veith, Michael; Kroke, Edwin","Precursors for pyromellit-bridged silica sol‒gel hybrid materials","New Journal of Chemistry","2013","37","1","169","","10.1039/c2nj40538e","","","0.71073","MoKα","","0.0634","0.0577","","","0.1557","0.1604","","","","","","1.092","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052977","7.8416","0.0018","10.779","0.002","13.485","0.003","95.885","0.004","98.485","0.005","103.936","0.004","1082.8","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C31 H26 O -","- C31 H26 O -","- C62 H52 O2 -","2","1","","Moorthy, Jarugu Narasimha; Mandal, Susovan; Kumar, Amrit","Photochromism of novel chromenes constrained to be part of [2.2]paracyclophane: remarkable ‘phane’ effects on the colored o-quinonoid intermediates","New Journal of Chemistry","2013","37","1","82","","10.1039/c2nj40575j","","","0.71073","MoKα","","0.0924","0.0764","","","0.2242","0.2441","","","","","","1.099","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052978","18.2537","0.001","18.39","0.001","20.7899","0.0012","74.209","0.001","89.492","0.001","87.577","0.001","6709.5","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C121 H151 La2 N21 O33 -","- C103 H97 La2 N21 O24 -","- C206 H194 La4 N42 O48 -","2","1","","Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J.","1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems","New Journal of Chemistry","2013","37","1","119","","10.1039/c2nj40586e","","","0.71073","MoKα","","0.0441","0.0395","","","0.1082","0.1116","","","","","","1.101","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052979","21.31","0.002","21.575","0.002","25.924","0.002","82.036","0.002","86.57","0.001","84.975","0.001","11744.8","1.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C126 H159 Er N18 O23 -","- C103 H97 Er N18 O15 -","- C412 H388 Er4 N72 O60 -","4","2","","Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J.","1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems","New Journal of Chemistry","2013","37","1","119","","10.1039/c2nj40586e","","","0.71073","MoKα","","0.0739","0.0567","","","0.1521","0.1607","","","","","","1.093","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052980","17.6026","0.0014","17.8227","0.0015","20.5821","0.0017","81.527","0.001","81.654","0.001","88.492","0.001","6318.9","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C120 H145 N21 O32 Yb2 -","- C105 H103 N21 O26 Yb2 -","- C210 H206 N42 O52 Yb4 -","2","1","","Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J.","1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems","New Journal of Chemistry","2013","37","1","119","","10.1039/c2nj40586e","","","0.71073","MoKα","","0.0541","0.047","","","0.1348","0.1408","","","","","","1.092","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052981","23.7722","0.0009","23.7722","0.0009","23.7722","0.0009","90","","90","","90","","13434.1","0.9","100","2","100","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","","","","- C133 H169 N18 O22.5 Yb -","- C112 H112 N18 O15 Yb -","- C448 H448 N72 O60 Yb4 -","4","0.333333","","Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J.","1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems","New Journal of Chemistry","2013","37","1","119","","10.1039/c2nj40586e","","","0.71073","MoKα","","0.0734","0.058","","","0.1645","0.1801","","","","","","1.09","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052982","14.8807","0.0003","20.2373","0.0004","24.8721","0.0006","95.009","0.002","101.027","0.002","107.138","0.001","6942.5","0.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C139 H175 F9 N15 O18 S3 Yb -","- C121 H127 F9 N15 O15 S3 Yb -","- C242 H254 F18 N30 O30 S6 Yb2 -","2","1","","Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J.","1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems","New Journal of Chemistry","2013","37","1","119","","10.1039/c2nj40586e","","","0.71073","MoKα","","0.0662","0.0469","","","0.1025","0.1078","","","","","","0.914","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052983","24.8539","0.0006","13.987","0.0003","28.8206","0.0006","90","","104.791","0.001","90","","9687","0.4","100","2","100","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C95 H105 F9 N15 O13 S3 Yb -","- C90 H93 F9 N15 O12 S3 Yb -","- C360 H372 F36 N60 O48 S12 Yb4 -","4","1","","Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J.","1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems","New Journal of Chemistry","2013","37","1","119","","10.1039/c2nj40586e","","","1.54178","CuKα","","0.0296","0.0284","","","0.0679","0.0685","","","","","","1.055","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052984","13.6476","0.0009","16.3938","0.001","23.0054","0.0014","88.036","0.001","89.204","0.001","82.558","0.001","5100.5","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C111 H83 F9 N21 O13 S3 Yb -","- C111 H81 F9 N21 O12.5 S3 Yb -","- C222 H162 F18 N42 O25 S6 Yb2 -","2","1","","Guillet, Gary L.; Hyatt, I. F. Dempsey; Hillesheim, Patrick C.; Abboud, Khalil A.; Scott, Michael J.","1,2,4-Triazine-picolinamide functionalized, nonadentate chelates for the segregation of lanthanides(iii) and actinides(iii) in biphasic systems","New Journal of Chemistry","2013","37","1","119","","10.1039/c2nj40586e","","","0.71073","MoKα","","0.0407","0.0324","","","0.0833","0.0863","","","","","","1.044","","","","has coordinates,has disorder","180083","2020-10-21","18:00:00",""
"7052985","17.232","0.002","15.471","0.002","9.473","0.0011","90","","114.15","0.002","90","","2304.4","0.5","100","2","100","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C46 H52 Cl4 Co2 N8 O2 -","- C46 H52 Cl4 Co2 N8 O2 -","- C92 H104 Cl8 Co4 N16 O4 -","2","0.25","","Jacobs, Tia; Barbour, Leonard J.","Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion","New Journal of Chemistry","2013","37","1","71","","10.1039/c2nj40612h","","","0.71073","MoKα","","0.1168","0.0826","","","0.166","0.1811","","","","","","1.161","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052986","20.02","0.004","14.595","0.003","17.102","0.003","90","","118.62","0.03","90","","4386.5","1.9","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H44 Cl4 Co2 N8 -","- C44 H44 Cl4 Co2 N8 -","- C176 H176 Cl16 Co8 N32 -","4","0.5","","Jacobs, Tia; Barbour, Leonard J.","Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion","New Journal of Chemistry","2013","37","1","71","","10.1039/c2nj40612h","","","0.71073","MoKα","","0.1992","0.1308","","","0.232","0.2617","","","","","","1.156","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052987","17.36","0.02","15.483","0.02","9.44","0.012","90","","113.97","0.02","90","","2319","5","100","2","100","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C46 H52 Cl4 N8 O2 Zn2 -","- C46 H52 Cl4 N8 O2 Zn2 -","- C92 H104 Cl8 N16 O4 Zn4 -","2","0.25","","Jacobs, Tia; Barbour, Leonard J.","Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion","New Journal of Chemistry","2013","37","1","71","","10.1039/c2nj40612h","","","0.71073","MoKα","","0.1368","0.0859","","","0.1777","0.1991","","","","","","1.04","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052988","20.01","0.005","14.658","0.003","17.146","0.004","90","","118.325","0.003","90","","4426.9","1.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H44 Cl4 N8 Zn2 -","- C44 H44 Cl4 N8 Zn2 -","- C176 H176 Cl16 N32 Zn8 -","4","0.5","","Jacobs, Tia; Barbour, Leonard J.","Single-crystal to single-crystal transformations in discrete solvated metallocycles: the role of the metal ion","New Journal of Chemistry","2013","37","1","71","","10.1039/c2nj40612h","","","0.71073","MoKα","","0.1793","0.0804","","","0.165","0.2088","","","","","","1.019","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052989","20.6275","0.0008","10.5366","0.0004","30.6641","0.0012","90","","99.59","0.001","90","","6571.5","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ceotfb","","","- C68 H116 Ce2 O3 S -","- C68 H116 Ce2 O3 S -","- C272 H464 Ce8 O12 S4 -","4","1","","Werkema, Evan L.; Castro, Ludovic; Maron, Laurent; Eisenstein, Odile; Andersen, Richard A.","Cleaving bonds in CH3OSO2CF3 with [1,2,4-(Me3C)3C5H2]2CeH; an experimental and computational study","New Journal of Chemistry","2013","37","1","132","","10.1039/c2nj40624a","","","0.71073","MoKα","","0.0558","0.0379","","","0.0792","0.088","","","","","","1.053","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052990","10.5673","0.0012","21.532","0.002","16.3041","0.0018","90","","98.267","0.002","90","","3671.2","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","ceotf","","","- C35 H58 Ce F3 O3 S -","- C35 H58 Ce F3 O3 S -","- C140 H232 Ce4 F12 O12 S4 -","4","1","","Werkema, Evan L.; Castro, Ludovic; Maron, Laurent; Eisenstein, Odile; Andersen, Richard A.","Cleaving bonds in CH3OSO2CF3 with [1,2,4-(Me3C)3C5H2]2CeH; an experimental and computational study","New Journal of Chemistry","2013","37","1","132","","10.1039/c2nj40624a","","","0.71073","MoKα","","0.0258","0.0224","","","0.0499","0.0522","","","","","","1.067","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052991","17.083","0.002","11.2862","0.0009","11.2092","0.0015","90","","106.755","0.007","90","","2069.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H18 N8 O7 Zn2 -","- C16 H18 N8 O7 Zn2 -","- C64 H72 N32 O28 Zn8 -","4","0.5","","Lou, Benyong; He, Fengdan","Coordination polymers as potential solid forms of drugs: three zinc(ii) coordination polymers of theophylline with biocompatible organic acids","New Journal of Chemistry","2013","37","2","309","","10.1039/c2nj40625j","","","0.71073","MoKα","","0.052","0.0316","","","0.0763","0.118","","","","","","1.088","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052992","16.023","0.002","13.4229","0.0016","11.4932","0.0019","90","","103.331","0.009","90","","2405.3","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H20 N8 O7 Zn2 -","- C21 H20 N8 O7 Zn2 -","- C84 H80 N32 O28 Zn8 -","4","0.5","","Lou, Benyong; He, Fengdan","Coordination polymers as potential solid forms of drugs: three zinc(ii) coordination polymers of theophylline with biocompatible organic acids","New Journal of Chemistry","2013","37","2","309","","10.1039/c2nj40625j","","","0.71073","MoKα","","0.0481","0.0386","","","0.0754","0.0805","","","","","","1.096","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052993","11.8565","0.0011","11.048","0.0008","20.2252","0.0016","90","","90","","90","","2649.3","0.4","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H11 N5 O4 Zn -","- C13 H11 N5 O4 Zn -","- C104 H88 N40 O32 Zn8 -","8","1","","Lou, Benyong; He, Fengdan","Coordination polymers as potential solid forms of drugs: three zinc(ii) coordination polymers of theophylline with biocompatible organic acids","New Journal of Chemistry","2013","37","2","309","","10.1039/c2nj40625j","","","0.71073","MoKα","","0.0319","0.0283","","","0.0646","0.0666","","","","","","1.109","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7052994","13.5277","0.0004","15.3111","0.0007","17.7296","0.0005","86.083","0.003","67.796","0.002","77.863","0.003","3323.7","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C138.5 H131 Cl N14 O23 Zn2 -","- C138.5 H127 Cl N14 O23 Zn2 -","- C138.5 H127 Cl N14 O23 Zn2 -","1","0.5","","Lang, Thomas; Graf, Ernest; Kyritsakas, Nathalie; Hosseini, Mir Wais","Zinc‒ and palladium‒porphyrin based turnstiles","New Journal of Chemistry","2013","37","1","112","","10.1039/c2nj40657h","","","0.71073","MoKα","","0.0969","0.0782","","","0.2357","0.2528","","","","","","1.063","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7052995","14.8196","0.0012","17.1292","0.0015","17.1532","0.0017","63.953","0.003","84.648","0.003","64.883","0.003","3518.9","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C148 H156 N14 O23 Pd2 -","- C148 H146 N14 O23 Pd2 -","- C148 H146 N14 O23 Pd2 -","1","0.5","","Lang, Thomas; Graf, Ernest; Kyritsakas, Nathalie; Hosseini, Mir Wais","Zinc‒ and palladium‒porphyrin based turnstiles","New Journal of Chemistry","2013","37","1","112","","10.1039/c2nj40657h","","","0.71073","MoKα","","0.151","0.1132","","","0.2997","0.3255","","","","","","1.416","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052996","13.1083","0.0003","9.45522","0.00019","15.1358","0.0004","90","","99.016","0.002","90","","1852.78","0.08","100.15","","100.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Benzene-1,2-diolato)(methanolato)(2-(morpholinomethyl)phenyl)boron methanol solvate","","- C19 H26 B N O5 -","- C19 H26 B N O5 -","- C76 H104 B4 N4 O20 -","4","1","","Adamczyk-Woźniak, Agnieszka; Borys, Krzysztof M.; Madura, Izabela D.; Pawełko, Alicja; Tomecka, Ewelina; Żukowski, Kamil","Lewis acidity and sugar receptor activity of 3-amino-substituted benzoxaboroles and their ortho-aminomethylphenylboronic acid analogues","New Journal of Chemistry","2013","37","1","188","","10.1039/c2nj40687j","","","1.5418","CuKα","","0.0388","0.0335","","","0.0862","0.0894","","","","","","1.049","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052997","35.577","0.005","6.4458","0.0009","12.9791","0.0007","90","","109.18","0.01","90","","2811.2","0.6","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H8 Cl2 F10 N4 S -","- C24 H6 F10 N4 S -","- C96 H24 F40 N16 S4 -","4","0.5","","Moussallem, Chady; Allain, Magali; Gohier, Frédéric; Frère, Pierre","Synthesis, electronic properties and packing modes of conjugated systems based on 2,5-di(cyanovinyl)furan or thiophene and imino-perfluorophenyl moieties","New Journal of Chemistry","2013","37","2","409","","10.1039/c2nj40745k","","x-ray","0.71073","MoKα","","0.0802","0.0531","","","0.1116","0.1218","","","","","","1.061","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052998","36.916","0.009","6.298","0.0007","9.662","0.002","90","","101.03","0.02","90","","2204.9","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H6 F10 N4 O -","- C24 H6 F10 N4 O -","- C96 H24 F40 N16 O4 -","4","0.5","","Moussallem, Chady; Allain, Magali; Gohier, Frédéric; Frère, Pierre","Synthesis, electronic properties and packing modes of conjugated systems based on 2,5-di(cyanovinyl)furan or thiophene and imino-perfluorophenyl moieties","New Journal of Chemistry","2013","37","2","409","","10.1039/c2nj40745k","","x-ray","0.71073","MoKα","","","0.0581","","","","0.1339","","","","","","1.122","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7052999","22.017","0.0017","16.2879","0.0016","13.7909","0.0011","90","","90","","90","","4945.6","0.7","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C18 H22 Mg O13 Zn -","- C18 H16 Mg O10 Zn -","- C144 H128 Mg8 O80 Zn8 -","8","1","","Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi","Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands","New Journal of Chemistry","2013","37","2","380","","10.1039/c2nj40752c","","","0.71073","MoKα","","0.106","0.0668","","","0.1529","0.1735","","","","","","1.043","","","","has coordinates","180083","2020-10-21","18:00:00",""
"7053000","12.0711","0.0004","12.2504","0.0004","13.3746","0.0005","90","","101.194","0.003","90","","1940.15","0.12","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 O9 Zn2 -","- C18 H14 O9 Zn2 -","- C72 H56 O36 Zn8 -","4","1","","Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi","Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands","New Journal of Chemistry","2013","37","2","380","","10.1039/c2nj40752c","","","0.71073","MoKα","","0.0396","0.0301","","","0.071","0.0766","","","","","","1.034","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053001","8.0667","0.0003","12.2547","0.0008","12.591","0.0006","95.846","0.005","93.184","0.004","95.283","0.004","1230.3","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H26 O10 Zn3 -","- C24 H26 O10 Zn3 -","- C48 H52 O20 Zn6 -","2","1","","Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi","Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands","New Journal of Chemistry","2013","37","2","380","","10.1039/c2nj40752c","","","0.71073","MoKα","","0.0492","0.0433","","","0.111","0.1151","","","","","","1.097","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053002","18.14","0.001","31.2496","0.0019","6.8627","0.0004","90","","106.35","0.006","90","","3732.9","0.4","293","2","293","2","","","","","","","","5","C 1 m 1","C -2y","8","","","","- C30 H36 Ba O14 Zn2 -","- C30 H34 Ba O13 Zn2 -","- C120 H136 Ba4 O52 Zn8 -","4","1","","Bo, Qi-Bing; Wang, Hong-Yan; Wang, Da-Qi","Synthesis, characterization and photoluminescent properties of Zn-based mono- and hetero-MOFs containing the R-isophthalate (R = methyl or tert-butyl) ligands","New Journal of Chemistry","2013","37","2","380","","10.1039/c2nj40752c","","","0.71073","MoKα","","0.0377","0.0342","","","0.076","0.0787","","","","","","1.043","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053003","34.465","0.013","34.465","0.013","7.825","0.003","90","","90","","120","","8050","5","296","2","296","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C21 H17 N3 O3 -","- C21 H17 N3 O3 -","- C378 H306 N54 O54 -","18","1","","Xu, Huajie; Liu, Zhaodi; Sheng, Liangquan; Chen, Mingming; Huang, Deqian; Zhang, Hong; Song, Chongfu; Chen, Shuisheng","A novel “turn-on” fluorescent probe for Fe3+ in aqueous media based on CN isomerization","New Journal of Chemistry","2013","37","2","274","","10.1039/c2nj40767a","","","0.71073","MoKα","","0.0571","0.0415","","","0.1007","0.11","","","","","","1.029","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053004","9.1543","0.0003","9.4031","0.0003","20.9383","0.0007","77.882","0.002","79.291","0.002","83.454","0.002","1726.21","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","[(2,2'bipyridine)di(flumequinato-κ^2^O,O)zinc(II)] dihydrate","[(2,2'bipyridine)di(9-fluoro-5-methyl-1-oxo-1,5,6,7-tetrahydropyrido[3,2,1-ij]quinoline-2-carboxylato-κ^2^O,O)zinc(II)] dihydrate","","- C38 H34 F2 N4 O8 Zn -","- C38 H34 F2 N4 O8 Zn -","- C76 H68 F4 N8 O16 Zn2 -","2","1","","Tarushi, Alketa; Kljun, Jakob; Turel, Iztok; Pantazaki, Anastasia A.; Psomas, George; Kessissoglou, Dimitris P.","Zinc(II) complexes with the quinolone antibacterial drug flumequine: structure, DNA- and albumin-binding","New Journal of Chemistry","2013","37","2","342","","10.1039/c2nj40798a","","","0.71073","MoKα","","0.1","0.0526","","","0.091","0.1063","","","","","","1.028","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053005","7.8443","0.0001","9.2261","0.0001","15.1286","0.0002","100.316","0.0008","100.686","0.0008","96.171","0.0008","1047.24","0.02","150","2","150","2","","","","","","","","7","P -1","-P 1","2","[(2,2'-bipyridine)chlorido(flumequinato-κ^2^O,O)zinc(II)]","[(2,2'-bipyridine)chlorido(9-fluoro-5-methyl-1-oxo-1,5,6,7-tetrahydropyr ido[3,2,1-ij]quinoline-2-carboxylato-κ^2^O,O)zinc(II)]","","- C24 H19 Cl F N3 O3 Zn -","- C24 H19 Cl F N3 O3 Zn -","- C48 H38 Cl2 F2 N6 O6 Zn2 -","2","1","","Tarushi, Alketa; Kljun, Jakob; Turel, Iztok; Pantazaki, Anastasia A.; Psomas, George; Kessissoglou, Dimitris P.","Zinc(ii) complexes with the quinolone antibacterial drug flumequine: structure, DNA- and albumin-binding","New Journal of Chemistry","2013","37","2","342","","10.1039/c2nj40798a","","","0.71073","MoKα","","0.0255","0.0244","","","0.0615","0.0621","","","","","","1.068","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053006","12.448","0.001","13.931","0.001","22.376","0.002","86.52","0.01","80.65","0.01","69.71","0.01","3591.1","0.6","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C93.64 H13.16 F54 -","- C93.64 H7 F54 -","- C187.28 H14 F108 -","2","1","","Ignat'eva, D. V.; Goryunkov, A. A.; Tamm, N. B.; Ioffe, I. N.; Sidorov, L. N.; Troyanov, S. I.","Isolation and structural characterization of the most highly trifluoromethylated C70 fullerenes: C70(CF3)18 and C70(CF3)20","New Journal of Chemistry","2013","37","2","299","","10.1039/c2nj40959c","","","0.905","","","0.1027","0.0882","","","0.2186","0.225","","","","","","1.059","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053007","14.524","0.001","21.689","0.001","23.545","0.002","90","","99.168","0.003","90","","7322.2","0.9","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C93 H7 F60 -","- C93 H7 F60 -","- C372 H28 F240 -","4","1","","Ignat'eva, D. V.; Goryunkov, A. A.; Tamm, N. B.; Ioffe, I. N.; Sidorov, L. N.; Troyanov, S. I.","Isolation and structural characterization of the most highly trifluoromethylated C70 fullerenes: C70(CF3)18 and C70(CF3)20","New Journal of Chemistry","2013","37","2","299","","10.1039/c2nj40959c","","","0.905","synchrotron","","0.132","0.0863","","","0.1956","0.213","","","","","","1.16","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053008","14.7468","0.0005","15.55","0.0005","18.135","0.0005","78.495","0.002","82.54","0.002","71.023","0.002","3844.1","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C100.5 H12 F60 -","- C100.5 H8 F60 -","- C201 H16 F120 -","2","1","","Ignat'eva, D. V.; Goryunkov, A. A.; Tamm, N. B.; Ioffe, I. N.; Sidorov, L. N.; Troyanov, S. I.","Isolation and structural characterization of the most highly trifluoromethylated C70 fullerenes: C70(CF3)18 and C70(CF3)20","New Journal of Chemistry","2013","37","2","299","","10.1039/c2nj40959c","","","0.905","synchrotron","","0.0978","0.0869","","","0.2031","0.2132","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053009","11.7261","0.0007","6.3804","0.0004","19.3742","0.0012","90","","90.906","0.002","90","","1449.34","0.15","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 O2 S -","- C20 H10 O2 S -","- C80 H40 O8 S4 -","4","1","","Seidel, Nadine; Hahn, Torsten; Liebing, Simon; Seichter, Wilhelm; Kortus, Jens; Weber, Edwin","Synthesis and properties of new 9,10-anthraquinone derived compounds for molecular electronics","New Journal of Chemistry","2013","37","3","601","","10.1039/c2nj40772h","","","0.71073","MoKα","","0.0621","0.0433","","","0.1171","0.1398","","","","","","1.064","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053010","18.3586","0.0005","8.6988","0.0002","8.3214","0.0002","90","","98.203","0.002","90","","1315.31","0.06","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C16 H13 Br O2 -","- C16 H13 Br O2 -","- C64 H52 Br4 O8 -","4","1","","Seidel, Nadine; Hahn, Torsten; Liebing, Simon; Seichter, Wilhelm; Kortus, Jens; Weber, Edwin","Synthesis and properties of new 9,10-anthraquinone derived compounds for molecular electronics","New Journal of Chemistry","2013","37","3","601","","10.1039/c2nj40772h","","","0.71073","MoKα","","0.0459","0.0324","","","0.0815","0.0902","","","","","","1.026","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053011","10.8327","0.0011","20.919","0.003","13.3107","0.0014","90","","104.117","0.009","90","","2925.2","0.6","100","2","100","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","bis(1,3-diphenylpropane-1,3-dionato)(3- methylpyridine)oxovanadium(IV)","bis(1,3-diphenylpropane-1,3-dionato)(3-methylpyridine)oxovanadium(IV)","","- C36 H29 N O5 V -","- C36 H29 N O5 V -","- C144 H116 N4 O20 V4 -","4","1","","Stilinović, Vladimir; Bučar, Dejan-Krešimir; Halasz, Ivan; Meštrović, Ernest","VO⋯C interactions in crystal structures of oxovanadium-coordination compounds","New Journal of Chemistry","2013","37","3","619","","10.1039/c2nj40780a","","","0.71073","MoKα","","0.0743","0.0567","","","0.0942","0.1013","","","","","","1.12","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053012","10.333","0.002","14.007","0.002","14.251","0.003","77.356","0.015","70.407","0.018","77.535","0.016","1873.2","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","bis(1,3-diphenylpropane-1,3-dionato)(4,4'- bipyridine)oxovanadium(IV) dimethylsulphoxyde solvate","bis(1,3-diphenylpropane-1,3-dionato)(4,4'-bipyridine)oxovanadium(IV) dimethylsulphoxyde solvate","","- C42 H36 N2 O6 S V -","- C42 H36 N2 O6 S V -","- C84 H72 N4 O12 S2 V2 -","2","1","","Stilinović, Vladimir; Bučar, Dejan-Krešimir; Halasz, Ivan; Meštrović, Ernest","VO⋯C interactions in crystal structures of oxovanadium-coordination compounds","New Journal of Chemistry","2013","37","3","619","","10.1039/c2nj40780a","","","0.71073","MoKα","","0.1268","0.0973","","","0.2747","0.3113","","","","","","1.122","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053013","11.7951","0.0006","9.4577","0.0005","12.8525","0.0007","90","","91.093","0.005","90","","1433.49","0.13","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(4-(Diethylamino)phenyl)(pyridine-2-yl)methanol","(4-(Diethylamino)phenyl)(pyridine-2-yl)methanol","","- C16 H20 N2 O -","- C16 H20 N2 O -","- C64 H80 N8 O4 -","4","1","","Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj","Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols","New Journal of Chemistry","2013","37","3","563","","10.1039/c2nj40871f","","","0.7107","MoKα","","0.0774","0.0584","","","0.1545","0.1701","","","","","","1.044","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053014","8.489","0.0003","17.2434","0.0006","8.1339","0.0003","90","","110.61","0.004","90","","1114.43","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(4-Methoxyphenyl)(pyridine-2-yl)methanol","(4-Methoxyphenyl)(pyridine-2-yl)methanol","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","","Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj","Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols","New Journal of Chemistry","2013","37","3","563","","10.1039/c2nj40871f","","","0.7107","MoKα","","0.043","0.0353","","","0.0793","0.0838","","","","","","1.042","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053015","10.6147","0.0005","11.5927","0.0005","9.2553","0.0004","90","","90","","90","","1138.89","0.09","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","(1H-indol-3-yl)(pyridin-2-yl)methanol","(1H-indol-3-yl)(pyridin-2-yl)methanol","","- C14 H12 N2 O -","- C14 H12 N2 O -","- C56 H48 N8 O4 -","4","1","","Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj","Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols","New Journal of Chemistry","2013","37","3","563","","10.1039/c2nj40871f","","","0.7107","MoKα","","0.0455","0.0388","","","0.0944","0.1022","","","","","","1.06","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053016","5.9087","0.0002","12.77","0.0005","21.8373","0.0007","90","","90","","90","","1647.71","0.1","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","4,4'-(phenylmethylene)bis(methoxybenzene)","4,4'-(phenylmethylene)bis(methoxybenzene)","","- C21 H20 O2 -","- C21 H20 O2 -","- C84 H80 O8 -","4","1","","Harikrishnan, Adhikesavan; Selvakumar, Jayaraman; Gnanamani, Elumalai; Bhattacharya, Suman; Ramanathan, Chinnasamy Ramaraj","Friedel‒Crafts hydroxyalkylation through activation of a carbonyl group using AlBr3: an easy access to pyridyl aryl/heteroaryl carbinols","New Journal of Chemistry","2013","37","3","563","","10.1039/c2nj40871f","","","0.7107","MoKα","","0.0407","0.0341","","","0.0757","0.0807","","","","","","1.066","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053017","32.989","0.007","32.989","0.007","7.098","0.002","90","","90","","120","","6690","3","100","2","100","2","","","","","","","Claudia Caltagirone","4","R -3 :H","-R 3","148","","","","- C21 H26 N4 O4 -","- C18 H14 N4 O -","- C324 H252 N72 O18 -","18","1","","Olivari, Martina; Caltagirone, Claudia; Garau, Alessandra; Isaia, Francesco; Light, Mark E.; Lippolis, Vito; Montis, Riccardo; Scorciapino, Mariano Andrea","Non-symmetric substituted ureas locked in an (E,Z) conformation: an unusual anion binding via supramolecular assembly","New Journal of Chemistry","2013","37","3","663","","10.1039/c2nj40877e","","","0.71075","MoKα","","0.099","0.0712","","","0.1314","0.1421","","","","","","1.164","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053018","22.003","0.004","7.1308","0.0014","18.677","0.004","90","","90","","90","","2930.4","1","100","2","100","2","","","","","","","Claudia Caltagirone","4","P n a 21","P 2c -2n","33","","","","- C18 H14 N4 O -","- C18 H14 N4 O -","- C144 H112 N32 O8 -","8","2","","Olivari, Martina; Caltagirone, Claudia; Garau, Alessandra; Isaia, Francesco; Light, Mark E.; Lippolis, Vito; Montis, Riccardo; Scorciapino, Mariano Andrea","Non-symmetric substituted ureas locked in an (E,Z) conformation: an unusual anion binding via supramolecular assembly","New Journal of Chemistry","2013","37","3","663","","10.1039/c2nj40877e","","","0.71075","MoKα","","0.0859","0.0624","","","0.1016","0.1085","","","","","","1.044","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053019","8.041","0.0017","19.459","0.004","18.998","0.004","90","","94.696","0.003","90","","2962.6","1.1","100","2","100","2","","","","","","","Claudia Caltagirone","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H14 N4 O -","- C19 H14 N4 O -","- C152 H112 N32 O8 -","8","2","","Olivari, Martina; Caltagirone, Claudia; Garau, Alessandra; Isaia, Francesco; Light, Mark E.; Lippolis, Vito; Montis, Riccardo; Scorciapino, Mariano Andrea","Non-symmetric substituted ureas locked in an (E,Z) conformation: an unusual anion binding via supramolecular assembly","New Journal of Chemistry","2013","37","3","663","","10.1039/c2nj40877e","","","0.71075","MoKα","","0.1121","0.0793","","","0.1604","0.1788","","","","","","1.119","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053020","17.665","0.004","6.3279","0.0014","26.063","0.006","90","","100.725","0.003","90","","2862.5","1.1","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C2 H8 Cu N8 -","- C2 H8 Cu N8 -","- C32 H128 Cu16 N128 -","16","2","","Wu, Bi-Dong; Zhou, Zun-Ning; Li, Fu-Gang; Yang, Li; Zhang, Tong-Lai; Zhang, Jian-Guo","Preparation, crystal structures, thermal decompositions and explosive properties of two new high-nitrogen azide ethylenediamine energetic compounds","New Journal of Chemistry","2013","37","3","646","","10.1039/c2nj40887b","","","0.71073","MoKα","","0.0448","0.0326","","","0.08","0.0872","","","","","","0.998","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7053021","13.671","0.004","9.447","0.002","9.343","0.003","90","","100.349","0.003","90","","1187","0.6","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H16 Co N11 O3 -","- C4 H16 Co N11 O3 -","- C16 H64 Co4 N44 O12 -","4","0.5","","Wu, Bi-Dong; Zhou, Zun-Ning; Li, Fu-Gang; Yang, Li; Zhang, Tong-Lai; Zhang, Jian-Guo","Preparation, crystal structures, thermal decompositions and explosive properties of two new high-nitrogen azide ethylenediamine energetic compounds","New Journal of Chemistry","2013","37","3","646","","10.1039/c2nj40887b","","","0.71073","MoKα","","0.0325","0.0281","","","0.0748","0.0778","","","","","","1.001","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7053022","15.9841","0.0003","20.584","0.0005","24.9501","0.0005","111.656","0.002","106.005","0.0016","94.5871","0.0016","7180.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C82 H104 N4 O8 Zn -","- C82 H104 N4 O8 Zn -","- C328 H416 N16 O32 Zn4 -","4","2","","Raymont, Victoria; Wilson, Hannah; Pfrunder, Michael; McMurtrie, John C.; Mullen, Kathleen M.","New approaches to the synthesis of strapped porphyrin containing bipyridinium [2]rotaxanes","New Journal of Chemistry","2013","37","4","893","","10.1039/c2nj40762k","","","0.71073","MoKα","","0.1189","0.0657","","","0.1715","0.1917","","","","","","1.002","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053023","16.039","0.005","20.336","0.006","16.729","0.005","90","","91.988","0.005","90","","5453","3","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C102 H92 Cr3 Mn3 N18 O16 -","- C102 H92 Cr3 Mn3 N18 O16 -","- C204 H184 Cr6 Mn6 N36 O32 -","2","0.5","","Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi","Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks","New Journal of Chemistry","2013","37","4","941","","10.1039/c2nj41059a","","","0.71073","MoKα","","0.0827","0.0542","","","0.0995","0.1046","","","","","","1.092","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053024","15.946","0.003","20.452","0.002","16.9","0.003","90","","92.377","0.003","90","","5506.8","1.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C105 H98 Cr3 Mn3 N18 O16 -","- C105 H98 Cr3 Mn3 N18 O16 -","- C210 H196 Cr6 Mn6 N36 O32 -","2","0.5","","Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi","Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks","New Journal of Chemistry","2013","37","4","941","","10.1039/c2nj41059a","","","0.71073","MoKα","","0.0813","0.0604","","","0.1331","0.1399","","","","","","1.055","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053025","9.5129","0.0019","21.587","0.004","13.479","0.003","90","","91.71","0.03","90","","2766.7","1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H22 Cr Mn N8 O2 -","- C30 H22 Cr Mn N8 O2 -","- C120 H88 Cr4 Mn4 N32 O8 -","4","1","","Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi","Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks","New Journal of Chemistry","2013","37","4","941","","10.1039/c2nj41059a","","","0.71073","MoKα","","0.0294","0.0267","","","0.0823","0.0839","","","","","","1.092","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053026","9.2635","0.0019","21.4","0.004","14.823","0.003","90","","97.68","0.03","90","","2912.1","1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H24 Cr Mn N8 O2 -","- C31 H24 Cr Mn N8 O2 -","- C124 H96 Cr4 Mn4 N32 O8 -","4","1","","Zhang, Qian; Zhou, Hongbo; Shen, Xiaoping; Zhou, Hu; Yang, Yuqi","Syntheses, crystal structures and magnetic properties of four cyano-bridged bimetallic alternating chain complexes based on [CrIII(salen)(CN)2]− and [CrIII(bipy)(CN)4]− building blocks","New Journal of Chemistry","2013","37","4","941","","10.1039/c2nj41059a","","","0.71073","MoKα","","0.0701","0.055","","","0.1358","0.1464","","","","","","1.014","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053027","17.912","0.004","7.1061","0.0015","20.966","0.004","90","","107.44","0.002","90","","2546","0.9","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 N2 O10 Zn -","- C28 H22 N2 O10 Zn -","- C112 H88 N8 O40 Zn4 -","4","0.5","","Hong, Xu-Jia; Wang, Ming-Fang; Jia, Hong-Yang; Li, Wei-Xing; Li, Jing; Liu, Yi-Ting; Jin, Hong-Guang; Cai, Yue-Peng","Assemblies of several supramolecular networks containing quinoline-2,3-dicarboxylic acid","New Journal of Chemistry","2013","37","4","933","","10.1039/c3nj40783g","","","0.71073","MoKα","","0.0831","0.0621","","","0.1918","0.2094","","","","","","1.127","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053028","7.4062","0.0017","9.136","0.002","9.415","0.003","110.466","0.004","98.32","0.004","111.664","0.003","526.5","0.2","298","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H16 N2 O10 Zn -","- C22 H16 N2 O10 Zn -","- C22 H16 N2 O10 Zn -","1","0.5","","Hong, Xu-Jia; Wang, Ming-Fang; Jia, Hong-Yang; Li, Wei-Xing; Li, Jing; Liu, Yi-Ting; Jin, Hong-Guang; Cai, Yue-Peng","Assemblies of several supramolecular networks containing quinoline-2,3-dicarboxylic acid","New Journal of Chemistry","2013","37","4","933","","10.1039/c3nj40783g","","","0.71073","MoKα","","0.065","0.0544","","","0.1362","0.1442","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053029","12.693","0.004","5.7903","0.0019","13.581","0.005","90","","115.966","0.004","90","","897.4","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H12 N2 O8 Zn -","- C22 H12 N2 O8 Zn -","- C44 H24 N4 O16 Zn2 -","2","0.5","","Hong, Xu-Jia; Wang, Ming-Fang; Jia, Hong-Yang; Li, Wei-Xing; Li, Jing; Liu, Yi-Ting; Jin, Hong-Guang; Cai, Yue-Peng","Assemblies of several supramolecular networks containing quinoline-2,3-dicarboxylic acid","New Journal of Chemistry","2013","37","4","933","","10.1039/c3nj40783g","","","0.71073","MoKα","","0.0892","0.0512","","","0.1146","0.1322","","","","","","1.09","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053030","8.4656","0.0016","8.9809","0.0018","9.2251","0.0018","76.535","0.002","85.007","0.002","74.037","0.002","655.6","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H24 N2 O10 S2 Zn -","- C26 H24 N2 O10 S2 Zn -","- C26 H24 N2 O10 S2 Zn -","1","0.5","","Hong, Xu-Jia; Wang, Ming-Fang; Jia, Hong-Yang; Li, Wei-Xing; Li, Jing; Liu, Yi-Ting; Jin, Hong-Guang; Cai, Yue-Peng","Assemblies of several supramolecular networks containing quinoline-2,3-dicarboxylic acid","New Journal of Chemistry","2013","37","4","933","","10.1039/c3nj40783g","","","0.71073","MoKα","","0.0684","0.0557","","","0.1385","0.1481","","","","","","1.015","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053031","7.2673","0.0008","33.408","0.003","7.3747","0.0008","90","","98.931","0.005","90","","1768.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H13 F N4 O3 -","- C21 H13 F N4 O3 -","- C84 H52 F4 N16 O12 -","4","1","","Liu, Xiang; Li, Jihui; Chen, Baohua","One-pot synthesis of 2,4,5-trisubstituted 1,2,3-triazoles through the cascade reactions of acid chlorides, terminal acetylenes, sodium azide and aryl halides","New Journal of Chemistry","2013","37","4","965","","10.1039/c3nj40912k","","","0.71073","MoKα","","0.068","0.0591","","","0.175","0.1818","","","","","","1.403","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053032","21.9206","0.0011","10.1128","0.0005","23.1925","0.0012","90","","96.119","0.002","90","","5112","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C51 H62 Br4 N2 O4 Zr -","- C51 H62 Br4 N2 O4 Zr -","- C204 H248 Br16 N8 O16 Zr4 -","4","1","","Saha, Tanmoy Kumar; Mandal, Mrinmay; Chakraborty, Debashis; Ramkumar, Venkatachalam","Imino phenoxide complexes of group 4 metals: synthesis, structural characterization and polymerization studies","New Journal of Chemistry","2013","37","4","949","","10.1039/c3nj40916c","","","0.71073","MoKα","","0.0864","0.0453","","","0.1042","0.1211","","","","","","1.007","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053033","24.4152","0.0013","13.135","0.0006","18.3821","0.001","90","","116.306","0.003","90","","5284.5","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H60 Br4 N4 O4 Ti -","- C48 H60 Br4 N4 O4 Ti -","- C192 H240 Br16 N16 O16 Ti4 -","4","0.5","","Saha, Tanmoy Kumar; Mandal, Mrinmay; Chakraborty, Debashis; Ramkumar, Venkatachalam","Imino phenoxide complexes of group 4 metals: synthesis, structural characterization and polymerization studies","New Journal of Chemistry","2013","37","4","949","","10.1039/c3nj40916c","","","0.71073","MoKα","","0.0804","0.0458","","","0.1233","0.1408","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053034","16.4326","0.0009","21.783","0.0011","25.0841","0.0013","88.239","0.002","85.703","0.002","79.019","0.002","8788.5","0.8","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H68 Hf N2 O4 -","- C41 H68 Hf N2 O4 -","- C328 H544 Hf8 N16 O32 -","8","4","","Saha, Tanmoy Kumar; Mandal, Mrinmay; Chakraborty, Debashis; Ramkumar, Venkatachalam","Imino phenoxide complexes of group 4 metals: synthesis, structural characterization and polymerization studies","New Journal of Chemistry","2013","37","4","949","","10.1039/c3nj40916c","","","0.71073","MoKα","","0.0818","0.0556","","","0.1507","0.1779","","","","","","1.219","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053035","10.1011","0.0017","11.4452","0.0018","15.124","0.002","69.997","0.007","81.79","0.007","73.284","0.007","1571.6","0.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H8 O S8 -","- C11 H8 O S8 -","- C44 H32 O4 S32 -","4","2","","Camerel, Franck; Jeannin, Olivier; Yzambart, Gilles; Fabre, Bruno; Lorcy, Dominique; Fourmigué, Marc","Redox-active proligands from the direct connection of 1,3-dithiol-2-one to tetrathiafulvalene (TTF): syntheses, characterizations and metal complexation","New Journal of Chemistry","2013","37","4","992","","10.1039/c3nj41097h","","","0.71073","MoKα","","0.0457","0.0336","","","0.0875","0.1052","","","","","","1.089","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053036","15.341","0.003","29.058","0.006","5.1928","0.001","90","","90","","90","","2314.8","0.8","150","2","150","2","","","","","","","","3","P n 21 a","P -2ac -2n","33","","","","- C16 H14 S12 -","- C16 H14 S12 -","- C64 H56 S48 -","4","1","","Camerel, Franck; Jeannin, Olivier; Yzambart, Gilles; Fabre, Bruno; Lorcy, Dominique; Fourmigué, Marc","Redox-active proligands from the direct connection of 1,3-dithiol-2-one to tetrathiafulvalene (TTF): syntheses, characterizations and metal complexation","New Journal of Chemistry","2013","37","4","992","","10.1039/c3nj41097h","","","0.71073","MoKα","","0.0891","0.0646","","","0.1468","0.1655","","","","","","1.058","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053037","14.1392","0.0002","6.9205","0.0001","30.6289","0.0005","90","","94.125","0.001","90","","2989.28","0.08","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 O S6 -","- C12 H10 O S6 -","- C96 H80 O8 S48 -","8","1","","Camerel, Franck; Jeannin, Olivier; Yzambart, Gilles; Fabre, Bruno; Lorcy, Dominique; Fourmigué, Marc","Redox-active proligands from the direct connection of 1,3-dithiol-2-one to tetrathiafulvalene (TTF): syntheses, characterizations and metal complexation","New Journal of Chemistry","2013","37","4","992","","10.1039/c3nj41097h","","","0.71073","MoKα","","0.0483","0.0369","","","0.0843","0.0893","","","","","","1.156","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053038","7.569","0.005","14.725","0.005","18.158","0.005","95.476","0.005","90.546","0.005","91.274","0.005","2013.9","1.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H34 O2 S13 -","- C30 H34 O2 S13 -","- C60 H68 O4 S26 -","2","1","","Camerel, Franck; Jeannin, Olivier; Yzambart, Gilles; Fabre, Bruno; Lorcy, Dominique; Fourmigué, Marc","Redox-active proligands from the direct connection of 1,3-dithiol-2-one to tetrathiafulvalene (TTF): syntheses, characterizations and metal complexation","New Journal of Chemistry","2013","37","4","992","","10.1039/c3nj41097h","","","0.71073","MoKα","","0.1813","0.0668","","","0.1683","0.2442","","","","","","0.966","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053039","49.363","0.0007","16.337","0.0003","22.309","0.0004","90","","115.934","0.001","90","","16179.2","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H46 Co2 F24 I2 N8 O14.5 -","- C62 H46 Co2 F24 I2 N8 O14.5 -","- C496 H368 Co16 F192 I16 N64 O116 -","8","1","","Vaz, Maria G. F.; Akpinar, Handan; Guedes, Guilherme P.; Santos, Sauli; Novak, Miguel A.; Lahti, Paul M.","Two co-crystalline M(hfac)2(IPhIN)2·M(hfac)2 (M = Mn, Co) compounds with a bis(iminoylnitroxide) biradical: structure and magnetism","New Journal of Chemistry","2013","37","7","1927","","10.1039/c3nj00047h","","x-ray","0.71073","MoKα","","0.0842","0.0575","","","0.1514","0.1688","","","","","","1.052","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053040","49.475","0.0008","16.483","0.0003","22.224","0.0004","90","0.001","115.247","0.001","90","0.001","16392.4","0.5","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C124 H114 F48 I4 Mn4 N16 O29 -","- C124 H114 F48 I4 Mn4 N16 O29 -","- C496 H456 F192 I16 Mn16 N64 O116 -","4","0.5","","Vaz, Maria G. F.; Akpinar, Handan; Guedes, Guilherme P.; Santos, Sauli; Novak, Miguel A.; Lahti, Paul M.","Two co-crystalline M(hfac)2(IPhIN)2·M(hfac)2 (M = Mn, Co) compounds with a bis(iminoylnitroxide) biradical: structure and magnetism","New Journal of Chemistry","2013","37","7","1927","","10.1039/c3nj00047h","","x-ray","0.71073","MoKα","","0.0878","0.0564","","","0.1382","0.1545","","","","","","1.026","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053041","12.9597","0.0011","9.6741","0.0008","13.3527","0.0011","90","","100.796","0.002","90","","1644.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H14 Cl N O3 -","- C19 H14 Cl N O3 -","- C76 H56 Cl4 N4 O12 -","4","1","","Wang, Zheng; Shi, Ying; Luo, Xiaoyan; Han, De-Man; Deng, Wei-Ping","Direct synthesis of pyrroles via 1,3-dipolar cycloaddition of azomethine ylides with ynones","New Journal of Chemistry","2013","37","6","1742","","10.1039/c3nj00067b","","","0.71073","MoKα","","0.0495","0.0401","","","0.1026","0.1103","","","","","","1.027","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053042","5.565","0.0005","13.292","0.0016","10.0843","0.0012","90","","96.248","0.009","90","","741.5","0.14","","","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Thiophen-2-yl-1,2,4-triazine","","- C7 H5 N3 S -","- C7 H5 N3 S -","- C28 H20 N12 S4 -","4","1","","Branowska, Danuta; Chaciak, Bartosz; Siuchta, Olga; Olender, Ewa; Ledwon, Przemyslaw; Lapkowski, Mieczyslaw; Poronik, Eugenij; Wysocki, Waldemar; Karczmarzyk, Zbigniew; Skora, Lukasz; Filapek, Michał; Krompiec, Stanislaw; Urbanczyk-Lipkowska, Zofia; Kalicki, Przemyslaw","Synthesis, photophysics and electrochemistry of novel, nitrogen-containing heterocyclic derivatives","New Journal of Chemistry","2013","37","7","1982","","10.1039/c3nj00078h","","","","","","0.115","0.0921","","","0.2418","0.2595","","","","","","","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053043","13.4965","0.0005","6.1169","0.0003","13.1345","0.0005","90","","95.157","0.002","90","","1079.95","0.08","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2,2'-Bithiophen-5-yl)-1,2,4-triazine","","- C11 H7 N3 S2 -","- C11 H7 N3 S2 -","- C44 H28 N12 S8 -","4","1","","Branowska, Danuta; Chaciak, Bartosz; Siuchta, Olga; Olender, Ewa; Ledwon, Przemyslaw; Lapkowski, Mieczyslaw; Poronik, Eugenij; Wysocki, Waldemar; Karczmarzyk, Zbigniew; Skora, Lukasz; Filapek, Michał; Krompiec, Stanislaw; Urbanczyk-Lipkowska, Zofia; Kalicki, Przemyslaw","Synthesis, photophysics and electrochemistry of novel, nitrogen-containing heterocyclic derivatives","New Journal of Chemistry","2013","37","7","1982","","10.1039/c3nj00078h","","","","","","0.0458","0.044","","","0.1195","0.1238","","","","","","","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053044","17.137","0.0012","11.457","0.0016","17.233","0.0015","90","","95.355","0.005","90","","3368.7","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H108 N2 O8 Ti2 -","- C60 H108 N2 O8 Ti2 -","- C120 H216 N4 O16 Ti4 -","2","0.5","","Hancock, Stuart L.; Mahon, Mary F.; Jones, Matthew D.","Salen complexes based on 1,4-diaminocyclohexane and their exploitation for the polymerisation of rac-lactide","New Journal of Chemistry","2013","37","7","1996","","10.1039/c3nj00111c","","","0.71073","MoKα","","0.1157","0.0576","","","0.1211","0.1481","","","","","","1.022","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053045","9.569","0.001","11.6","0.0007","11.819","0.0013","109.497","0.005","96.776","0.004","93.635","0.005","1220.6","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H80 Al2 N2 O4 -","- C48 H80 Al2 N2 O4 -","- C48 H80 Al2 N2 O4 -","1","0.5","","Hancock, Stuart L.; Mahon, Mary F.; Jones, Matthew D.","Salen complexes based on 1,4-diaminocyclohexane and their exploitation for the polymerisation of rac-lactide","New Journal of Chemistry","2013","37","7","1996","","10.1039/c3nj00111c","","","0.71073","MoKα","","0.1313","0.0782","","","0.1813","0.2188","","","","","","1.013","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053046","6.487","0.0006","7.668","0.0007","17.385","0.0014","98.515","0.005","90.729","0.005","94.709","0.005","852.08","0.13","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H52 Al2 N2 O2 -","- C34 H52 Al2 N2 O2 -","- C34 H52 Al2 N2 O2 -","1","0.5","","Hancock, Stuart L.; Mahon, Mary F.; Jones, Matthew D.","Salen complexes based on 1,4-diaminocyclohexane and their exploitation for the polymerisation of rac-lactide","New Journal of Chemistry","2013","37","7","1996","","10.1039/c3nj00111c","","","0.71073","MoKα","","0.057","0.0428","","","0.1069","0.118","","","","","","1.04","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053047","10.423","0.0002","22.81","0.0005","12.501","0.0002","90","","114.617","0.001","90","","2701.97","0.09","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H41 N O4 Ti -","- C24 H41 N O4 Ti -","- C96 H164 N4 O16 Ti4 -","4","1","","Hancock, Stuart L.; Mahon, Mary F.; Jones, Matthew D.","Salen complexes based on 1,4-diaminocyclohexane and their exploitation for the polymerisation of rac-lactide","New Journal of Chemistry","2013","37","7","1996","","10.1039/c3nj00111c","","","0.71073","MoKα","","0.0892","0.0691","","","0.1764","0.1912","","","","","","1.11","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053048","8.835","0.0002","10.756","0.0003","20.488","0.0007","95.503","0.001","90.585","0.001","97.92","0.001","1918.96","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H49 Cl2 N O4 Ti -","- C40 H49 Cl2 N O4 Ti -","- C80 H98 Cl4 N2 O8 Ti2 -","2","1","","Hancock, Stuart L.; Mahon, Mary F.; Jones, Matthew D.","Salen complexes based on 1,4-diaminocyclohexane and their exploitation for the polymerisation of rac-lactide","New Journal of Chemistry","2013","37","7","1996","","10.1039/c3nj00111c","","","0.71073","MoKα","","0.0685","0.0493","","","0.1165","0.1291","","","","","","1.046","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053049","5.7744","0.0003","15.2403","0.0008","7.9988","0.0004","90","","92.736","0.004","90","","703.12","0.06","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H10 N2 O2 -","- C6 H10 N2 O2 -","- C24 H40 N8 O8 -","4","1","","Belmar, Julio; Quezada, José; Jiménez, Claudio A.; Díaz-Gallifa, Pau; Pasán, Jorge; Ruiz-Pérez, Catalina","Synthesis, crystal structures and tautomerism in novel oximes based on hydroxyalkylpyrazolones","New Journal of Chemistry","2013","37","7","2002","","10.1039/c3nj00163f","","","1.5418","CuKα","","0.047","0.0414","","","0.1059","0.113","","","","","","0.988","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053050","8.298","0.002","15.1999","0.0005","12.458","0.003","90","","149.966","0.003","90","","786.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H9 N3 O3 -","- C6 H9 N3 O3 -","- C24 H36 N12 O12 -","4","1","","Belmar, Julio; Quezada, José; Jiménez, Claudio A.; Díaz-Gallifa, Pau; Pasán, Jorge; Ruiz-Pérez, Catalina","Synthesis, crystal structures and tautomerism in novel oximes based on hydroxyalkylpyrazolones","New Journal of Chemistry","2013","37","7","2002","","10.1039/c3nj00163f","","","1.54184","CuKα","","0.0456","0.0429","","","0.1176","0.121","","","","","","0.996","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053051","15.8072","0.0007","4.92528","0.00015","16.3792","0.0007","90","","116.696","0.005","90","","1139.27","0.09","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 N3 O3 -","- C11 H11 N3 O3 -","- C44 H44 N12 O12 -","4","1","","Belmar, Julio; Quezada, José; Jiménez, Claudio A.; Díaz-Gallifa, Pau; Pasán, Jorge; Ruiz-Pérez, Catalina","Synthesis, crystal structures and tautomerism in novel oximes based on hydroxyalkylpyrazolones","New Journal of Chemistry","2013","37","7","2002","","10.1039/c3nj00163f","","","1.54184","CuKα","","0.0575","0.0378","","","0.1265","0.1325","","","","","","1.22","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053052","19.586","0.002","5.6198","0.0007","13.7767","0.0016","90","","125.672","0.002","90","","1231.9","0.2","296","2","296","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C30 H28 O4 -","- C30 H28 O4 -","- C60 H56 O8 -","2","0.5","","Li, Chenyu; Luo, Xiaoliang; Zhao, Weijun; Li, Cuihong; Liu, Zhengping; Bo, Zhishan; Dong, Yuping; Dong, Yong Qiang; Tang, Ben Zhong","Switching the emission of tetrakis(4-methoxyphenyl)ethylene among three colors in the solid state","New Journal of Chemistry","2013","37","6","1696","","10.1039/c3nj00063j","","","0.71073","MoKα","","0.0399","0.0328","","","0.0863","0.0907","","","","","","1.059","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053053","15.363","0.003","18.607","0.004","11.891","0.002","90","","102.51","0.03","90","","3318.5","1.2","253","2","253","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C78 H54 N6 O7 Re2 -","- C78 H54 N6 O7 Re2 -","- C156 H108 N12 O14 Re4 -","2","0.5","","Chung, Wai-Kin; Wong, Keith Man-Chung; Lam, Wai Han; Zhu, Xiuling; Zhu, Nianyong; Kwok, Hoi-Sing; Yam, Vivian Wing-Wah","Syntheses, photophysical, electroluminescence and computational studies of rhenium(i) diimine triarylamine-containing alkynyl complexes","New Journal of Chemistry","2013","37","6","1753","","10.1039/c3nj00121k","","","0.71073","MoKα","","0.0362","0.0298","","","0.0747","0.0766","","","","","","1.029","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7053054","15.543","0.003","12.047","0.002","18.937","0.004","90","","110.57","0.03","90","","3319.8","1.3","301","2","301","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C39 H26 N3 O3 Re -","- C39 H26 N3 O3 Re -","- C156 H104 N12 O12 Re4 -","4","1","","Chung, Wai-Kin; Wong, Keith Man-Chung; Lam, Wai Han; Zhu, Xiuling; Zhu, Nianyong; Kwok, Hoi-Sing; Yam, Vivian Wing-Wah","Syntheses, photophysical, electroluminescence and computational studies of rhenium(i) diimine triarylamine-containing alkynyl complexes","New Journal of Chemistry","2013","37","6","1753","","10.1039/c3nj00121k","","","0.71073","MoKα","","0.0535","0.0329","","","0.0763","0.0803","","","","","","0.898","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053055","36.572","0.007","12.522","0.003","23.379","0.005","90","","124.77","0.03","90","","8795","5","301","2","301","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C43 H42 Cl4 N3 O3 Re -","- C43 H42 Cl4 N3 O3 Re -","- C344 H336 Cl32 N24 O24 Re8 -","8","1","","Chung, Wai-Kin; Wong, Keith Man-Chung; Lam, Wai Han; Zhu, Xiuling; Zhu, Nianyong; Kwok, Hoi-Sing; Yam, Vivian Wing-Wah","Syntheses, photophysical, electroluminescence and computational studies of rhenium(i) diimine triarylamine-containing alkynyl complexes","New Journal of Chemistry","2013","37","6","1753","","10.1039/c3nj00121k","","","0.71073","MoKα","","0.0684","0.0443","","","0.1146","0.1199","","","","","","0.931","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053056","17.1501","0.0005","11.1874","0.0009","20.5208","0.0011","90","","105.596","0.004","90","","3792.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H33 N8 O13 Sm Zn -","- C32 H33 N8 O13 Sm Zn -","- C128 H132 N32 O52 Sm4 Zn4 -","4","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0689","0.0477","","","0.1214","0.1292","","","","","","1.038","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053057","12.9132","0.0005","19.373","0.0006","15.1871","0.0006","90","","98.684","0.003","90","","3755.8","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H35 Eu N8 Ni O14 -","- C32 H35 Eu N8 Ni O14 -","- C128 H140 Eu4 N32 Ni4 O56 -","4","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0547","0.0305","","","0.0519","0.0563","","","","","","0.9","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053058","12.8862","0.0005","19.4017","0.0006","15.1766","0.0006","90","","98.747","0.003","90","","3750.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H35 Gd N8 Ni O14 -","- C32 H35 Gd N8 Ni O14 -","- C128 H140 Gd4 N32 Ni4 O56 -","4","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0732","0.0395","","","0.0575","0.0638","","","","","","1.006","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053059","12.8557","0.0005","19.4086","0.0007","15.1631","0.0007","90","","99.045","0.004","90","","3736.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H35 Dy N8 Ni O14 -","- C32 H35 Dy N8 Ni O14 -","- C128 H140 Dy4 N32 Ni4 O56 -","4","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.042","0.0272","","","0.0522","0.056","","","","","","1.002","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053060","12.8478","0.0005","19.3966","0.0006","15.1553","0.0005","90","","98.995","0.003","90","","3730.3","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H35 Ho N8 Ni O14 -","- C32 H35 Ho N8 Ni O14 -","- C128 H140 Ho4 N32 Ni4 O56 -","4","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0495","0.0296","","","0.0496","0.0534","","","","","","0.955","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053061","16.8588","0.0007","11.2386","0.0003","20.4501","0.001","90","","104.911","0.004","90","","3744.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H33 Cu Eu N8 O13 -","- C32 H33 Cu Eu N8 O13 -","- C128 H132 Cu4 Eu4 N32 O52 -","4","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0845","0.0516","","","0.1095","0.1202","","","","","","1.033","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053062","16.8607","0.0006","11.2122","0.0004","20.4234","0.0007","90","","104.879","0.003","90","","3731.5","0.2","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C32 H33 Cu Gd N8 O13 -","- C32 H33 Cu Gd N8 O13 -","- C128 H132 Cu4 Gd4 N32 O52 -","4","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0881","0.0498","","","0.1138","0.1257","","","","","","1.038","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053063","21.981","0.0008","12.7911","0.0003","16.9394","0.0007","90","","130.558","0.002","90","","3618.5","0.2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H29 N8 O13 Sm Zn -","- C30 H29 N8 O13 Sm Zn -","- C120 H116 N32 O52 Sm4 Zn4 -","4","0.5","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0232","0.0191","","","0.0465","0.0476","","","","","","0.994","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053064","21.9113","0.0018","12.7257","0.0007","16.8798","0.0015","90","","130.47","0.03","90","","3580.6","1.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H29 Gd N8 O13 Zn -","- C30 H29 Gd N8 O13 Zn -","- C120 H116 Gd4 N32 O52 Zn4 -","4","0.5","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0446","0.0319","","","0.0611","0.0635","","","","","","0.935","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053065","21.9564","0.0015","12.7382","0.0005","16.9246","0.0013","90","","130.408","0.005","90","","3604.4","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H29 N8 O13 Tb Zn -","- C30 H29 N8 O13 Tb Zn -","- C120 H116 N32 O52 Tb4 Zn4 -","4","0.5","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0362","0.0264","","","0.0549","0.0568","","","","","","0.939","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053066","21.795","0.002","12.7388","0.0014","16.8446","0.0019","90","","130.612","0.006","90","","3550.3","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H29 Eu N8 O13 Zn -","- C30 H29 Eu N8 O13 Zn -","- C120 H116 Eu4 N32 O52 Zn4 -","4","0.5","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0449","0.0339","","","0.0762","0.0793","","","","","","0.922","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053067","14.4975","0.0008","23.6838","0.0016","23.5318","0.0016","90","","104.979","0.006","90","","7805.2","0.9","293","2","293","2","","","","","","","","6","C 1 2/n 1","-C 2yac","15","","","","- C28 H34 N7 Ni O17 Sm -","- C28 H30 N7 Ni O17 Sm -","- C224 H240 N56 Ni8 O136 Sm8 -","8","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.0661","0.0308","","","0.0505","0.0562","","","","","","0.81","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053068","12.966","0.002","13.261","0.002","13.785","0.002","71.469","0.013","67.302","0.013","77.851","0.013","2062.8","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H34 Eu N9 Ni O14 -","- C32 H32 Eu N9 Ni O14 -","- C64 H64 Eu2 N18 Ni2 O28 -","2","1","","Sarwar, Masood; Madalan, Augustin M.; Tiseanu, Carmen; Novitchi, Ghenadie; Maxim, Catalin; Marinescu, Gabriela; Luneau, Dominique; Andruh, Marius","A new synthetic route towards binuclear 3d‒4f complexes, using non-compartmental ligands derived from o-vanillin. Syntheses, crystal structures, magnetic and luminescent properties","New Journal of Chemistry","2013","37","8","2280","","10.1039/c3nj00199g","","","0.71073","MoKα","","0.1327","0.0651","","","0.0954","0.1123","","","","","","0.858","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053069","10.037","0.003","16.03","0.004","14.767","0.004","90","","109.64","0.007","90","","2237.7","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H36 N Sc Si -","- C21 H36 N Sc Si -","- C84 H144 N4 Sc4 Si4 -","4","1","","Luo, Yunjie; Chi, Shuhui; Chen, Jue","Half-sandwich rare-earth-metal derivatives bearing pyrrolidinyl-functionalized cyclopentadienyl ligand: synthesis, characterization and catalysis in syndiospecific polymerization of styrene","New Journal of Chemistry","2013","37","9","2675","","10.1039/c3nj00214d","","","0.7107","MoKα","","0.1675","0.1056","","","0.2371","0.2775","","","","","","1.181","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053070","27.0591","0.0011","9.9549","0.0003","17.3059","0.0007","90","","112.102","0.005","90","","4319.1","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H36 N Si Y -","- C21 H36 N Si Y -","- C168 H288 N8 Si8 Y8 -","8","1","","Luo, Yunjie; Chi, Shuhui; Chen, Jue","Half-sandwich rare-earth-metal derivatives bearing pyrrolidinyl-functionalized cyclopentadienyl ligand: synthesis, characterization and catalysis in syndiospecific polymerization of styrene","New Journal of Chemistry","2013","37","9","2675","","10.1039/c3nj00214d","","","0.7107","MoKα","","0.0515","0.0357","","","0.0803","0.0848","","","","","","1.041","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053071","26.9928","0.0009","9.9102","0.0002","17.1932","0.0005","90","","112.218","0.004","90","","4257.8","0.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H36 Lu N Si -","- C21 H36 Lu N Si -","- C168 H288 Lu8 N8 Si8 -","8","1","","Luo, Yunjie; Chi, Shuhui; Chen, Jue","Half-sandwich rare-earth-metal derivatives bearing pyrrolidinyl-functionalized cyclopentadienyl ligand: synthesis, characterization and catalysis in syndiospecific polymerization of styrene","New Journal of Chemistry","2013","37","9","2675","","10.1039/c3nj00214d","","","0.7107","MoKα","","0.0376","0.0262","","","0.0509","0.0543","","","","","","1.073","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053072","10.7456","0.0016","10.7843","0.0013","16.231","0.002","108.818","0.006","93.485","0.008","94.941","0.01","1765.9","0.4","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H54 N3 Sc Si5 -","- C22.92 H33 N2.99 Sc Si4.98 -","- C45.84 H66 N5.98 Sc2 Si9.96 -","2","1","","Luo, Yunjie; Chi, Shuhui; Chen, Jue","Half-sandwich rare-earth-metal derivatives bearing pyrrolidinyl-functionalized cyclopentadienyl ligand: synthesis, characterization and catalysis in syndiospecific polymerization of styrene","New Journal of Chemistry","2013","37","9","2675","","10.1039/c3nj00214d","","","0.71075","MoKα","","0.115","0.079","","","0.2222","0.2485","","","","","","1.099","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053073","9.934","0.0004","19.5918","0.0007","17.466","0.0013","90","","97.036","0.005","90","","3373.7","0.3","220","2","220","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H54 N3 Si5 Y -","- C23 H54 N3 Si5 Y -","- C92 H216 N12 Si20 Y4 -","4","1","","Luo, Yunjie; Chi, Shuhui; Chen, Jue","Half-sandwich rare-earth-metal derivatives bearing pyrrolidinyl-functionalized cyclopentadienyl ligand: synthesis, characterization and catalysis in syndiospecific polymerization of styrene","New Journal of Chemistry","2013","37","9","2675","","10.1039/c3nj00214d","","","0.7107","MoKα","","0.0684","0.0436","","","0.0906","0.0971","","","","","","1","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053074","9.9233","0.0003","19.4249","0.0005","17.3278","0.0005","90","","96.934","0.002","90","","3315.66","0.16","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H54 Lu N3 Si5 -","- C23 H54 Lu N3 Si5 -","- C92 H216 Lu4 N12 Si20 -","4","1","","Luo, Yunjie; Chi, Shuhui; Chen, Jue","Half-sandwich rare-earth-metal derivatives bearing pyrrolidinyl-functionalized cyclopentadienyl ligand: synthesis, characterization and catalysis in syndiospecific polymerization of styrene","New Journal of Chemistry","2013","37","9","2675","","10.1039/c3nj00214d","","","0.7107","MoKα","","0.0403","0.0294","","","0.0565","0.0601","","","","","","1.001","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053075","7.076","0.003","8.7129","0.0011","15.6143","0.0019","86.398","0.015","76.694","0.012","81.384","0.01","925.8","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H16 Co O8 -","- C21 H16 Co O8 -","- C42 H32 Co2 O16 -","2","1","","Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A.","Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand","New Journal of Chemistry","2013","37","8","2303","","10.1039/c3nj00227f","","","0.71073","MoKα","","0.2201","0.0534","","","0.089","0.1194","","","","","","0.968","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053076","19.554","0.004","14.761","0.003","8.3825","0.0016","90","","90","","90","","2419.5","0.8","293","2","293","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C30 H18 Co N2 O6 -","- C30 H18 Co N2 O6 -","- C120 H72 Co4 N8 O24 -","4","","","Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A.","Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand","New Journal of Chemistry","2013","37","8","2303","","10.1039/c3nj00227f","","","0.71073","MoKα","","0.1456","0.0618","","","0.0944","0.1084","","","","","","1.008","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053077","9.2002","0.0003","16.3387","0.0005","16.4478","0.0005","90","","90","","90","","2472.42","0.13","293","2","293","2","","","","","","","","5","P b n n","-P 2n 2b","52","","","","- C30 H18 Cd N2 O6 -","- C30 H18 Cd N2 O6 -","- C120 H72 Cd4 N8 O24 -","4","0.5","","Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A.","Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand","New Journal of Chemistry","2013","37","8","2303","","10.1039/c3nj00227f","","","0.71073","MoKα","","0.0371","0.0283","","","0.0698","0.0741","","","","","","1.041","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053078","13.6277","0.0003","13.6277","0.0003","21.4357","0.0003","90","","90","","90","","3980.91","0.14","293","2","293","2","","","","","","","","4","P 42/n :2","-P 4bc","86","","","","- C21 H18 Co O9 -","- C21 H18 Co O9 -","- C168 H144 Co8 O72 -","8","1","","Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A.","Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand","New Journal of Chemistry","2013","37","8","2303","","10.1039/c3nj00227f","","","0.71073","MoKα","","0.1682","0.0748","","","0.1693","0.2138","","","","","","0.974","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053079","8.2341","0.0001","8.2839","0.0002","11.321","0.0001","69.656","0.001","72.198","0.001","61.084","0.001","624.801","0.019","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H22 Cu N4 O6 -","- C28 H22 Cu N4 O6 -","- C28 H22 Cu N4 O6 -","1","0.5","","Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A.","Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand","New Journal of Chemistry","2013","37","8","2303","","10.1039/c3nj00227f","","","0.71073","MoKα","","0.0923","0.0636","","","0.1322","0.1507","","","","","","1.072","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053080","19.6716","0.0011","14.8036","0.0008","8.3806","0.0005","90","","90","","90","","2440.5","0.2","293","2","293","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C30 H18 N2 O6 Zn -","- C30 H18 N2 O6 Zn -","- C120 H72 N8 O24 Zn4 -","4","","","Casanova, Isabel; Sousa-Pedrares, Antonio; Viqueira, Joaquin; Durán, María L.; Romero, Jaime; Sousa, Antonio; García-Vázquez, José A.","Electrochemical synthesis and structural characterization of homoleptic and heteroleptic cobalt, nickel, copper, zinc and cadmium compounds with the 2-hydroxy-1,4-naphthoquinone ligand","New Journal of Chemistry","2013","37","8","2303","","10.1039/c3nj00227f","","","0.71073","MoKα","","0.0751","0.0421","","","0.0758","0.0875","","","","","","1.063","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053081","45.859","0.004","6.0059","0.0004","15.782","0.001","90","","105.08","0.004","90","","4197.1","0.5","123","","123","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H24 N2 O2 S2 -","- C24 H24 N2 O2 S2 -","- C192 H192 N16 O16 S16 -","8","1","","Mikata, Yuji; Nakagaki, Fumie; Nakanishi, Kaori","Thioether-tethered bisquinoline derivatives as fluorescent probes for mercury(ii) and iron(iii) ions","New Journal of Chemistry","2013","37","8","2236","","10.1039/c3nj00233k","","","0.7107","MoKα","","","0.0424","","","","0.1105","","","","","","1.086","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053082","14.2333","0.0007","14.4741","0.0007","15.0775","0.0009","101.041","0.0015","113.072","0.0008","111.103","0.0003","2457.8","0.2","123.1","","123","","","","","","","","","7","P -1","-P 1","2","","","","- C22 H20 Cl2 Hg N2 O8 S2 -","- C22 H20 Cl2 Hg N2 O8 S2 -","- C88 H80 Cl8 Hg4 N8 O32 S8 -","4","2","","Mikata, Yuji; Nakagaki, Fumie; Nakanishi, Kaori","Thioether-tethered bisquinoline derivatives as fluorescent probes for mercury(ii) and iron(iii) ions","New Journal of Chemistry","2013","37","8","2236","","10.1039/c3nj00233k","","","0.7107","MoKα","","","0.0364","","","","0.0856","","","","","","1.097","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053083","14.1182","0.0007","14.1182","0.0007","12.4604","0.0011","90","","90","","90","","2483.7","0.3","150","2","150","2","","","","","","","","6","P 4/m n c","-P 4 2n","128","","","","- Co H48 K4 O62 Si W11 -","- Co0.96 K4 O62 Si W11.04 -","- Co1.92 K8 O124 Si2 W22.08 -","2","0.125","","Balula, Salete S.; Cunha-Silva, Luís; Santos, Isabel C. M. S.; Estrada, Ana C.; Fernandes, A. C.; Cavaleiro, José A. S.; Pires, João; Freire, Cristina; Cavaleiro, Ana M. V.","Mono-substituted silicotungstates as active catalysts for sustainable oxidations: homo- and heterogeneous performance","New Journal of Chemistry","2013","37","8","2341","","10.1039/c3nj00243h","","","0.71073","MoKα","","0.0409","0.0382","","","0.0952","0.0971","","","","","","1.15","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053084","17.928","0.005","10.121","0.005","21.863","0.005","90","","113.697","0.005","90","","3633","2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H32 Cu O8 P S4 -","- C36 H32 Cu O8 P S4 -","- C144 H128 Cu4 O32 P4 S16 -","4","1","","Tripathi, Kumud Malika; Begum, Ameerunisha; Sonkar, Sumit Kumar; Sarkar, Sabyasachi","Nanospheres of copper(iii) 1,2-dicarbomethoxy-1,2-dithiolate and its composite with water soluble carbon nanotubes","New Journal of Chemistry","2013","37","9","2708","","10.1039/c3nj00368j","","","0.71073","MoKα","","0.0794","0.0535","","","0.1353","0.1809","","","","","","1.062","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053085","17.251","0.003","12.4954","0.0019","28.007","0.004","90","","97.612","0.003","90","","5983.9","1.6","293","2","293","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C104.9 H160.8 Cl5.8 N19 O20 P2 S2 -","- C104 H148 Cl4 N19 O20 P2 S2 -","- C208 H296 Cl8 N38 O40 P4 S4 -","2","0.5","","Zhang, Yanlei; Zhang, Rui; Zhao, Yanxia; Ji, Liguo; Jia, Chuandong; Wu, Biao","Anion binding of tris-(thio)urea ligands","New Journal of Chemistry","2013","37","8","2266","","10.1039/c3nj00401e","","","0.71073","MoKα","","0.1157","0.0845","","","0.2508","0.2771","","","","","","1.083","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053086","20.3327","0.0003","7.2956","0.0001","26.1828","0.0005","90","","114.731","0.002","90","","3527.71","0.11","100","1","100","1","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 B Cl2 F2 N3 -","- C18 H16 B Cl2 F2 N3 -","- C144 H128 B8 Cl16 F16 N24 -","8","1","","Bartelmess, Juergen; Weare, Walter W.; Latortue, Narah; Duong, Christina; Jones, Daniel S.","meso-Pyridyl BODIPYs with tunable chemical, optical and electrochemical properties","New Journal of Chemistry","2013","37","9","2663","","10.1039/c3nj00426k","","x-ray","1.54184","CuKα","","0.0261","0.025","","","0.066","0.067","","","","","","1.049","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053087","7.3678","0.0001","22.1323","0.0003","10.9276","0.0002","90","","109.642","0.002","90","","1678.24","0.05","100","1","100","1","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H17 B Cl F2 N3 -","- C18 H17 B Cl F2 N3 -","- C72 H68 B4 Cl4 F8 N12 -","4","1","","Bartelmess, Juergen; Weare, Walter W.; Latortue, Narah; Duong, Christina; Jones, Daniel S.","meso-Pyridyl BODIPYs with tunable chemical, optical and electrochemical properties","New Journal of Chemistry","2013","37","9","2663","","10.1039/c3nj00426k","","x-ray","1.54184","CuKα","","0.0372","0.0352","","","0.0918","0.0933","","","","","","1.085","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053088","8.925","0.003","7.601","0.002","26.621","0.008","90","","92.886","0.004","90","","1803.6","0.9","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","1,3-Bis(S)1,2,3,4-tetrahydronaphtalen-1-yl)urea","","","- C21 H24 N2 O -","- C21 H24 N2 O -","- C84 H96 N8 O4 -","4","2","","Trejo-Huizar, Karla Elisa; Ortiz-Rico, Ricardo; Peña-González, María de los Angeles; Hernández-Rodríguez, Marcos","Recognition of chiral carboxylates by 1,3-disubstituted thioureas with 1-arylethyl scaffolds","New Journal of Chemistry","2013","37","9","2610","","10.1039/c3nj00644a","","","0.71073","MoKα","","0.1004","0.0676","","","0.1135","0.1258","","","","","","1.095","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053089","9.5896","0.0001","13.9112","0.0002","16.3886","0.0003","109.382","0.001","94.1999","0.0011","107.952","0.0009","1924.07","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H79 Fe3 N28 O14 Th2 -","- C48 H79 Fe3 N28 O14 Th2 -","- C48 H79 Fe3 N28 O14 Th2 -","1","0.5","","Dumas, Thomas; Charbonnel, Marie Christine; Charushnikova, Iraida A.; Conradson, Steven D.; Fillaux, Clara; Hennig, Christoph; Moisy, Philippe; Petit, Sébastien; Scheinost, Andreas C.; Shuh, David K.; Tyliszczak, Tolek; Auwer, Christophe Den","Multi-edge X-ray absorption spectroscopy of thorium, neptunium and plutonium hexacyanoferrate compounds","New Journal of Chemistry","2013","37","10","3003","","10.1039/c3nj00318c","","","0.71073","MoKα","","0.0408","0.0354","","","0.0925","0.095","","","","","","1.072","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053090","9.7335","0.0019","17.276","0.004","10.034","0.002","90","","99.91","0.03","90","","1662.1","0.6","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C18 H38 Fe N11 O12 Th -","- C18 H38 Fe N11 O12 Th -","- C36 H76 Fe2 N22 O24 Th2 -","2","0.5","","Dumas, Thomas; Charbonnel, Marie Christine; Charushnikova, Iraida A.; Conradson, Steven D.; Fillaux, Clara; Hennig, Christoph; Moisy, Philippe; Petit, Sébastien; Scheinost, Andreas C.; Shuh, David K.; Tyliszczak, Tolek; Auwer, Christophe Den","Multi-edge X-ray absorption spectroscopy of thorium, neptunium and plutonium hexacyanoferrate compounds","New Journal of Chemistry","2013","37","10","3003","","10.1039/c3nj00318c","","","0.71073","MoKα","","0.0478","0.0407","","","0.1066","0.1101","","","","","","1.08","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053091","4.5858","0.0001","12.6009","0.0002","21.26","0.0004","90","","94.044","0.0007","90","","1225.45","0.04","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-aminosalicylic acid - nicotinamide cocrystal","","","- C13 H13 N3 O4 -","- C13 H13 N3 O4 -","- C52 H52 N12 O16 -","4","1","","Sarcevica, Inese; Orola, Liana; Belyakov, Sergey; Veidis, Mikelis V.","Spontaneous cocrystal hydrate formation in the solid state: crystal structure aspects and kinetics","New Journal of Chemistry","2013","37","10","2978","","10.1039/c3nj00489a","","","0.71069","MoKα","","0.0506","0.0379","","","0.0903","0.0971","","","","","","1.029","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053092","16.9534","0.0018","12.6293","0.0013","26.729","0.003","90","","92.474","0.002","90","","5717.6","1.1","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C59 H132 Ag20 N14 O33 S10 -","- C59 H132 Ag20 N14 O33 S10 -","- C118 H264 Ag40 N28 O66 S20 -","2","0.5","","Yuan, Shuai; Deng, Yong-Kai; Wang, Xing-Po; Sun, Di","A temperature-sensitive luminescent Ag20 nanocluster templated by carbonate in situ generated from atmospheric CO2 fixation","New Journal of Chemistry","2013","37","10","2973","","10.1039/c3nj00645j","","","0.71073","MoKα","","0.1661","0.0888","","","0.1933","0.2309","","","","","","1.001","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053093","6.9519","0.0006","14.9904","0.0013","12.8623","0.0013","90","","103.276","0.006","90","","1304.6","0.2","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(4-pyridyl)-imidazole, silver(I) perchlorate","","- C10 H10 Ag Cl N4 O4 -","- C10 H10 Ag Cl N4 O4 -","- C40 H40 Ag4 Cl4 N16 O16 -","4","1","","Abul Haj, Mohammad; Aakeröy, Christer B.; Desper, John","Silver(i) coordination chemistry: from 1-D chains to molecular rectangles","New Journal of Chemistry","2013","37","1","204","","10.1039/c2nj40669a","","","0.71073","MoKα","","0.1227","0.0667","","","0.151","0.1769","","","","","","0.969","","","","has coordinates,has disorder","180084","2020-10-21","18:00:00",""
"7053094","6.7927","0.0003","15.7016","0.0007","13.1938","0.0006","90","","102.723","0.002","90","","1372.65","0.11","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2-(4-pyridyl)-imidazole, silver(I) hexafluorophosphate","","- C10 H10 Ag F6 N4 P -","- C10 H10 Ag F6 N4 P -","- C40 H40 Ag4 F24 N16 P4 -","4","1","","Abul Haj, Mohammad; Aakeröy, Christer B.; Desper, John","Silver(i) coordination chemistry: from 1-D chains to molecular rectangles","New Journal of Chemistry","2013","37","1","204","","10.1039/c2nj40669a","","","0.71073","MoKα","","0.0353","0.0278","","","0.0621","0.0648","","","","","","1.02","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053095","6.4496","0.0005","13.5953","0.0011","8.6168","0.0006","90","","94.244","0.003","90","","753.49","0.1","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(2-imidazolyl)-pyridine, silver(I)","","- C8 H6 Ag N3 -","- C8 H6 Ag N3 -","- C32 H24 Ag4 N12 -","4","1","","Abul Haj, Mohammad; Aakeröy, Christer B.; Desper, John","Silver(i) coordination chemistry: from 1-D chains to molecular rectangles","New Journal of Chemistry","2013","37","1","204","","10.1039/c2nj40669a","","","0.71073","MoKα","","0.0401","0.0321","","","0.0686","0.0712","","","","","","1.151","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053096","6.9704","0.0004","7.8319","0.0005","19.4544","0.0011","79.749","0.002","85.086","0.002","81.023","0.002","1030.46","0.11","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","4-(2-imidazolyl)-pyridine, silver(I) nitrate","","- C32 H34 Ag4 N16 O15 -","- C32 H34 Ag4 N16 O15 -","- C32 H34 Ag4 N16 O15 -","1","0.5","","Abul Haj, Mohammad; Aakeröy, Christer B.; Desper, John","Silver(i) coordination chemistry: from 1-D chains to molecular rectangles","New Journal of Chemistry","2013","37","1","204","","10.1039/c2nj40669a","","","0.71073","MoKα","","0.0305","0.0261","","","0.0568","0.0596","","","","","","1.092","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053097","13.736","0.0004","17.136","0.0005","23.276","0.0003","90","","123.993","0.0014","90","","4542.4","0.2","150","2","150","2","","","","","","","synthesized by the authors","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H62 N2 O8 -","- C48 H62 N2 O8 -","- C192 H248 N8 O32 -","4","1","","Hudeček, Oldřich; Budka, Jan; Dvořáková, Hana; Cuřínová, Petra; Císařová, Ivana; Lhoták, Pavel","Anion receptors based on ureidocalix[4]arenes immobilised in the partial cone conformation","New Journal of Chemistry","2013","37","1","220","","10.1039/c2nj40724h","","","0.71073","MoKα","","0.097","0.0609","","","0.1683","0.1959","","","","","","0.999","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053098","16.6808","0.0008","16.6808","0.0008","52.257","0.005","90","","90","","120","","12592.4","1.5","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C15 H58 Mn N4 O24 P6 -","- C15 H58 Mn N4 O24 P6 -","- C180 H696 Mn12 N48 O288 P72 -","12","0.333333","","Tian, Hui; Zhu, Yan-Yu; Sun, Zhen-Gang; Tong, Fei; Zhu, Jiang; Chu, Wei; Sun, Shou-Hui; Zheng, Ming-Jing","Mixed-solvothermal synthesis, structures, luminescent and surface photovoltage properties of four new transition metal diphosphonates with a 3D supramolecular structure","New Journal of Chemistry","2013","37","1","212","","10.1039/c2nj40737j","","","0.71073","MoKα","","0.0798","0.0549","","","0.1507","0.1747","","","","","","1","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053099","16.6483","0.0006","16.6483","0.0006","51.521","0.003","90","","90","","120","","12366.7","1","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C15 H58 Co N4 O24 P6 -","- C15 H58 Co N4 O24 P6 -","- C180 H696 Co12 N48 O288 P72 -","12","0.333333","","Tian, Hui; Zhu, Yan-Yu; Sun, Zhen-Gang; Tong, Fei; Zhu, Jiang; Chu, Wei; Sun, Shou-Hui; Zheng, Ming-Jing","Mixed-solvothermal synthesis, structures, luminescent and surface photovoltage properties of four new transition metal diphosphonates with a 3D supramolecular structure","New Journal of Chemistry","2013","37","1","212","","10.1039/c2nj40737j","","","0.71073","MoKα","","0.0636","0.0497","","","0.1578","0.1724","","","","","","1.097","","","","has coordinates","180084","2020-10-21","18:00:00",""
"7053100","16.6093","0.0007","16.6093","0.0007","51.213","0.004","90","","90","","120","","12235.3","1.2","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C15 H58 N4 Ni O24 P6 -","- C15 H58 N4 Ni O24 P6 -","- C180 H696 N48 Ni12 O288 P72 -","12","0.333333","","Tian, Hui; Zhu, Yan-Yu; Sun, Zhen-Gang; Tong, Fei; Zhu, Jiang; Chu, Wei; Sun, Shou-Hui; Zheng, Ming-Jing","Mixed-solvothermal synthesis, structures, luminescent and surface photovoltage properties of four new transition metal diphosphonates with a 3D supramolecular structure","New Journal of Chemistry","2013","37","1","212","","10.1039/c2nj40737j","","","0.71073","MoKα","","0.0654","0.0499","","","0.1496","0.1666","","","","","","1.048","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053101","16.6344","0.0015","16.6344","0.0015","51.382","0.007","90","","90","","120","","12313","2","293","2","293","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C15 H58 N4 O24 P6 Zn -","- C15 H58 N4 O24 P6 Zn -","- C180 H696 N48 O288 P72 Zn12 -","12","0.333333","","Tian, Hui; Zhu, Yan-Yu; Sun, Zhen-Gang; Tong, Fei; Zhu, Jiang; Chu, Wei; Sun, Shou-Hui; Zheng, Ming-Jing","Mixed-solvothermal synthesis, structures, luminescent and surface photovoltage properties of four new transition metal diphosphonates with a 3D supramolecular structure","New Journal of Chemistry","2013","37","1","212","","10.1039/c2nj40737j","","","0.71073","MoKα","","0.0769","0.0531","","","0.1458","0.1617","","","","","","1.061","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053102","10.382","0.002","11.335","0.003","12.001","0.005","113.852","0.008","99.102","0.008","108.116","0.006","1160.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H44 Ag F6 N8 P -","- C54 H44 Ag F6 N8 P -","- C54 H44 Ag F6 N8 P -","1","0.5","","Dinda, Joydev; Adhikary, Sirsendu Das; Seth, Saikat Kumar; Mahapatra, Ambikesh","Carbazole functionalized luminescent silver(i), gold(i) and gold(iii)‒N-heterocyclic carbene complexes: a new synthetic disproportionation approach towards Au(i)‒NHC to provide Au(iii)‒NHC","New Journal of Chemistry","2013","37","2","431","","10.1039/c2nj40740j","","","0.71073","MoKα","","0.0479","0.0377","","","0.0789","0.0837","","","","","","1.029","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053103","10.107","0.002","11.469","0.001","12.087","0.002","113.244","0.001","100.451","0.003","106.521","0.001","1163.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H44 Au F6 N8 P -","- C54 H44 Au F6 N8 P -","- C54 H44 Au F6 N8 P -","1","0.5","","Dinda, Joydev; Adhikary, Sirsendu Das; Seth, Saikat Kumar; Mahapatra, Ambikesh","Carbazole functionalized luminescent silver(i), gold(i) and gold(iii)‒N-heterocyclic carbene complexes: a new synthetic disproportionation approach towards Au(i)‒NHC to provide Au(iii)‒NHC","New Journal of Chemistry","2013","37","2","431","","10.1039/c2nj40740j","","","0.71073","MoKα","","0.0468","0.0441","","","0.104","0.1061","","","","","","1.069","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053104","7.6394","0.0009","15.8473","0.0018","8.8524","0.0011","90","","95.036","0.003","90","","1067.6","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H19 Au Cl3 N3 -","- C22 H19 Au Cl3 N3 -","- C44 H38 Au2 Cl6 N6 -","2","1","","Dinda, Joydev; Adhikary, Sirsendu Das; Seth, Saikat Kumar; Mahapatra, Ambikesh","Carbazole functionalized luminescent silver(i), gold(i) and gold(iii)‒N-heterocyclic carbene complexes: a new synthetic disproportionation approach towards Au(i)‒NHC to provide Au(iii)‒NHC","New Journal of Chemistry","2013","37","2","431","","10.1039/c2nj40740j","","","0.71073","MoKα","","0.028","0.0256","","","0.0583","0.0593","","","","","","1.017","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053105","9.2067","0.0018","19.017","0.004","16.825","0.003","90","","100.56","0.03","90","","2895.9","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H29 Cd N5 O9 S2 -","- C20 H14 Cd N4 O4 S2 -","- C80 H56 Cd4 N16 O16 S8 -","4","1","","zhou, Xiaojing; Zhang, Zhijuan; Li, Baiyan; Yang, Fen; Peng, Yu; Li, Guanghua; Shi, Zhan; Feng, Shouhua; Li, Jing","Two three-dimensional metal‒organic frameworks constructed by thiazole-spaced pyridinecarboxylates exhibiting selective gas sorption or antiferromagnetic coupling","New Journal of Chemistry","2013","37","2","425","","10.1039/c2nj40805h","","","0.71073","MoKα","","0.0588","0.0374","","","0.0673","0.0716","","","","","","0.865","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053106","9.1726","0.0018","18.956","0.004","16.748","0.003","90","","102.13","0.03","90","","2847.1","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 Mn N5 O8 S2 -","- C20 H14 Mn N4 O4 S2 -","- C80 H56 Mn4 N16 O16 S8 -","4","1","","zhou, Xiaojing; Zhang, Zhijuan; Li, Baiyan; Yang, Fen; Peng, Yu; Li, Guanghua; Shi, Zhan; Feng, Shouhua; Li, Jing","Two three-dimensional metal‒organic frameworks constructed by thiazole-spaced pyridinecarboxylates exhibiting selective gas sorption or antiferromagnetic coupling","New Journal of Chemistry","2013","37","2","425","","10.1039/c2nj40805h","","","0.71073","MoKα","","0.0543","0.0354","","","0.0715","0.0753","","","","","","0.855","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053107","7.0234","0.0003","11.5161","0.0007","16.6952","0.0013","84.67","0.003","85.169","0.004","81.571","0.004","1326.56","0.14","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H31 I N4 O3 S3 -","- C21 H31 I N4 O3 S3 -","- C42 H62 I2 N8 O6 S6 -","2","1","","Park, Hee-Jun; Kim, Wooyul; Choi, Wonyong; Chung, Young Keun","Ruthenium(ii) complexes incorporating the bidentate ligand containing an imidazolium moiety: synthesis, characterization, and electrochemical properties and their application in a visible-light induced hydrogen-evolving system","New Journal of Chemistry","2013","37","10","3174","","10.1039/c3nj00014a","","","0.71073","MoKα","","0.1514","0.073","","","0.1492","0.1842","","","","","","1.03","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053108","12.8038","0.0007","12.9738","0.0007","15.058","0.0009","82.105","0.003","83.499","0.003","75.437","0.003","2389.9","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H39 F18 N8 O5 P3 Ru -","- C39 H29 F18 N8 P3 Ru -","- C78 H58 F36 N16 P6 Ru2 -","2","1","","Park, Hee-Jun; Kim, Wooyul; Choi, Wonyong; Chung, Young Keun","Ruthenium(ii) complexes incorporating the bidentate ligand containing an imidazolium moiety: synthesis, characterization, and electrochemical properties and their application in a visible-light induced hydrogen-evolving system","New Journal of Chemistry","2013","37","10","3174","","10.1039/c3nj00014a","","","0.71073","MoKα","","0.1049","0.0756","","","0.2176","0.2419","","","","","","0.963","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053109","8.242","0.001","8.242","0.001","22.569","0.004","90","","90","","120","","1327.7","0.3","298","2","298","2","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- C3 H3 Fe O6 -","- C3 H3 Fe O6 -","- C18 H18 Fe6 O36 -","6","0.166667","","Paredes-García, Verónica; Rojas, Ignacio; Madrid, Rosa; Vega, Andres; Navarro-Moratalla, Efrén; Cañón-Mancisidor, Walter; Spodine, Evgenia; Venegas-Yazigi, Diego","Structural and magnetic characterization of the tridimensional network [Fe(HCO2)3]n·nHCO2H","New Journal of Chemistry","2013","37","7","2120","","10.1039/c3nj00023k","","","0.71073","MoKα","","0.0174","0.017","","","0.051","0.0513","","","","","","1.019","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053110","17.749","0.007","16.668","0.006","21.755","0.008","90","","94.496","0.008","90","","6416","4","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32.75 H40 N O11.75 S -","- C31 H33 N O10 S -","- C248 H264 N8 O80 S8 -","8","1","","Wu, Meng; Wang, Zi-Wen; Liu, Yu-Xiu; Song, Hai-Bin; Zhang, Ao; Meng, Ling-Hua; Wang, Qing-Min","Different salt derivatives of phenanthroindolizidine alkaloids display different in vitro antitumor activity","New Journal of Chemistry","2013","37","6","1817","","10.1039/c3nj00031a","","","0.71073","MoKα","","0.0562","0.045","","","0.122","0.1275","","","","","","1.041","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053111","13.8857","0.0015","16.496","0.002","19.62","0.003","90","","90.266","0.008","90","","4494.1","1","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H32 Cl N O5 -","- C25 H32 Cl N O5 -","- C200 H256 Cl8 N8 O40 -","8","1","","Wu, Meng; Wang, Zi-Wen; Liu, Yu-Xiu; Song, Hai-Bin; Zhang, Ao; Meng, Ling-Hua; Wang, Qing-Min","Different salt derivatives of phenanthroindolizidine alkaloids display different in vitro antitumor activity","New Journal of Chemistry","2013","37","6","1817","","10.1039/c3nj00031a","","","0.71073","MoKα","","0.085","0.0551","","","0.1141","0.1283","","","","","","0.969","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053112","14.507","0.003","16.714","0.003","20.116","0.004","90","","92.21","0.03","90","","4873.9","1.7","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24.78 H31.11 I N O4.78 -","- C24 H28 I N O4 -","- C192 H224 I8 N8 O32 -","8","1","","Wu, Meng; Wang, Zi-Wen; Liu, Yu-Xiu; Song, Hai-Bin; Zhang, Ao; Meng, Ling-Hua; Wang, Qing-Min","Different salt derivatives of phenanthroindolizidine alkaloids display different in vitro antitumor activity","New Journal of Chemistry","2013","37","6","1817","","10.1039/c3nj00031a","","","0.71073","MoKα","","0.0702","0.0558","","","0.1257","0.1329","","","","","","1.144","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053113","7.2916","0.0003","13.7926","0.0005","14.493","0.0006","78.306","0.002","82.839","0.002","80.576","0.002","1401.72","0.1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Br2 N6 O6 -","- C26 H28 Br2 N6 O6 -","- C52 H56 Br4 N12 O12 -","2","1","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.077","0.0444","","","0.1297","0.1513","","","","","","0.962","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053114","7.0527","0.0012","13.808","0.002","14.472","0.002","78.038","0.005","83.616","0.005","81.133","0.005","1357.7","0.4","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H28 Cl2 N6 O6 -","- C26 H28 Cl2 N6 O6 -","- C52 H56 Cl4 N12 O12 -","2","1","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.1116","0.0647","","","0.1609","0.1907","","","","","","0.962","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053115","8.5912","0.0004","12.595","0.0006","14.3918","0.0007","90","","106.76","0.002","90","","1491.13","0.12","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 N6 O14 S2 -","- C26 H30 N6 O14 S2 -","- C52 H60 N12 O28 S4 -","2","0.5","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.0962","0.0875","","","0.2195","0.2258","","","","","","0.908","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053116","6.691","0.003","13.879","0.006","17.851","0.007","90","","109.63","0.02","90","","1561.4","1.2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 N6 O12 S2 -","- C28 H30 N6 O12 S2 -","- C56 H60 N12 O24 S4 -","2","0.5","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.0831","0.0554","","","0.1545","0.1746","","","","","","0.998","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053117","6.9112","0.0009","9.5788","0.0011","20.126","0.002","90","","94.476","0.008","90","","1328.3","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 N8 O10 -","- C26 H24 N8 O10 -","- C52 H48 N16 O20 -","2","0.5","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.0754","0.0528","","","0.1699","0.2139","","","","","","1.166","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053118","19.277","0.006","9.226","0.003","34.761","0.01","90","","116.698","0.019","90","","5523","3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C104 H102 F24 N24 O19 Si4 -","- C104 H96 F24 N24 O19 Si4 -","- C208 H192 F48 N48 O38 Si8 -","2","0.5","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.1156","0.0817","","","0.1765","0.246","","","","","","1.116","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053119","9.5472","0.0005","24.1664","0.001","12.7016","0.0005","90","","101.922","0.002","90","","2867.3","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 Cl2 N6 O12 -","- C26 H24 Cl2 N6 O12 -","- C104 H96 Cl8 N24 O48 -","4","1","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.147","0.0733","","","0.1829","0.2229","","","","","","1.031","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053120","7.5861","0.0004","10.2212","0.0006","18.4816","0.0014","100.062","0.006","98.722","0.005","106.368","0.005","1322.86","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H27 N6 O9 P -","- C26 H27 N6 O9 P -","- C52 H54 N12 O18 P2 -","2","1","","Nath, Jayanta K.; Baruah, Jubaraj B.","Water assisted anion chains and anion dependent fluorescence emission in salts of N,N′-bis(3-imidazol-1-ylpropyl)naphthalenediimide","New Journal of Chemistry","2013","37","5","1509","","10.1039/c3nj00034f","","","0.71073","MoKα","","0.0807","0.0572","","","0.1385","0.1555","","","","","","1","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053121","13.7661","0.0005","24.6948","0.0011","8.3773","0.001","90","","105.686","0.005","90","","2741.8","0.4","110","2","110","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C27 H26 Ce N O10 -","- C27 H26 Ce N O10 -","- C108 H104 Ce4 N4 O40 -","4","0.5","","Patra, Ranjan; Titi, Hatem M.; Goldberg, Israel","Metal‒organic coordination polymers with a new 3,5-(4-carboxybenzyloxy) benzoic acid linker","New Journal of Chemistry","2013","37","5","1494","","10.1039/c3nj00054k","","","0.71073","MoKα","","0.0429","0.0344","","","0.0821","0.0856","","","","","","1.092","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053122","13.6593","0.0004","24.5441","0.0011","8.4234","0.0003","90","","105.445","0.003","90","","2722","0.18","110","2","110","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C27 H26 N Nd O10 -","- C27 H26 N Nd O10 -","- C108 H104 N4 Nd4 O40 -","4","0.5","","Patra, Ranjan; Titi, Hatem M.; Goldberg, Israel","Metal‒organic coordination polymers with a new 3,5-(4-carboxybenzyloxy) benzoic acid linker","New Journal of Chemistry","2013","37","5","1494","","10.1039/c3nj00054k","","","0.71073","MoKα","","0.0525","0.0403","","","0.0946","0.1005","","","","","","1.066","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053123","17.8091","0.0004","25.5978","0.0007","5.7377","0.0002","90","","98.1557","0.0012","90","","2589.21","0.13","110","2","110","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H15 Cu2 O9 -","- C23 H15 Cu2 O9 -","- C92 H60 Cu8 O36 -","4","0.5","","Patra, Ranjan; Titi, Hatem M.; Goldberg, Israel","Metal‒organic coordination polymers with a new 3,5-(4-carboxybenzyloxy) benzoic acid linker","New Journal of Chemistry","2013","37","5","1494","","10.1039/c3nj00054k","","","0.71073","MoKα","","0.0474","0.0401","","","0.1101","0.1142","","","","","","1.045","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053124","15.3997","0.0009","15.4635","0.0009","17.2247","0.001","93.145","0.003","114.157","0.002","100.775","0.003","3636.9","0.4","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H90 Cd2 N8 O20 -","- C60 H54 Cd2 N4 O16 -","- C120 H108 Cd4 N8 O32 -","2","1","","Patra, Ranjan; Titi, Hatem M.; Goldberg, Israel","Metal‒organic coordination polymers with a new 3,5-(4-carboxybenzyloxy) benzoic acid linker","New Journal of Chemistry","2013","37","5","1494","","10.1039/c3nj00054k","","","0.71073","MoKα","","0.098","0.0683","","","0.1499","0.16","","","","","","1.047","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053125","8.202","0.0003","14.2941","0.0006","15.4384","0.0005","75.737","0.003","88.315","0.003","75.493","0.003","1697.27","0.11","172.9","0.3","172.9","0.3","","","","","","","","6","P -1","-P 1","2","","","","- C33 H39 Cl2 F3 P3 Re -","- C33 H39 Cl2 F3 P3 Re -","- C66 H78 Cl4 F6 P6 Re2 -","2","1","","He, Guomei; Fan, Ting; Chen, Jiangxi; Sung, Herman Ho-Yung; Williams, Ian Duncan; Lin, Zhenyang; Jia, Guochen","Effects of substituents on the formation of rhenium carbyne and η2-vinyl complexes from the reactions of ReH5(PMe2Ph)3 with terminal alkynes","New Journal of Chemistry","2013","37","6","1823","","10.1039/c3nj00062a","","x-ray","1.5418","CuKα","","0.0312","0.0305","","","0.0745","0.075","","","","","","1.012","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053126","9.4371","0.0002","13.1854","0.0004","13.7827","0.0005","103.898","0.003","93.937","0.002","95.447","0.002","1649.84","0.09","173","0.14","173","0.14","","","","","","","","6","P -1","-P 1","2","","","","- C33 H39 Cl2 F3 P3 Re -","- C33 H39 Cl2 F3 P3 Re -","- C66 H78 Cl4 F6 P6 Re2 -","2","1","","He, Guomei; Fan, Ting; Chen, Jiangxi; Sung, Herman Ho-Yung; Williams, Ian Duncan; Lin, Zhenyang; Jia, Guochen","Effects of substituents on the formation of rhenium carbyne and η2-vinyl complexes from the reactions of ReH5(PMe2Ph)3 with terminal alkynes","New Journal of Chemistry","2013","37","6","1823","","10.1039/c3nj00062a","","x-ray","1.5418","CuKα","","0.0274","0.027","","","0.0699","0.0702","","","","","","1.005","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053127","10.7952","0.0003","12.6871","0.0004","13.8264","0.0004","90.643","0.003","98.261","0.002","108.65","0.003","1772.3","0.1","173","0.14","173","0.14","","","","","","","","7","P -1","-P 1","2","","","","- C33.25 H40 Cl2 F3 O0.25 P3 Re -","- C33.25 H39 Cl2 F3 O0.25 P3 Re -","- C66.5 H78 Cl4 F6 O0.5 P6 Re2 -","2","1","","He, Guomei; Fan, Ting; Chen, Jiangxi; Sung, Herman Ho-Yung; Williams, Ian Duncan; Lin, Zhenyang; Jia, Guochen","Effects of substituents on the formation of rhenium carbyne and η2-vinyl complexes from the reactions of ReH5(PMe2Ph)3 with terminal alkynes","New Journal of Chemistry","2013","37","6","1823","","10.1039/c3nj00062a","","x-ray","1.5418","CuKα","","0.0212","0.0208","","","0.0581","0.0584","","","","","","1.013","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053128","10.619","0.003","5.43","0.002","14.639","0.005","90","","108.69","0.02","90","","799.6","0.5","120","2","120","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C6 H9 N5 O2 -","- C6 H9 N5 O2 -","- C24 H36 N20 O8 -","4","1","","Boland, Yves; Safin, Damir A.; Tinant, Bernard; Babashkina, Maria G.; Marchand-Brynaert, Jacqueline; Garcia, Yann","Routes to novel mono- and bis-tetrazole compounds: synthesis, spectroscopic and structural characterization","New Journal of Chemistry","2013","37","4","1174","","10.1039/c3nj00090g","","","0.71069","MoKα","","0.0433","0.04","","","0.1205","0.1231","","","","","","1.206","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053129","12.849","0.003","5.378","0.002","16.169","0.005","90","","102.5","0.02","90","","1090.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C7 H11 N9 O -","- C7 H11 N9 O -","- C28 H44 N36 O4 -","4","1","","Boland, Yves; Safin, Damir A.; Tinant, Bernard; Babashkina, Maria G.; Marchand-Brynaert, Jacqueline; Garcia, Yann","Routes to novel mono- and bis-tetrazole compounds: synthesis, spectroscopic and structural characterization","New Journal of Chemistry","2013","37","4","1174","","10.1039/c3nj00090g","","","0.71069","MoKα","","0.0494","0.043","","","0.1102","0.1144","","","","","","1.116","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053130","13.8832","0.0005","11.6611","0.0004","30.2445","0.0009","90","","94.113","0.001","90","","4883.8","0.3","100","2","100","2","","","","","","","synthetical product","5","P 1 21/n 1","-P 2yn","14","","(mu2-oxo)-bis(2,4-di-tert-butyl-6-[{[2-(dimethylamino)ethyl]imino}methyl]phe- nolato)-tetraoxo-di-molybdenum(VI) acetonitrile solvate (1:2)","","- C42 H72 Mo2 N6 O7 -","- C42.002 H72.003 Mo2 N6.001 O7 -","- C168.008 H288.012 Mo8 N24.004 O28 -","4","1","","Judmaier, Martina E.; Sala, Chris H.; Belaj, Ferdinand; Volpe, Manuel; Mösch-Zanetti, Nadia C.","Dimeric μ-oxo bridged molybdenum(vi) dioxo complexes as catalysts in the epoxidation of internal and terminal alkenes","New Journal of Chemistry","2013","37","7","2139","","10.1039/c3nj00115f","","","0.71073","MoKα","","0.0322","0.0268","","","0.0657","0.0686","","","","","","1.06","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053131","7.4666","0.0006","14.8332","0.0011","16.7476","0.0012","98.171","0.002","90.647","0.002","92.937","0.002","1833.3","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H46 Cl4 Mo2 N4 O7 -","- C28 H46 Cl4 Mo2 N4 O7 -","- C56 H92 Cl8 Mo4 N8 O14 -","2","1","","Judmaier, Martina E.; Sala, Chris H.; Belaj, Ferdinand; Volpe, Manuel; Mösch-Zanetti, Nadia C.","Dimeric μ-oxo bridged molybdenum(vi) dioxo complexes as catalysts in the epoxidation of internal and terminal alkenes","New Journal of Chemistry","2013","37","7","2139","","10.1039/c3nj00115f","","","0.71073","MoKα","","0.034","0.0297","","","0.0754","0.079","","","","","","1.071","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053132","8.1437","0.0017","10.197","0.002","12.09","0.003","90","","92.216","0.004","90","","1003.2","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H11 N5 O2 -","- C8 H11 N5 O2 -","- C32 H44 N20 O8 -","4","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Shamshina, Julia L.; Beasley, Preston A.; McCrary, Parker D.; Kelley, Steven P.; Rogers, Robin D.","Azolium azolates from reactions of neutral azoles with 1,3-dimethyl-imidazolium-2-carboxylate, 1,2,3-trimethyl-imidazolium hydrogen carbonate, and N,N-dimethyl-pyrrolidinium hydrogen carbonate","New Journal of Chemistry","2013","37","5","1461","","10.1039/c3nj00147d","","","0.71073","MoKα","","0.0947","0.0581","","","0.1063","0.1187","","","","","","1.09","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053133","6.928","0.0013","8.2326","0.0015","10.864","0.002","74.659","0.003","74.897","0.003","68.18","0.003","545.56","0.17","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H26 N10 O4 -","- C18 H26 N10 O4 -","- C18 H26 N10 O4 -","1","0.5","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Shamshina, Julia L.; Beasley, Preston A.; McCrary, Parker D.; Kelley, Steven P.; Rogers, Robin D.","Azolium azolates from reactions of neutral azoles with 1,3-dimethyl-imidazolium-2-carboxylate, 1,2,3-trimethyl-imidazolium hydrogen carbonate, and N,N-dimethyl-pyrrolidinium hydrogen carbonate","New Journal of Chemistry","2013","37","5","1461","","10.1039/c3nj00147d","","","0.71073","MoKα","","0.0749","0.0503","","","0.1204","0.1289","","","","","","1.102","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053134","7.8099","0.0017","12.914","0.003","11.053","0.002","90","","97.967","0.004","90","","1104","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 N6 O4 -","- C8 H10 N6 O4 -","- C32 H40 N24 O16 -","4","1","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Shamshina, Julia L.; Beasley, Preston A.; McCrary, Parker D.; Kelley, Steven P.; Rogers, Robin D.","Azolium azolates from reactions of neutral azoles with 1,3-dimethyl-imidazolium-2-carboxylate, 1,2,3-trimethyl-imidazolium hydrogen carbonate, and N,N-dimethyl-pyrrolidinium hydrogen carbonate","New Journal of Chemistry","2013","37","5","1461","","10.1039/c3nj00147d","","","0.71073","MoKα","","0.0769","0.0526","","","0.121","0.1318","","","","","","1.053","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053135","6.4782","0.0006","26.704","0.002","11.0823","0.001","90","","90","","90","","1917.2","0.3","173","2","173","2","","","","","","","","4","C m c a","-C 2ac 2","64","","","","- C7 H10 N6 O2 -","- C7 H10 N6 O2 -","- C56 H80 N48 O16 -","8","","","Smiglak, Marcin; Hines, C. Corey; Reichert, W. Matthew; Shamshina, Julia L.; Beasley, Preston A.; McCrary, Parker D.; Kelley, Steven P.; Rogers, Robin D.","Azolium azolates from reactions of neutral azoles with 1,3-dimethyl-imidazolium-2-carboxylate, 1,2,3-trimethyl-imidazolium hydrogen carbonate, and N,N-dimethyl-pyrrolidinium hydrogen carbonate","New Journal of Chemistry","2013","37","5","1461","","10.1039/c3nj00147d","","","0.71073","MoKα","","0.0483","0.0406","","","0.1035","0.1085","","","","","","1.082","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053136","12.0028","0.0004","13.0095","0.0005","20.3429","0.0007","90","","99.216","0.001","90","","3135.55","0.19","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H17 Fe N2 O2.5 -","- C18 H17 Fe N2 O2.5 -","- C144 H136 Fe8 N16 O20 -","8","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.0374","0.0285","","","0.0778","0.0833","","","","","","1.042","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053137","13.2738","0.0004","8.4806","0.0002","14.0205","0.0004","90","","114.859","0.001","90","","1432.05","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Fe N2 O -","- C18 H14 Fe N2 O -","- C72 H56 Fe4 N8 O4 -","4","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.0284","0.025","","","0.0652","0.0679","","","","","","1.044","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053138","14.1216","0.0004","8.5142","0.0002","13.7245","0.0004","90","","115.626","0.001","90","","1487.84","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 Fe N2 S -","- C18 H14 Fe N2 S -","- C72 H56 Fe4 N8 S4 -","4","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.0238","0.0213","","","0.0557","0.0577","","","","","","1.046","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053139","10.3361","0.0003","7.9197","0.0002","17.1157","0.0005","90","","98.984","0.001","90","","1383.88","0.07","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H13 Fe N O2 -","- C18 H13 Fe N O2 -","- C72 H52 Fe4 N4 O8 -","4","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.0287","0.024","","","0.0602","0.0624","","","","","","1.102","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053140","7.3774","0.0003","9.9499","0.0004","10.566","0.0004","87.451","0.001","79.77","0.001","74.67","0.001","736.1","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H13 Fe N S2 -","- C18 H13 Fe N S2 -","- C36 H26 Fe2 N2 S4 -","2","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.0363","0.0294","","","0.0756","0.0797","","","","","","1.037","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053141","13.1577","0.0014","8.6907","0.0009","13.8343","0.0016","90","","114.783","0.003","90","","1436.3","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H13 Fe N O S -","- C18 H13 Fe N O S -","- C72 H52 Fe4 N4 O4 S4 -","4","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.056","0.0461","","","0.1182","0.1298","","","","","","1.075","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053142","16.2896","0.0004","12.4546","0.0003","16.4543","0.0004","90","","111.719","0.001","90","","3101.27","0.13","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H17 Fe N3 O2 -","- C18 H17 Fe N3 O2 -","- C144 H136 Fe8 N24 O16 -","8","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.0248","0.0224","","","0.0596","0.0612","","","","","","1.041","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053143","11.9743","0.0003","12.3974","0.0003","14.2253","0.0003","90","","92.713","0.001","90","","2109.38","0.09","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H25 Fe N5 O2 -","- C23 H25 Fe N5 O2 -","- C92 H100 Fe4 N20 O8 -","4","1","","Tauchman, Jiří; Hladíková, Kateřina; Uhlík, Filip; Císařová, Ivana; Štěpnička, Petr","Synthesis, molecular structure, electrochemistry and DFT study of a ferrocenyl-substituted 4-quinazolinone and related heterocycles","New Journal of Chemistry","2013","37","7","2019","","10.1039/c3nj00182b","","","0.71073","MoKα","","0.0374","0.0287","","","0.0728","0.0774","","","","","","1.026","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053144","7.0459","0.0002","11.048","0.003","15.4564","0.0004","90","","90","","90","","1203.2","0.3","120","2","120.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H8 N4 O4 -","- C13 H8 N4 O4 -","- C52 H32 N16 O16 -","4","1","","Alkorta, Ibon; Cossío, Fernando P.; Elguero, José; Fresno, Nieves; Hernandez-Folgado, Laura; García-Granda, Santiago; Menéndez-Taboada, Laura; Pérez-Fernández, Ruth; Reviriego, Felipe; Vázquez-Viñuela, Lucia","The reaction of NH-indazoles with 1-fluoro-2,4-dinitrobenzene: the unusual formation of benzotriazole-N-oxides","New Journal of Chemistry","2013","37","8","2384","","10.1039/c3nj00186e","","","1.5418","CuKα","","0.0383","0.0335","","","0.0768","0.0796","","","","","","1.073","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053145","7.073","0.0005","24.084","0.0016","14.3289","0.001","90","","100.633","0.007","90","","2399","0.3","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 N4 O4 -","- C13 H8 N4 O4 -","- C104 H64 N32 O32 -","8","2","","Alkorta, Ibon; Cossío, Fernando P.; Elguero, José; Fresno, Nieves; Hernandez-Folgado, Laura; García-Granda, Santiago; Menéndez-Taboada, Laura; Pérez-Fernández, Ruth; Reviriego, Felipe; Vázquez-Viñuela, Lucia","The reaction of NH-indazoles with 1-fluoro-2,4-dinitrobenzene: the unusual formation of benzotriazole-N-oxides","New Journal of Chemistry","2013","37","8","2384","","10.1039/c3nj00186e","","","1.5418","CuKα","","0.0822","0.0469","","","0.0934","0.1085","","","","","","0.984","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053146","7.2107","0.0006","24.0635","0.0017","14.4077","0.0011","90","","100.334","0.017","90","","2459.4","0.4","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 N4 O4 -","- C13 H8 N4 O4 -","- C104 H64 N32 O32 -","8","2","","Alkorta, Ibon; Cossío, Fernando P.; Elguero, José; Fresno, Nieves; Hernandez-Folgado, Laura; García-Granda, Santiago; Menéndez-Taboada, Laura; Pérez-Fernández, Ruth; Reviriego, Felipe; Vázquez-Viñuela, Lucia","The reaction of NH-indazoles with 1-fluoro-2,4-dinitrobenzene: the unusual formation of benzotriazole-N-oxides","New Journal of Chemistry","2013","37","8","2384","","10.1039/c3nj00186e","","","1.5418","CuKα","","0.1325","0.0599","","","0.1241","0.1709","","","","","","0.998","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053147","13.0325","0.0006","15.3958","0.0015","6.1563","0.0003","90","","99.558","0.005","90","","1218.09","0.15","293","0.2","293","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 N4 O4 -","- C13 H8 N4 O4 -","- C52 H32 N16 O16 -","4","1","","Alkorta, Ibon; Cossío, Fernando P.; Elguero, José; Fresno, Nieves; Hernandez-Folgado, Laura; García-Granda, Santiago; Menéndez-Taboada, Laura; Pérez-Fernández, Ruth; Reviriego, Felipe; Vázquez-Viñuela, Lucia","The reaction of NH-indazoles with 1-fluoro-2,4-dinitrobenzene: the unusual formation of benzotriazole-N-oxides","New Journal of Chemistry","2013","37","8","2384","","10.1039/c3nj00186e","","","1.5418","CuKα","","0.0676","0.0439","","","0.1028","0.1171","","","","","","1.048","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053148","10.3941","0.0005","19.4479","0.001","19.9677","0.0009","90","","91.96","0.004","90","","4034","0.3","119.9","0.6","119.9","0.6","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C74 H22 N3 -","- C74.012 H22 N3 -","- C296.048 H88 N12 -","4","1","","Konarev, Dmitri V.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Ishikawa, Manabu; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","Structure and magnetic properties of the ionic fullerene salt (TMP+)·(C60˙−)·C6H5CN containing layers of monomeric C60˙− radical anions","New Journal of Chemistry","2013","37","8","2521","","10.1039/c3nj00189j","","","0.7107","MoKα","","0.0587","0.0451","","","0.1077","0.1178","","","","","","1.033","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053149","22.8309","0.0009","19.3871","0.0007","28.4509","0.0009","90","","105.634","0.004","90","","12127.2","0.8","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C74 H22 N3 -","- C73.9999 H22 N3 -","- C887.999 H264 N36 -","12","3","","Konarev, Dmitri V.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Ishikawa, Manabu; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","Structure and magnetic properties of the ionic fullerene salt (TMP+)·(C60˙−)·C6H5CN containing layers of monomeric C60˙− radical anions","New Journal of Chemistry","2013","37","8","2521","","10.1039/c3nj00189j","","","0.7107","MoKα","","0.0841","0.0587","","","0.1626","0.1767","","","","","","1.072","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053150","15.0911","0.0014","16.7006","0.0016","24.236","0.002","90","","90","","90","","6108.2","1","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H62 Co6 N8 O31 -","- C30 H24 Co6 N4 O22 -","- C120 H96 Co24 N16 O88 -","4","1","","Li, Zongze; Du, Lin; Zhou, Jie; Li, Lin; Hu, Yan; Qiao, Yongfeng; Xie, Mingjin; Zhao, Qihua","A chiral porous cobalt‒organic framework based on reinforced sinusoidal-like SBUs involving in situ-generated formate","New Journal of Chemistry","2013","37","8","2473","","10.1039/c3nj00236e","","","0.71073","MoKα","","0.0763","0.0481","","","0.0721","0.078","","","","","","0.933","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053151","6.307","0.001","12.611","0.002","10.4919","0.0017","90","","91.227","0.002","90","","834.3","0.2","298","2","298","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C15 H15 Co N3 O5 -","- C15 H15 Co N3 O5 -","- C30 H30 Co2 N6 O10 -","2","1","","Li, Zongze; Du, Lin; Zhou, Jie; Li, Lin; Hu, Yan; Qiao, Yongfeng; Xie, Mingjin; Zhao, Qihua","A chiral porous cobalt‒organic framework based on reinforced sinusoidal-like SBUs involving in situ-generated formate","New Journal of Chemistry","2013","37","8","2473","","10.1039/c3nj00236e","","","0.71073","MoKα","","0.0601","0.0514","","","0.1363","0.1419","","","","","","1.013","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053152","11.7071","0.0002","15.649","0.0003","15.7529","0.0011","90","","99.715","0.007","90","","2844.6","0.2","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H31 Cl N2 Ni O2 -","- C34 H31 Cl N2 Ni O2 -","- C136 H124 Cl4 N8 Ni4 O8 -","4","1","","Luca, Oana R.; Huang, Daria L.; Takase, Michael K.; Crabtree, Robert H.","Redox-active cyclopentadienyl Ni complexes with quinoid N-heterocyclic carbene ligands for the electrocatalytic hydrogen release from chemical fuels","New Journal of Chemistry","2013","37","11","3402","","10.1039/c3nj00276d","","","1.54187","CuKα","","0.0732","0.0603","","","0.1592","0.1732","","","","","","1.136","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053153","8.0943","0.0004","8.7229","0.0004","10.6687","0.0005","99.129","0.003","90.439","0.003","114.943","0.002","672.02","0.06","296","2","296","2","","","","","","","","2","P -1","-P 1","2","4,4'-dipyrenyl-biphenyl ?","","","- C44 H26 -","- C44 H26 -","- C44 H26 -","1","0.5","","Kwon, Jongchul; Hong, Jung-Pyo; Lee, Seonghoon; Hong, Jong-In","4,4′-Di(pyren-1-yl)-1,1′-biphenyl as an efficient material for organic light-emitting diodes and thin-film transistors","New Journal of Chemistry","2013","37","9","2881","","10.1039/c3nj00295k","","","0.71073","MoKα","","0.0849","0.0753","","","0.1927","0.2041","","","","","","1.014","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053154","7.7658","0.0002","10.8456","0.0003","27.334","0.0008","90","","93.128","0.001","90","","2298.77","0.11","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 Cl F6 N3 P Rh S -","- C20 H22 Cl F6 N3 P Rh S -","- C80 H88 Cl4 F24 N12 P4 Rh4 S4 -","4","1","","Gupta, Gajendra; Sharma, Gunjan; Koch, Biplob; Park, Sunhong; Lee, Shim Sung; Kim, Jinkwon","Syntheses, characterization and molecular structures of novel Ru(ii), Rh(iii) and Ir(iii) complexes and their possible roles as antitumour and cytotoxic agents","New Journal of Chemistry","2013","37","8","2573","","10.1039/c3nj00315a","","","0.71073","MoKα","","0.0348","0.0307","","","0.0806","0.083","","","","","","1.056","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053155","8.879","0.0003","12.4284","0.0004","12.9718","0.0004","86.465","0.002","79.783","0.002","88.566","0.002","1405.94","0.08","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C23 H27 Cl3 F6 N5 O0 P Rh -","- C23 H27 Cl3 F6 N5 P Rh -","- C46 H54 Cl6 F12 N10 P2 Rh2 -","2","1","","Gupta, Gajendra; Sharma, Gunjan; Koch, Biplob; Park, Sunhong; Lee, Shim Sung; Kim, Jinkwon","Syntheses, characterization and molecular structures of novel Ru(ii), Rh(iii) and Ir(iii) complexes and their possible roles as antitumour and cytotoxic agents","New Journal of Chemistry","2013","37","8","2573","","10.1039/c3nj00315a","","","0.71073","MoKα","","0.0514","0.0474","","","0.1376","0.1423","","","","","","1.083","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053156","8.3861","0.0004","18.9328","0.0009","11.7032","0.0006","90","","95.681","0.002","90","","1849.02","0.16","172","2","172","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 Cl F6 N3 P Ru S -","- C16 H13 Cl F6 N3 P Ru S -","- C64 H52 Cl4 F24 N12 P4 Ru4 S4 -","4","1","","Gupta, Gajendra; Sharma, Gunjan; Koch, Biplob; Park, Sunhong; Lee, Shim Sung; Kim, Jinkwon","Syntheses, characterization and molecular structures of novel Ru(ii), Rh(iii) and Ir(iii) complexes and their possible roles as antitumour and cytotoxic agents","New Journal of Chemistry","2013","37","8","2573","","10.1039/c3nj00315a","","","0.71073","MoKα","","0.0386","0.0326","","","0.0752","0.0786","","","","","","1.044","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053157","7.668","0.005","8.251","0.005","8.861","0.005","111.221","0.007","93.978","0.008","108.043","0.007","486.4","0.5","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H16 Cu2 N8 S4 -","- C14 H16 Cu2 N8 S4 -","- C14 H16 Cu2 N8 S4 -","1","0.5","","Gil-García, Rubén; Fraile, Roberto; Donnadieu, Bruno; Madariaga, Gotzon; Januskaitis, Vaidas; Rovira, Jordi; González, Lucía; Borrás, Joaquín; Arnáiz, Francisco Javier; García-Tojal, Javier","Desulfurization processes of thiosemicarbazonecopper(ii) derivatives in acidic and basic aqueous media","New Journal of Chemistry","2013","37","11","3568","","10.1039/c3nj00321c","","","0.71073","MoKα","","0.0818","0.0554","","","","0.1347","","","","","","1.039","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053158","10.968","0.004","16.018","0.006","9.462","0.003","90","","110.91","0.03","90","","1552.9","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Cl2 Cu3 N10 O4 S2 -","- C26 H22 Cl2 Cu3 N10 O4 S2 -","- C52 H44 Cl4 Cu6 N20 O8 S4 -","2","0.5","","Gil-García, Rubén; Fraile, Roberto; Donnadieu, Bruno; Madariaga, Gotzon; Januskaitis, Vaidas; Rovira, Jordi; González, Lucía; Borrás, Joaquín; Arnáiz, Francisco Javier; García-Tojal, Javier","Desulfurization processes of thiosemicarbazonecopper(ii) derivatives in acidic and basic aqueous media","New Journal of Chemistry","2013","37","11","3568","","10.1039/c3nj00321c","","","0.71073","MoKα","","0.2246","0.0463","","","","0.1087","","","","","","0.669","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053159","11.663","0.003","28.967","0.009","11.259","0.004","90","","109.92","0.02","90","","3576","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H17 Cu N5 O5 S -","- C13 H17 Cu N5 O5 S -","- C104 H136 Cu8 N40 O40 S8 -","8","1","","Gil-García, Rubén; Fraile, Roberto; Donnadieu, Bruno; Madariaga, Gotzon; Januskaitis, Vaidas; Rovira, Jordi; González, Lucía; Borrás, Joaquín; Arnáiz, Francisco Javier; García-Tojal, Javier","Desulfurization processes of thiosemicarbazonecopper(ii) derivatives in acidic and basic aqueous media","New Journal of Chemistry","2013","37","11","3568","","10.1039/c3nj00321c","","","0.71069","MoKα","","0.3381","0.0589","","","","0.1494","","","","","","0.572","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053160","10.133","0.009","20.184","0.007","13.385","0.006","90","","105.16","0.08","90","","2642","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 Cu N6 O3 S2 -","- C8 H8 Cu N6 O3 S2 -","- C64 H64 Cu8 N48 O24 S16 -","8","2","","Gil-García, Rubén; Fraile, Roberto; Donnadieu, Bruno; Madariaga, Gotzon; Januskaitis, Vaidas; Rovira, Jordi; González, Lucía; Borrás, Joaquín; Arnáiz, Francisco Javier; García-Tojal, Javier","Desulfurization processes of thiosemicarbazonecopper(ii) derivatives in acidic and basic aqueous media","New Journal of Chemistry","2013","37","11","3568","","10.1039/c3nj00321c","","","0.71069","MoKα","","0.3127","0.0466","","","","0.1184","","","","","","0.581","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053161","10.164","0.002","20.143","0.008","13.375","0.004","90","","105.39","0.03","90","","2640.1","1.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15.72 H16 Cu2 N12 O6.83 S3.72 -","- C15.722 H16 Cu2 N12 O6.834 S3.722 -","- C62.888 H64 Cu8 N48 O27.336 S14.888 -","4","1","","Gil-García, Rubén; Fraile, Roberto; Donnadieu, Bruno; Madariaga, Gotzon; Januskaitis, Vaidas; Rovira, Jordi; González, Lucía; Borrás, Joaquín; Arnáiz, Francisco Javier; García-Tojal, Javier","Desulfurization processes of thiosemicarbazonecopper(ii) derivatives in acidic and basic aqueous media","New Journal of Chemistry","2013","37","11","3568","","10.1039/c3nj00321c","","","0.71069","MoKα","","0.123","0.0352","","","","0.0715","","","","","","0.745","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053162","6.0132","0.0013","14.588","0.004","22.279","0.005","90","","95.358","0.005","90","","1945.8","0.8","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H28 Fe N O3 -","- C21 H28 Fe N O3 -","- C84 H112 Fe4 N4 O12 -","4","1","","Nakatsuji, Shin'ichi; Fujiwara, Kazuya; Akutsu, Hiroki; Yamada, Jun-ichi; Satoh, Masaharu","Structures and properties of ferrocene derivatives with different kinds of nitroxide radicals","New Journal of Chemistry","2013","37","8","2468","","10.1039/c3nj00343d","","","0.71075","MoKα","","","0.0636","","","","0.1962","","","","","","1.08","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053163","10.761","0.0007","11.9388","0.0015","15.1774","0.0003","90","","105.66","0.0005","90","","1877.5","0.3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 Fe N O3 -","- C20 H26 Fe N O3 -","- C80 H104 Fe4 N4 O12 -","4","1","","Nakatsuji, Shin'ichi; Fujiwara, Kazuya; Akutsu, Hiroki; Yamada, Jun-ichi; Satoh, Masaharu","Structures and properties of ferrocene derivatives with different kinds of nitroxide radicals","New Journal of Chemistry","2013","37","8","2468","","10.1039/c3nj00343d","","","0.71069","MoKα","","","0.0639","","","","0.1715","","","","","","1.102","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053164","21.162","0.006","8.427","0.003","10.717","0.003","90","","91.718","0.007","90","","1910.3","1","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 Fe N O3 -","- C20 H24 Fe N O3 -","- C80 H96 Fe4 N4 O12 -","4","1","","Nakatsuji, Shin'ichi; Fujiwara, Kazuya; Akutsu, Hiroki; Yamada, Jun-ichi; Satoh, Masaharu","Structures and properties of ferrocene derivatives with different kinds of nitroxide radicals","New Journal of Chemistry","2013","37","8","2468","","10.1039/c3nj00343d","","","0.71075","MoKα","","","0.0548","","","","0.1857","","","","","","0.962","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053165","11.6","0.0002","16.6558","0.0003","35.0297","0.0007","90","","90","","90","","6768","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C54 H100 Cu3 N6 O23 -","- C54 H78 Cu3 N6 O23 -","- C216 H312 Cu12 N24 O92 -","4","1","","Tanaka, Koichi; Asakura, Azusa; Muraoka, Toshihide; Kalicki, Przemysław; Urbanczyk-Lipkowska, Zofia","Asymmetric direct aldol reactions catalyzed by chiral amine macrocycle‒metal(ii) complexes under solvent-free conditions","New Journal of Chemistry","2013","37","9","2851","","10.1039/c3nj00361b","","","0.7107","MoKα","","0.0632","0.0561","","","0.153","0.1607","","","","","","1.162","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053166","8.0751","0.0003","25.4734","0.0008","14.7742","0.0005","90","","111.606","0.003","90","","2825.53","0.18","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H31 Cl N4 O2 Ru -","- C31 H31 Cl N4 O2 Ru -","- C124 H124 Cl4 N16 O8 Ru4 -","4","1","","Garza-Ortiz, Ariadna; Uma Maheswari, Palanisamy; Siegler, Maxime; Spek, Anthony L.; Reedijk, Jan","A new family of Ru(ii) complexes with a tridentate pyridine Schiff-base ligand and bidentate co-ligands: synthesis, characterization, structure and in vitro cytotoxicity studies","New Journal of Chemistry","2013","37","11","3450","","10.1039/c3nj00415e","","","0.71073","MoKα","","0.0342","0.0229","","","0.0498","0.0539","","","","","","1.039","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053167","12.7069","0.0013","11.0731","0.0008","20.3584","0.0016","90","","101.572","0.005","90","","2806.3","0.4","200","","200","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H23 N Ru -","- C15 H23 N Ru -","- C120 H184 N8 Ru8 -","8","1","","Hirano, Masafumi; Inoue, Haruka; Okamoto, Takuya; Ueda, Takao; Komine, Nobuyuki; Komiya, Sanshiro; Wang, Xian-qi; Bennett, Martin A.","Cross-dimerisation between different cisoid- and transoid-1,3-dienes at a ruthenium(0) centre","New Journal of Chemistry","2013","37","11","3433","","10.1039/c3nj00429e","","","0.71075","MoKα","","","0.1056","","","","0.2931","","","","","","1.29","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053168","8.852","0.006","14.382","0.009","24.096","0.014","90","","90","","90","","3068","3","200","","200","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C18 H28 Ru -","- C18 H28 Ru -","- C144 H224 Ru8 -","8","1","","Hirano, Masafumi; Inoue, Haruka; Okamoto, Takuya; Ueda, Takao; Komine, Nobuyuki; Komiya, Sanshiro; Wang, Xian-qi; Bennett, Martin A.","Cross-dimerisation between different cisoid- and transoid-1,3-dienes at a ruthenium(0) centre","New Journal of Chemistry","2013","37","11","3433","","10.1039/c3nj00429e","","","0.71075","MoKa","","","0.0353","","","","0.0849","","","","","","1.066","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053169","5.6471","0.0007","20.606","0.004","9.0626","0.0013","90","","103.672","0.012","90","","1024.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H19 N O2 -","- C8 H19 N O2 -","- C32 H76 N4 O8 -","4","1","","McCrary, Parker D.; Beasley, Preston A.; Gurau, Gabriela; Narita, Asako; Barber, Patrick S.; Cojocaru, O. Andreea; Rogers, Robin D.","Drug specific, tuning of an ionic liquid's hydrophilic‒lipophilic balance to improve water solubility of poorly soluble active pharmaceutical ingredients","New Journal of Chemistry","2013","37","7","2196","","10.1039/c3nj00454f","","","0.71073","MoKα","","0.122","0.0552","","","0.1237","0.1483","","","","","","0.996","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053170","5.4838","0.0008","26.117","0.004","8.228","0.0012","90","","100.331","0.005","90","","1159.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H23 N O2 -","- C10 H23 N O2 -","- C40 H92 N4 O8 -","4","1","","McCrary, Parker D.; Beasley, Preston A.; Gurau, Gabriela; Narita, Asako; Barber, Patrick S.; Cojocaru, O. Andreea; Rogers, Robin D.","Drug specific, tuning of an ionic liquid's hydrophilic‒lipophilic balance to improve water solubility of poorly soluble active pharmaceutical ingredients","New Journal of Chemistry","2013","37","7","2196","","10.1039/c3nj00454f","","","0.71073","MoKα","","0.0614","0.0406","","","0.1108","0.1276","","","","","","1.014","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053171","13.2365","0.0013","19.4764","0.0019","17.2337","0.0015","90","","94.607","0.011","90","","4428.5","0.7","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H42 Cl3 F9 Ru2 S3 -","- C42 H42 Cl3 F9 Ru2 S3 -","- C168 H168 Cl12 F36 Ru8 S12 -","4","1","","Giannini, Federico; Paul, Lydia E. H.; Furrer, Julien; Therrien, Bruno; Süss-Fink, Georg","Highly cytotoxic diruthenium trithiolato complexes of the type [(η6-p-MeC6H4Pri)2Ru2(μ2-SR)3]+: synthesis, characterization, molecular structure and in vitro anticancer activity","New Journal of Chemistry","2013","37","11","3503","","10.1039/c3nj00476g","","","0.71073","MoKα","","0.0911","0.0472","","","0.1129","0.1255","","","","","","0.844","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053172","13.2082","0.0005","13.1769","0.0004","28.5766","0.0009","90","","92.029","0.003","90","","4970.4","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H39 Cl13 Ru2 S3 -","- C40 H39 Cl13 Ru2 S3 -","- C160 H156 Cl52 Ru8 S12 -","4","1","","Giannini, Federico; Paul, Lydia E. H.; Furrer, Julien; Therrien, Bruno; Süss-Fink, Georg","Highly cytotoxic diruthenium trithiolato complexes of the type [(η6-p-MeC6H4Pri)2Ru2(μ2-SR)3]+: synthesis, characterization, molecular structure and in vitro anticancer activity","New Journal of Chemistry","2013","37","11","3503","","10.1039/c3nj00476g","","","0.71073","MoKα","","0.1153","0.0699","","","0.0898","0.0991","","","","","","1.096","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053173","15.53","0.005","16.537","0.006","11.752","0.005","90","","123.003","0.001","90","","2531.1","1.6","180","","180","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H24 N12 O16 Zr -","- C12 H24 N12 O16 Zr -","- C48 H96 N48 O64 Zr4 -","4","0.5","","Mouchaham, Georges; Roques, Nans; Duhayon, Carine; Imaz, Inhar; Sutter, Jean-Pascal","Extended H-bond networks based on guanidinium H-donors and [Zr(A)4]4− H-acceptor units: modulation of the assemblage and guest accessible volume by chemical design (A = oxalate, dihydrobenzoquinonate, chloranilate)","New Journal of Chemistry","2013","37","11","3476","","10.1039/c3nj00520h","","","0.71073","MoKα","","0.0308","0.0255","","0.035","0.0286","0.0281","","","","","","1.0601","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053174","37.6265","0.0011","7.2895","0.0002","12.4055","0.0004","90","","90","","90","","3402.56","0.18","180","","180","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C20 H34 N12 O21 Zr -","- C20 H34 N12 O21 Zr -","- C80 H136 N48 O84 Zr4 -","4","1","","Mouchaham, Georges; Roques, Nans; Duhayon, Carine; Imaz, Inhar; Sutter, Jean-Pascal","Extended H-bond networks based on guanidinium H-donors and [Zr(A)4]4− H-acceptor units: modulation of the assemblage and guest accessible volume by chemical design (A = oxalate, dihydrobenzoquinonate, chloranilate)","New Journal of Chemistry","2013","37","11","3476","","10.1039/c3nj00520h","","","0.71073","MoKα","","0.0376","0.0296","","0.0346","0.0316","0.0309","","","","","","1.0823","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053175","10.6469","0.0003","10.67004","0.00017","17.8637","0.0003","84.199","0.0013","75.9687","0.0018","60.221","0.002","1708.38","0.07","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H41 N12 O16.5 Zr -","- C20 H40 N12 O16.5 Zr -","- C40 H80 N24 O33 Zr2 -","2","1","","Mouchaham, Georges; Roques, Nans; Duhayon, Carine; Imaz, Inhar; Sutter, Jean-Pascal","Extended H-bond networks based on guanidinium H-donors and [Zr(A)4]4− H-acceptor units: modulation of the assemblage and guest accessible volume by chemical design (A = oxalate, dihydrobenzoquinonate, chloranilate)","New Journal of Chemistry","2013","37","11","3476","","10.1039/c3nj00520h","","","0.71073","MoKα","","0.1183","0.1146","","0.119","0.1164","0.1159","","","","","","0.9494","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053176","22.437","0.008","24.63","0.007","14.141","0.008","90","","90","","90","","7815","6","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C28 H35 N12 O17.5 Zr -","- C28 H32 N12 O17.5 Zr -","- C224 H256 N96 O140 Zr8 -","8","1","","Mouchaham, Georges; Roques, Nans; Duhayon, Carine; Imaz, Inhar; Sutter, Jean-Pascal","Extended H-bond networks based on guanidinium H-donors and [Zr(A)4]4− H-acceptor units: modulation of the assemblage and guest accessible volume by chemical design (A = oxalate, dihydrobenzoquinonate, chloranilate)","New Journal of Chemistry","2013","37","11","3476","","10.1039/c3nj00520h","","","0.71073","MoKα","","0.1502","0.1099","","","0.3252","0.3678","","","","","","1.409","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053177","15.6524","0.0004","17.6491","0.0004","19.7828","0.0005","96.198","0.001","101.315","0.001","115.121","0.001","4738","0.2","180","","180","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H35.7 Cl8 N12 O21.85 Zr -","- C28 H24 Cl8 N12 O21.85 Zr -","- C112 H96 Cl32 N48 O87.4 Zr4 -","4","2","","Mouchaham, Georges; Roques, Nans; Duhayon, Carine; Imaz, Inhar; Sutter, Jean-Pascal","Extended H-bond networks based on guanidinium H-donors and [Zr(A)4]4− H-acceptor units: modulation of the assemblage and guest accessible volume by chemical design (A = oxalate, dihydrobenzoquinonate, chloranilate)","New Journal of Chemistry","2013","37","11","3476","","10.1039/c3nj00520h","","","0.71073","MoKα","","0.1148","0.0604","","0.1116","0.0606","0.0565","","","","","","1.0744","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053178","17.4105","0.0004","20.2998","0.0005","13.9896","0.0004","90","","111.033","0.003","90","","4614.9","0.2","180","","180","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H26 Cl8 N12 O17 Zr -","- C36 H26 Cl8 N12 O17 Zr -","- C144 H104 Cl32 N48 O68 Zr4 -","4","1","","Mouchaham, Georges; Roques, Nans; Duhayon, Carine; Imaz, Inhar; Sutter, Jean-Pascal","Extended H-bond networks based on guanidinium H-donors and [Zr(A)4]4− H-acceptor units: modulation of the assemblage and guest accessible volume by chemical design (A = oxalate, dihydrobenzoquinonate, chloranilate)","New Journal of Chemistry","2013","37","11","3476","","10.1039/c3nj00520h","","","0.71073","MoKα","","0.0534","0.0258","","0.0369","0.0273","0.0255","","","","","","1.1048","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053179","10.3719","0.0007","21.7887","0.0015","17.3292","0.0012","90","","90","","90","","3916.2","0.5","180","","180","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C30 H36 K2 N6 O20 Zr -","- C30 H32 K2 N6 O20 Zr -","- C120 H128 K8 N24 O80 Zr4 -","4","0.5","","Mouchaham, Georges; Roques, Nans; Duhayon, Carine; Imaz, Inhar; Sutter, Jean-Pascal","Extended H-bond networks based on guanidinium H-donors and [Zr(A)4]4− H-acceptor units: modulation of the assemblage and guest accessible volume by chemical design (A = oxalate, dihydrobenzoquinonate, chloranilate)","New Journal of Chemistry","2013","37","11","3476","","10.1039/c3nj00520h","","","0.71073","MoKα","","0.0732","0.0478","","0.0723","0.0544","0.053","","","","","","1.0525","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053180","8.7","0.0017","11.397","0.002","14.164","0.003","90","","92.5","0.03","90","","1403.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H3 N7 O10 -","- C9 H3 N7 O10 -","- C36 H12 N28 O40 -","4","1","","Hou, Kehui; Ma, Congming; Liu, Zuliang","Synthesis, single crystal structure and performance of N-substituted derivatives of dinitroimidazole","New Journal of Chemistry","2013","37","9","2837","","10.1039/c3nj00521f","","","0.71073","MoKα","","0.0766","0.0508","","","0.1398","0.1583","","","","","","1.004","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053181","9.083","0.0018","11.395","0.002","14.089","0.003","90","","99.23","0.03","90","","1439.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H5 N9 O10 -","- C9 H5 N9 O10 -","- C36 H20 N36 O40 -","4","1","","Hou, Kehui; Ma, Congming; Liu, Zuliang","Synthesis, single crystal structure and performance of N-substituted derivatives of dinitroimidazole","New Journal of Chemistry","2013","37","9","2837","","10.1039/c3nj00521f","","","0.71073","MoKα","","0.0871","0.0505","","","0.1081","0.1217","","","","","","1.001","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053182","8.237","0.0016","12.791","0.003","12.916","0.003","90","","90","","90","","1360.8","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H3 N7 O10 -","- C9 H3 N7 O10 -","- C36 H12 N28 O40 -","4","1","","Hou, Kehui; Ma, Congming; Liu, Zuliang","Synthesis, single crystal structure and performance of N-substituted derivatives of dinitroimidazole","New Journal of Chemistry","2013","37","9","2837","","10.1039/c3nj00521f","","","0.71073","MoKα","","0.0808","0.0608","","","0.1465","0.1594","","","","","","1.002","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053183","8.4941","0.0007","12.7651","0.001","13.3699","0.0012","90","","90","","90","","1449.7","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H4 N8 O10 -","- C9 H4 N8 O10 -","- C36 H16 N32 O40 -","4","1","","Hou, Kehui; Ma, Congming; Liu, Zuliang","Synthesis, single crystal structure and performance of N-substituted derivatives of dinitroimidazole","New Journal of Chemistry","2013","37","9","2837","","10.1039/c3nj00521f","","","0.71073","MoKα","","0.1468","0.078","","","0.1453","0.1809","","","","","","1.044","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053184","9.158","0.0018","12.318","0.003","12.862","0.003","90","","90","","90","","1450.9","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H5 N9 O10 -","- C9 H5 N9 O10 -","- C36 H20 N36 O40 -","4","1","","Hou, Kehui; Ma, Congming; Liu, Zuliang","Synthesis, single crystal structure and performance of N-substituted derivatives of dinitroimidazole","New Journal of Chemistry","2013","37","9","2837","","10.1039/c3nj00521f","","","0.71073","MoKα","","0.0823","0.0535","","","0.1381","0.1575","","","","","","1.003","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053185","17.2568","0.0006","29.2556","0.0013","15.1819","0.0005","90","","100.457","0.003","90","","7537.4","0.5","180","2","180","2","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","","","","- C74 H59 F18 N10 O2 P5 Ru2 -","- C74 H59 F18 N10 O2 P5 Ru2 -","- C296 H236 F72 N40 O8 P20 Ru8 -","4","0.5","","Sylvain, Rémy; Vendier, Laure; Bijani, Christian; Santoro, Antonio; Puntoriero, Fausto; Campagna, Sebastiano; Sutra, Pierre; Igau, Alain","Evidence of the unprecedented conversion of intermolecular proton to water bridging of two phosphoryl ruthenium complexes","New Journal of Chemistry","2013","37","11","3543","","10.1039/c3nj00522d","","x-ray","1.5418","CuKα","","0.0866","0.0681","","","0.19","0.2074","","","","","","1.051","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053186","28.4278","0.0006","28.4278","0.0006","17.0604","0.0004","90","","90","","90","","13787.2","0.5","100","2","100","2","","","","","","","synthesis as described","7","I 41 c d","I 4bw -2c","110","","","","- C37 H30 F6 N5 O1.5 P2 Ru -","- C37 H30 F6 N5 O1.5 P2 Ru -","- C592 H480 F96 N80 O24 P32 Ru16 -","16","1","","Sylvain, Rémy; Vendier, Laure; Bijani, Christian; Santoro, Antonio; Puntoriero, Fausto; Campagna, Sebastiano; Sutra, Pierre; Igau, Alain","Evidence of the unprecedented conversion of intermolecular proton to water bridging of two phosphoryl ruthenium complexes","New Journal of Chemistry","2013","37","11","3543","","10.1039/c3nj00522d","","","0.71073","MoKα","","0.0195","0.0163","","","0.0349","0.036","","","","","","1.056","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7053187","11.9672","0.0003","18.6128","0.0004","24.142","0.0005","90","","96.754","0.002","90","","5340.1","0.2","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H42 Mo12 N3 O40 P -","- C27 H42 Mo12 N3 O40 P -","- C108 H168 Mo48 N12 O160 P4 -","4","1","","Guérin, Béatrice; Fernandes, Daniel Mesquita; Daran, Jean-Claude; Agustin, Dominique; Poli, Rinaldo","Investigation of induction times, activity, selectivity, interface and mass transport in solvent-free epoxidation by H2O2 and TBHP: a study with organic salts of the [PMo12O40]3− anion","New Journal of Chemistry","2013","37","11","3466","","10.1039/c3nj00523b","","","0.71073","MoKα","","0.0362","0.0311","","","0.0653","0.0676","","","","","","1.156","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053188","13.161","0.002","13.007","0.002","23.346","0.004","90","","100.685","0.002","90","","3927.2","1.1","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 N16 O11 -","- C10 H10 N16 O11 -","- C80 H80 N128 O88 -","8","2","","Dong, Kai; Wang, Yuan; Gong, Xu-Bin; Zhang, Jing; Sun, Cheng-Hui; Pang, Si-Ping","Formyl azido substituted nitro hexaazaisowurtzitane ‒ synthesis, characterization and energetic properties","New Journal of Chemistry","2013","37","11","3685","","10.1039/c3nj00532a","","","0.71073","MoKα","","0.0826","0.0694","","","0.1514","0.1614","","","","","","1.001","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053189","16.2048","0.0005","12.3116","0.0004","19.4697","0.0006","90","","90","","90","","3884.3","0.2","180","2","180","2","","","","","","","synthesis as described","8","P b c a","-P 2ac 2ab","61","","","","- C15 H11 Cl2 F6 N4 O P Ru -","- C15 H11 Cl2 F6 N4 O P Ru -","- C120 H88 Cl16 F48 N32 O8 P8 Ru8 -","8","1","","Akl, Joëlle; Billot, Chelmia; Lacroix, Pascal G.; Sasaki, Isabelle; Mallet-Ladeira, Sonia; Malfant, Isabelle; Arcos-Ramos, Rafael; Romero, Margarita; Farfán, Norberto","Molecular materials for switchable nonlinear optics in the solid state, based on ruthenium-nitrosyl complexes","New Journal of Chemistry","2013","37","11","3518","","10.1039/c3nj00558e","","x-ray","0.71073","MoKα","","0.0438","0.0313","","","0.0727","0.0814","","","","","","1.064","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053190","25.538","0.0016","15.5011","0.0009","14.6239","0.0009","90","","90","","90","","5789.1","0.6","180","2","180","2","","","","","","","synthesis as described","8","P b c n","-P 2n 2ab","60","","","","- C25 H24 Cl2 F6 N5 O2 P Ru -","- C25 H24 Cl2 F6 N5 O2 P Ru -","- C200 H192 Cl16 F48 N40 O16 P8 Ru8 -","8","1","","Akl, Joëlle; Billot, Chelmia; Lacroix, Pascal G.; Sasaki, Isabelle; Mallet-Ladeira, Sonia; Malfant, Isabelle; Arcos-Ramos, Rafael; Romero, Margarita; Farfán, Norberto","Molecular materials for switchable nonlinear optics in the solid state, based on ruthenium-nitrosyl complexes","New Journal of Chemistry","2013","37","11","3518","","10.1039/c3nj00558e","","x-ray","0.71073","MoKα","","0.1029","0.0562","","","0.142","0.1741","","","","","","1.038","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053191","6.5426","0.0004","10.6326","0.0006","12.1705","0.0007","77.018","0.002","74.588","0.002","87.095","0.002","795.3","0.08","173","2","173","2","","","","","","","","4","P 1","P 1","1","","","","- C40 H38 N4 O2 -","- C40 H38 N4 O2 -","- C40 H38 N4 O2 -","1","1","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.0624","0.0492","","","0.125","0.134","","","","","","1.038","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053192","6.5431","0.0004","10.6318","0.0006","12.1564","0.0007","76.976","0.003","74.585","0.003","86.92","0.003","794.25","0.08","173","2","173","2","","","","","","","","4","P 1","P 1","1","","","","- C40 H38 N4 O2 -","- C40 H38 N4 O2 -","- C40 H38 N4 O2 -","1","1","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.0806","0.057","","","0.1376","0.1524","","","","","","1.01","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053193","6.6076","0.0009","10.4384","0.0016","14.81","0.002","81.361","0.004","80.936","0.005","76.921","0.005","975.6","0.2","173","2","173","2","","","","","","","","4","P 1","P 1","1","","","","- C50 H44 N6 O2 -","- C50 H44 N6 O2 -","- C50 H44 N6 O2 -","1","1","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.1556","0.0666","","","0.1306","0.1755","","","","","","1.006","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053194","6.6001","0.0001","10.4252","0.0002","14.7935","0.0002","81.367","0.001","80.888","0.001","76.888","0.001","971.93","0.03","173","2","173","2","","","","","","","","4","P 1","P 1","1","","","","- C50 H44 N6 O2 -","- C50 H44 N6 O2 -","- C50 H44 N6 O2 -","1","1","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.053","0.0433","","","0.0972","0.103","","","","","","0.966","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053195","34.3268","0.001","14.1957","0.0003","21.8632","0.0005","90","","112.382","0.002","90","","9851.2","0.4","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C53 H55 N7 O6 Zn -","- C50 H42 N6 O2 Zn -","- C400 H336 N48 O16 Zn8 -","8","2","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.1356","0.0721","","","0.2011","0.2225","","","","","","1.047","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053196","10.7983","0.0011","19.3351","0.0019","13.5576","0.0013","90","","96.192","0.004","90","","2814.1","0.5","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C57 H45 Cl9 N6 O2 Zn -","- C57 H45 Cl9 N6 O2 Zn -","- C114 H90 Cl18 N12 O4 Zn2 -","2","1","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.1532","0.0951","","","0.263","0.308","","","","","","1.05","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053197","10.7272","0.0004","19.2135","0.0007","13.6582","0.0005","90","","95.605","0.002","90","","2801.59","0.18","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C56.5 H44.5 Cl7.5 N6 O2 Zn -","- C56.5 H44.5 Cl7.5 N6 O2 Zn -","- C113 H89 Cl15 N12 O4 Zn2 -","2","1","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.1317","0.0883","","","0.2441","0.2842","","","","","","1.068","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053198","10.9454","0.0003","17.1422","0.0006","11.7118","0.0004","90","","99.639","0.002","90","","2166.44","0.12","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C54 H42 N6 O2 Zn -","- C54 H42 N6 O2 Zn -","- C108 H84 N12 O4 Zn2 -","2","1","","Marets, N.; Bulach, V.; Hosseini, M. W.","Molecular tectonics: chiral 1- and 2-D zinc coordination networks based on chiral porphyrins bearing pyridyl and ethynylpyridyl appended units","New Journal of Chemistry","2013","37","11","3549","","10.1039/c3nj00591g","","","0.71073","MoKα","","0.0685","0.0472","","","0.1129","0.1236","","","","","","1.033","","","","has coordinates","180085","2020-10-21","18:00:00",""
"7053199","8.585","0.002","12.347","0.003","17.326","0.004","85.325","0.004","89.305","0.004","87.573","0.004","1828.7","0.7","300","2","300","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H44 Cu N6 O6 S2 -","- C32 H44 Cu N6 O6 S2 -","- C64 H88 Cu2 N12 O12 S4 -","2","1","","Saeed, Sohail; Rashid, Naghmana; Hussain, Rizwan; Malik, Muhammad Azad; O'Brien, Paul; Wong, Wing-Tak","Semiconducting nanostructured copper sulfide thin films from bidentate copper(ii) complexes of N-(dialkylcarbamothioyl)-nitrosubstituted benzamides by chemical vapour deposition","New Journal of Chemistry","2013","37","10","3214","","10.1039/c3nj00668a","","","0.71073","MoKα","","0.074","0.0486","","","0.108","0.1185","","","","","","1.054","","","","has coordinates,has disorder","180085","2020-10-21","18:00:00",""
"7053200","9.9473","0.0005","12.27","0.0008","21.0254","0.001","76.7","0.001","79.222","0.001","66.301","0.001","2273.9","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H49 Mo8 N7 O26 -","- C24 H49 Mo8 N7 O26 -","- C48 H98 Mo16 N14 O52 -","2","1","","Linguito, Stephen L.; Zhang, Xiao; Padmanabhan, Moothetty; Biradar, Ankush V.; Xu, Taotao; Emge, Thomas J.; Asefa, Tewodros; Li, Jing","New polyoxomolybdate compounds synthesized in situ using ionic liquid 1-butyl-3-methyl-imidazolium tetrafluoroborate as green solvent","New Journal of Chemistry","2013","37","9","2894","","10.1039/c3nj00669g","","","0.71073","MoKα","","0.0531","0.0372","","","0.0662","0.0711","","","","","","1.007","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053201","13.159","0.003","16.952","0.003","14.383","0.003","90","","91.45","0.03","90","","3207.4","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H60 Mo12 N8 O40 P -","- C32 H60 Mo12 N8 O40 P -","- C64 H120 Mo24 N16 O80 P2 -","2","0.5","","Linguito, Stephen L.; Zhang, Xiao; Padmanabhan, Moothetty; Biradar, Ankush V.; Xu, Taotao; Emge, Thomas J.; Asefa, Tewodros; Li, Jing","New polyoxomolybdate compounds synthesized in situ using ionic liquid 1-butyl-3-methyl-imidazolium tetrafluoroborate as green solvent","New Journal of Chemistry","2013","37","9","2894","","10.1039/c3nj00669g","","","0.71073","MoKα","","0.038","0.0292","","","0.0688","0.0724","","","","","","1.024","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053202","12.8716","0.0006","21.1033","0.0009","21.6102","0.001","96.282","0.001","105.243","0.001","100.756","0.001","5485.7","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H45 Mo12 N6 O40 P -","- C24 H45 Mo12 N6 O40 P -","- C96 H180 Mo48 N24 O160 P4 -","4","2","","Linguito, Stephen L.; Zhang, Xiao; Padmanabhan, Moothetty; Biradar, Ankush V.; Xu, Taotao; Emge, Thomas J.; Asefa, Tewodros; Li, Jing","New polyoxomolybdate compounds synthesized in situ using ionic liquid 1-butyl-3-methyl-imidazolium tetrafluoroborate as green solvent","New Journal of Chemistry","2013","37","9","2894","","10.1039/c3nj00669g","","","0.71073","MoKα","","0.0939","0.0573","","","0.1079","0.1208","","","","","","0.998","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053203","38.757","0.002","38.757","0.002","38.757","0.002","90","","90","","90","","58217","5","296","2","296","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","","","- C5.5 H3 Co0.58 N0 O2.67 -","- C5.5 H3 Co0.583333 O2.66667 -","- C1056 H576 Co112 O512 -","192","1","","Li, Liangjun; Tang, Sifu; Lv, Xiaoxia; Jiang, Min; Wang, Chao; Zhao, Xuebo","An rht type metal‒organic framework based on small cubicuboctahedron supermolecular building blocks and its gas adsorption properties","New Journal of Chemistry","2013","37","11","3662","","10.1039/c3nj00700f","","","0.71073","MoKα","","0.1425","0.0869","","","0.2597","0.2756","","","","","","1.505","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053204","9.4378","0.0019","13.969","0.003","17.639","0.004","91.92","0.004","103.279","0.003","99.284","0.003","2227.6","0.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H48 Ag2 F6 N16 O6 S2 -","- C36 H48 Ag2 F6 N16 O6 S2 -","- C72 H96 Ag4 F12 N32 O12 S4 -","2","1","","Pilar Carranza, M.; Manzano, Blanca R.; Jalón, Félix A.; Rodríguez, Ana M.; Santos, Lucía; Moreno, Miquel","Experimental and theoretical evidence of unsupported Ag‒Ag interactions in complexes with triazine-based ligands. Subtle effects of the symmetry of the triazine substituents","New Journal of Chemistry","2013","37","10","3183","","10.1039/c3nj00738c","","","0.71073","MoKα","","0.0492","0.032","","","0.0727","0.0778","","","","","","1.033","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053205","8.9492","0.0006","13.8345","0.0009","16.1715","0.0011","90","","101.784","0.001","90","","1960","0.2","160","2","160","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 Ag2 F6 N14 O8 S2 -","- C30 H34 Ag2 F6 N14 O8 S2 -","- C60 H68 Ag4 F12 N28 O16 S4 -","2","0.5","","Pilar Carranza, M.; Manzano, Blanca R.; Jalón, Félix A.; Rodríguez, Ana M.; Santos, Lucía; Moreno, Miquel","Experimental and theoretical evidence of unsupported Ag‒Ag interactions in complexes with triazine-based ligands. Subtle effects of the symmetry of the triazine substituents","New Journal of Chemistry","2013","37","10","3183","","10.1039/c3nj00738c","","","0.71073","MoKα","","0.0508","0.0331","","","0.0734","0.0817","","","","","","1.067","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053206","10.453","0.005","11.248","0.005","11.848","0.005","104.288","0.007","98.792","0.004","114.28","0.004","1178.4","0.9","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H60 Dy2 N4 O14 -","- C46 H60 Dy2 N4 O14 -","- C46 H60 Dy2 N4 O14 -","1","0.5","","Mei, Xuelan; Wang, Xiufeng; Wang, Juanjuan; Ma, Yue; Li, Licun; Liao, Daizheng","Dinuclear lanthanide complexes bridged by nitronyl nitroxide radical ligands with 2-phenolate groups: structure and magnetic properties","New Journal of Chemistry","2013","37","11","3620","","10.1039/c3nj00739a","","","0.71073","MoKα","","0.0422","0.0378","","","0.0638","0.0657","","","","","","1.062","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053207","10.509","0.004","11.349","0.005","11.813","0.004","103.788","0.004","98.622","0.004","114.832","0.003","1190.8","0.8","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H60 Eu2 N4 O14 -","- C46 H60 Eu2 N4 O14 -","- C46 H60 Eu2 N4 O14 -","1","0.5","","Mei, Xuelan; Wang, Xiufeng; Wang, Juanjuan; Ma, Yue; Li, Licun; Liao, Daizheng","Dinuclear lanthanide complexes bridged by nitronyl nitroxide radical ligands with 2-phenolate groups: structure and magnetic properties","New Journal of Chemistry","2013","37","11","3620","","10.1039/c3nj00739a","","","0.71073","MoKα","","0.0492","0.0402","","","0.0737","0.0769","","","","","","1.059","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053208","10.484","0.006","11.287","0.007","11.799","0.007","103.69","0.004","98.754","0.003","114.763","0.006","1180.8","1.2","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H60 Gd2 N4 O14 -","- C46 H60 Gd2 N4 O14 -","- C46 H60 Gd2 N4 O14 -","1","0.5","","Mei, Xuelan; Wang, Xiufeng; Wang, Juanjuan; Ma, Yue; Li, Licun; Liao, Daizheng","Dinuclear lanthanide complexes bridged by nitronyl nitroxide radical ligands with 2-phenolate groups: structure and magnetic properties","New Journal of Chemistry","2013","37","11","3620","","10.1039/c3nj00739a","","","0.71073","MoKα","","0.0471","0.041","","","0.0765","0.0794","","","","","","1.001","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053209","29.363","0.005","9.591","0.005","15.551","0.005","90","0.005","119.839","0.005","90","0.005","3799","2","293","2","293","2","","","","","","","Synthesized by the authors","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H28.71 Cl3.29 N4 O8 -","- C38 H28.704 Cl3.296 N4 O8 -","- C152 H114.816 Cl13.184 N16 O32 -","4","0.5","","Safaei, Shirin; Mohammadpoor-Baltork, Iraj; Khosropour, Ahmad Reza; Moghadam, Majid; Tangestaninejad, Shahram; Mirkhani, Valiollah","Copper(ii) ionic liquid catalyzed cyclization‒aromatization of hydrazones with dimethyl acetylenedicarboxylate: a green synthesis of fully substituted pyrazoles","New Journal of Chemistry","2013","37","7","2037","","10.1039/c3nj40756j","","","0.71069","MoKα","","0.2934","0.0578","","","0.1605","0.2158","","","","","","0.644","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053210","12.0842","0.0018","14.63","0.002","14.997","0.002","68.239","0.007","88.188","0.007","76.637","0.007","2391.4","0.6","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H46 F12 N7 O8 P2 Zn -","- C42 H42 F12 N7 O8 P2 Zn -","- C84 H84 F24 N14 O16 P4 Zn2 -","2","1","","Yadav, Yogesh J.; Mastropietro, Teresa F.; Szerb, Elisabeta Ildyko; Talarico, Anna Maria; Pirillo, Sante; Pucci, Daniela; Crispini, Alessandra; Ghedini, Mauro","2,2′-Bipyridine Zn(ii) complexes: effect of the 4,4′ substituents on the crystalline solid state properties","New Journal of Chemistry","2013","37","5","1486","","10.1039/c3nj40829a","","","0.71073","MoKα","","0.1177","0.0873","","","0.266","0.3031","","","","","","1.186","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053211","11.354","0.003","13.202","0.004","15.056","0.005","76.794","0.013","76.652","0.013","83.772","0.013","2134.1","1.1","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H36 F12 N6 O6 P2 Zn -","- C36 H36 F12 N6 O6 P2 Zn -","- C72 H72 F24 N12 O12 P4 Zn2 -","2","1","","Yadav, Yogesh J.; Mastropietro, Teresa F.; Szerb, Elisabeta Ildyko; Talarico, Anna Maria; Pirillo, Sante; Pucci, Daniela; Crispini, Alessandra; Ghedini, Mauro","2,2′-Bipyridine Zn(ii) complexes: effect of the 4,4′ substituents on the crystalline solid state properties","New Journal of Chemistry","2013","37","5","1486","","10.1039/c3nj40829a","","","0.71073","MoKα","","0.048","0.0439","","","0.1111","0.1142","","","","","","1.101","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053212","7.507","0.005","12.063","0.008","16.97","0.011","90","","96.79","0.02","90","","1526","1.7","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 N2 O2 -","- C12 H12 N2 O2 -","- C72 H72 N12 O12 -","6","1.5","","Yadav, Yogesh J.; Mastropietro, Teresa F.; Szerb, Elisabeta Ildyko; Talarico, Anna Maria; Pirillo, Sante; Pucci, Daniela; Crispini, Alessandra; Ghedini, Mauro","2,2′-Bipyridine Zn(ii) complexes: effect of the 4,4′ substituents on the crystalline solid state properties","New Journal of Chemistry","2013","37","5","1486","","10.1039/c3nj40829a","","","0.71073","MoKα","","0.0774","0.0485","","","0.1244","0.1437","","","","","","1.024","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053213","6.1134","0.0012","12.529","0.003","14.622","0.003","90","","92.51","0.03","90","","1118.9","0.4","113","2","113","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H20 S2 -","- C30 H20 S2 -","- C60 H40 S4 -","2","0.5","","Liu, Ying; Liu, Qida; Zhang, Xingye; Ai, Ling; Wang, Yang; Peng, Ruixiang; Ge, Ziyi","Synthesis, crystal structure, and polymerization of butterfly-shaped thieno[3,2-b]thiophene oligomers","New Journal of Chemistry","2013","37","4","1189","","10.1039/c3nj40909k","","","0.71073","MoKα","","0.0481","0.0444","","","0.1151","0.1179","","","","","","1.103","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053214","3.9007","0.0011","11.814","0.003","15.453","0.003","90","","94.644","0.014","90","","709.8","0.3","113","2","113","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H6 Br2 S4 -","- C14 H6 Br2 S4 -","- C28 H12 Br4 S8 -","2","0.5","","Liu, Ying; Liu, Qida; Zhang, Xingye; Ai, Ling; Wang, Yang; Peng, Ruixiang; Ge, Ziyi","Synthesis, crystal structure, and polymerization of butterfly-shaped thieno[3,2-b]thiophene oligomers","New Journal of Chemistry","2013","37","4","1189","","10.1039/c3nj40909k","","","0.7107","MoKα","","0.0974","0.0964","","","0.2658","0.2661","","","","","","1.154","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053215","6.1799","0.0012","7.6986","0.0015","21.307","0.004","90","","97.69","0.03","90","","1004.6","0.3","113","2","113","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H12 S6 -","- C22 H12 S6 -","- C44 H24 S12 -","2","0.5","","Liu, Ying; Liu, Qida; Zhang, Xingye; Ai, Ling; Wang, Yang; Peng, Ruixiang; Ge, Ziyi","Synthesis, crystal structure, and polymerization of butterfly-shaped thieno[3,2-b]thiophene oligomers","New Journal of Chemistry","2013","37","4","1189","","10.1039/c3nj40909k","","","0.71073","MoKα","","0.129","0.1182","","","0.3378","0.3455","","","","","","1.122","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053216","14.402","0.0002","8.9147","0.0001","18.3569","0.0012","90","","92.158","0.007","90","","2355.16","0.16","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(diethylamino)-6,6-diphenyl-6H-benzo[e]benzo[4,5]oxazolo[3,2-c] [1,3,2]oxazaborinin-7-ium-6-uide","","- C29 H27 B N2 O2 -","- C29 H27 B N2 O2 -","- C116 H108 B4 N8 O8 -","4","1","","Massue, Julien; Retailleau, Pascal; Ulrich, Gilles; Ziessel, Raymond","Synthesis of luminescent BPh2-coordinated 2-(2′-hydroxyphenyl)benzoxazole (HBO)","New Journal of Chemistry","2013","37","4","1224","","10.1039/c3nj41052h","","","1.54187","CuKα","","0.0735","0.053","","","0.1119","0.1296","","","","","","1.126","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053217","18.9987","0.0003","14.3343","0.0003","25.2809","0.0017","90","","90","","90","","6884.8","0.5","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-((4-(dibutylamino)phenyl)ethynyl)-6,6-diphenyl-6H-benzo[e]benzo[4,5] oxazolo[3,2-c][1,3,2]oxazaborinin-7-ium-6-uide","","- C41 H39 B N2 O2 -","- C41 H39 B N2 O2 -","- C328 H312 B8 N16 O16 -","8","1","","Massue, Julien; Retailleau, Pascal; Ulrich, Gilles; Ziessel, Raymond","Synthesis of luminescent BPh2-coordinated 2-(2′-hydroxyphenyl)benzoxazole (HBO)","New Journal of Chemistry","2013","37","4","1224","","10.1039/c3nj41052h","","","1.54187","CuKα","","0.098","0.0612","","","0.1641","0.2191","","","","","","1.165","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053218","26.495","0.0019","9.2581","0.0007","16.7981","0.0012","90","","94","0.004","90","","4110.4","0.5","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H54 Fe2 N6 O10 P2 S2 -","- C31 H54 Fe2 N6 O10 P2 S2 -","- C124 H216 Fe8 N24 O40 P8 S8 -","4","1","","Gao, Shang; Guo, Hongling; Peng, Xiaojun; Zhao, Xing; Duan, Qian; Liang, Qingcheng; Jiang, Dayong","The employment of a hydrophilic tris(morpholino)phosphine ligand in diiron propane-1,3-dithiolate complexes for potentially water-soluble iron-only hydrogenase active-site mimics","New Journal of Chemistry","2013","37","5","1437","","10.1039/c3nj41058g","","","0.71073","MoKα","","0.0888","0.059","","","0.1394","0.156","","","","","","1.035","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053219","12.4884","0.0007","5.0947","0.0003","17.4942","0.001","90","","99.941","0.001","90","","1096.35","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(1H-tetrazol-1-yl)acetic acid","","- C3 H4 N4 O2 -","- C3 H4 N4 O2 -","- C24 H32 N32 O16 -","8","2","","Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee","Energetic salts based on 1-methoxy-5-nitroiminotetrazole","New Journal of Chemistry","2013","37","4","1180","","10.1039/c3nj41117f","","","0.71073","MoKα","","0.0416","0.0332","","","0.0835","0.0891","","","","","","1.032","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053220","7.592","0.0004","13.7908","0.0008","15.7389","0.0009","114.474","0.002","100.409","0.001","90.831","0.005","1467.75","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","guanidinium 1-methoxy-5-nitroiminotetrazolate","guanidinium 1-methoxy-5-nitroiminotetrazolate","","- C3 H9.66667 N9 O3.33333 -","- C3 H9.66667 N9 O3.33333 -","- C18 H58 N54 O20 -","6","3","","Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee","Energetic salts based on 1-methoxy-5-nitroiminotetrazole","New Journal of Chemistry","2013","37","4","1180","","10.1039/c3nj41117f","","","0.71073","MoKα","","0.0598","0.0413","","","0.1192","0.1287","","","","","","1.077","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053221","17.1247","0.0006","9.7122","0.0003","13.4618","0.0008","90","","119.073","0.002","90","","1956.84","0.15","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","aminoguanidinium 1-methoxy-5-nitroiminotetrazolate","aminoguanidinium 1-methoxy-5-nitroiminotetrazolate","","- C3 H10 N10 O3 -","- C3 H10 N10 O3 -","- C24 H80 N80 O24 -","8","1","","Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee","Energetic salts based on 1-methoxy-5-nitroiminotetrazole","New Journal of Chemistry","2013","37","4","1180","","10.1039/c3nj41117f","","","0.71073","MoKα","","0.0859","0.0411","","","0.1044","0.1241","","","","","","0.985","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053222","6.5764","0.0012","9.2377","0.0017","9.8647","0.0018","105.849","0.004","100.993","0.004","103.37","0.004","539.86","0.17","296","2","296","2","","","","","","","","4","P -1","-P 1","2","diaminoguanidinium 1-methoxy-5-nitroiminotetrazolate","diaminoguanidinium 1-methoxy-5-nitroiminotetrazolate","","- C3 H11 N11 O3 -","- C3 H11 N11 O3 -","- C6 H22 N22 O6 -","2","1","","Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee","Energetic salts based on 1-methoxy-5-nitroiminotetrazole","New Journal of Chemistry","2013","37","4","1180","","10.1039/c3nj41117f","","","0.71073","MoKα","","0.053","0.0494","","","0.156","0.16","","","","","","1.068","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053223","6.9336","0.0001","7.9708","0.0001","10.6766","0.0002","103.98","0.001","97.668","0.003","100.985","0.001","552.023","0.016","296","2","296","2","","","","","","","","4","P -1","-P 1","2","triaminoguanidinium 1-methoxy-5-nitroiminotetrazolate","triaminoguanidinium 1-methoxy-5-nitroiminotetrazolate","","- C3 H12 N12 O3 -","- C3 H12 N12 O3 -","- C6 H24 N24 O6 -","2","1","","Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee","Energetic salts based on 1-methoxy-5-nitroiminotetrazole","New Journal of Chemistry","2013","37","4","1180","","10.1039/c3nj41117f","","","0.71073","MoKα","","0.0408","0.0333","","","0.0988","0.1032","","","","","","1.115","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053224","7.3715","0.0001","7.4426","0.0001","15.3365","0.0003","101.616","0.003","97.451","0.001","94.214","0.005","812.91","0.03","296","2","296","2","","","","","","","","4","P -1","-P 1","2","carbohydrazidinium 1-methoxy-5-nitroiminotetrazolate","carbohydrazidinium 1-methoxy-5-nitroiminotetrazolate","","- C5 H14 N16 O7 -","- C5 H14 N16 O7 -","- C10 H28 N32 O14 -","2","1","","Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee","Energetic salts based on 1-methoxy-5-nitroiminotetrazole","New Journal of Chemistry","2013","37","4","1180","","10.1039/c3nj41117f","","","0.71073","MoKα","","0.0575","0.0374","","","0.0954","0.1032","","","","","","0.964","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053225","3.8294","0.0003","27.714","0.002","9.5787","0.0008","90","","97.796","0.001","90","","1007.17","0.14","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3-amino-1,2,4-triazolium 1-methoxy-5-nitroiminotetrazolate","3-amino-1,2,4-triazolium 1-methoxy-5-nitroiminotetrazolate","","- C4 H8 N10 O3 -","- C4 H8 N10 O3 -","- C16 H32 N40 O12 -","4","1","","Joo, Young-Hyuk; Chung, Jin Hyuk; Cho, Soo Gyeong; Goh, Eun Mee","Energetic salts based on 1-methoxy-5-nitroiminotetrazole","New Journal of Chemistry","2013","37","4","1180","","10.1039/c3nj41117f","","","0.71073","MoKα","","0.0674","0.0364","","","0.0765","0.085","","","","","","0.861","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053226","11.956","0.002","16.995","0.004","15.106","0.003","90","","100.308","0.014","90","","3019.9","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H48 F12 Fe2 O5 P2 -","- C56 H42 F12 Fe2 O5 P2 -","- C112 H84 F24 Fe4 O10 P4 -","2","0.5","","Ba, Fatou; Cabon, Nolwenn; Le Poul, Pascal; Kahlal, Samia; Saillard, Jean-Yves; Le Poul, Nicolas; Golhen, Stéphane; Caro, Bertrand; Robin-Le Guen, Françoise","Diferrocenylpyrylium salts and electron rich bispyran from oxidative coupling of ferrocenylpyran. Example of redox systems switched by proton transfer","New Journal of Chemistry","2013","37","7","2066","","10.1039/c3nj41126e","","","0.71073","MoKα","","0.238","0.1191","","","0.3143","0.3952","","","","","","1.092","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053227","14.5334","0.0006","14.2796","0.0005","15.2101","0.0005","90","","92.956","0.003","90","","3152.4","0.2","100","2","100","2","","","","","","","","6","P 1 2/a 1","-P 2ya","13","","","","- C25 H57 F6 P2 Pd Sb -","- C25 H57 F6 P2 Pd Sb -","- C100 H228 F24 P8 Pd4 Sb4 -","4","1","","Walter, Marc D.; White, Peter S.; Brookhart, Maurice","Synthesis, structure and computational studies of a cationic T-shaped Pd-complex","New Journal of Chemistry","2013","37","4","1128","","10.1039/c3nj41145a","","","1.54185","CuKα","","0.0807","0.0564","","","0.1785","0.1953","","","","","","1.079","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053228","19.352","0.004","13.626","0.003","11.721","0.002","90","","107.01","0.03","90","","2955.5","1.1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H25 N3 O4 Zn -","- C35 H25 N3 O4 Zn -","- C140 H100 N12 O16 Zn4 -","4","0.5","","Ma, Zhen; Lu, Wanbing; Liang, Baohuan; Pombeiro, Armando J. L.","Synthesis, characterization, photoluminescent and thermal properties of zinc(ii) 4′-phenyl-terpyridine compounds","New Journal of Chemistry","2013","37","5","1529","","10.1039/c3nj41176a","","","0.71073","MoKα","","0.0479","0.0362","","","0.0953","0.1026","","","","","","1","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053229","20.389","0.004","13.924","0.003","12.196","0.002","90","","113.21","0.03","90","","3182.2","1.3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H29 N3 O6 S2 Zn -","- C35 H29 N3 O6 S2 Zn -","- C140 H116 N12 O24 S8 Zn4 -","4","0.5","","Ma, Zhen; Lu, Wanbing; Liang, Baohuan; Pombeiro, Armando J. L.","Synthesis, characterization, photoluminescent and thermal properties of zinc(ii) 4′-phenyl-terpyridine compounds","New Journal of Chemistry","2013","37","5","1529","","10.1039/c3nj41176a","","","0.71073","MoKα","","0.0518","0.0372","","","0.1126","0.1227","","","","","","1.029","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053230","11.0686","0.0007","22.0148","0.0013","12.9592","0.0009","90","","117.908","0.004","90","","2790.6","0.3","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H17 F6 N3 O7 S2 Zn -","- C23 H17 F6 N3 O7 S2 Zn -","- C92 H68 F24 N12 O28 S8 Zn4 -","4","1","","Ma, Zhen; Lu, Wanbing; Liang, Baohuan; Pombeiro, Armando J. L.","Synthesis, characterization, photoluminescent and thermal properties of zinc(ii) 4′-phenyl-terpyridine compounds","New Journal of Chemistry","2013","37","5","1529","","10.1039/c3nj41176a","","","0.71073","MoKα","","0.048","0.0371","","","0.0945","0.1046","","","","","","1.005","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053231","13.007","0.003","9.863","0.002","26.388","0.008","90","","110.93","0.03","90","","3161.9","1.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H29 N3 O7 Zn -","- C36 H29 N3 O7 Zn -","- C144 H116 N12 O28 Zn4 -","4","1","","Ma, Zhen; Lu, Wanbing; Liang, Baohuan; Pombeiro, Armando J. L.","Synthesis, characterization, photoluminescent and thermal properties of zinc(ii) 4′-phenyl-terpyridine compounds","New Journal of Chemistry","2013","37","5","1529","","10.1039/c3nj41176a","","","0.71073","MoKα","","0.0624","0.0408","","","0.1048","0.1224","","","","","","1.036","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053232","13.998","0.002","14.822","0.002","15.489","0.002","106.615","0.007","103.451","0.007","91.595","0.007","2979.6","0.7","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H25 N3 O6 Zn -","- C35 H25 N3 O6 Zn -","- C140 H100 N12 O24 Zn4 -","4","2","","Ma, Zhen; Lu, Wanbing; Liang, Baohuan; Pombeiro, Armando J. L.","Synthesis, characterization, photoluminescent and thermal properties of zinc(ii) 4′-phenyl-terpyridine compounds","New Journal of Chemistry","2013","37","5","1529","","10.1039/c3nj41176a","","","0.71073","MoKα","","0.0759","0.0476","","","0.1144","0.1328","","","","","","1.014","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053233","16.503","0.003","17.021","0.003","10.663","0.002","90","","99.67","0.03","90","","2952.7","1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H25 N3 O6 Zn -","- C35 H25 N3 O6 Zn -","- C140 H100 N12 O24 Zn4 -","4","0.5","","Ma, Zhen; Lu, Wanbing; Liang, Baohuan; Pombeiro, Armando J. L.","Synthesis, characterization, photoluminescent and thermal properties of zinc(ii) 4′-phenyl-terpyridine compounds","New Journal of Chemistry","2013","37","5","1529","","10.1039/c3nj41176a","","","0.71073","MoKα","","0.038","0.0305","","","0.0883","0.0943","","","","","","1.024","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053234","11.543","0.002","11.5238","0.0017","15.689","0.003","90","","100.072","0.004","90","","2054.8","0.6","100","","100","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C45 H69 Br N2 S -","- C45 H69 Br N2 S -","- C90 H138 Br2 N4 S2 -","2","1","","Foreiter, Magdalena B.; Gunaratne, H. Q. Nimal; Nockemann, Peter; Seddon, Kenneth R.; Stevenson, Paul J.; Wassell, David F.","Chiral thiouronium salts: synthesis, characterisation and application in NMR enantio-discrimination of chiral oxoanions","New Journal of Chemistry","2013","37","2","515","","10.1039/c2nj40632b","","","0.71075","Molybdenum","","0.0829","0.0535","","","0.063","0.0759","","","","","","0.87","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053235","7.525","0.0004","7.8787","0.0006","14.2239","0.0012","99.852","0.007","100.646","0.006","104.192","0.006","782.49","0.11","173","2","173","2","","","","","","","","7","P -1","-P 1","2","(2-imino-4-phenyl-1,3-thiazol-3-(2H)-yl)methyl phosphinate","(2-imino-4-phenyl-1,3-thiazol-3-(2H)-yl)methyl phosphinate","","- C11 H12 Cl3 N2 O2 P S -","- C11 H12 Cl3 N2 O2 P S -","- C22 H24 Cl6 N4 O4 P2 S2 -","2","1","","Betzl, Wolfgang; Hettstedt, Christina; Karaghiosoff, Konstantin","New anellated 4H-1,4,2-diazaphospholes","New Journal of Chemistry","2013","37","2","481","","10.1039/c2nj40709d","","","0.71069","MoKα","","0.0937","0.0563","","","0.1118","0.1237","","","","","","1.024","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053236","10.6264","0.0006","14.7725","0.0007","14.6357","0.001","90","","104.793","0.007","90","","2221.3","0.2","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H40 Li N3 Zn -","- C18.97 H40 Li N2.992 Zn -","- C75.88 H160 Li4 N11.968 Zn4 -","4","1","","Saßmannshausen, Jörg; Klett, Jan; Kennedy, Alan R.; Parkinson, John A.; Armstrong, David","Taming the shrew: [TMEDALi-Zn(C2H4)2L] as a model compound for anionic ethene polymerisation","New Journal of Chemistry","2013","37","2","494","","10.1039/c2nj40874k","","","1.5418","CuKα","","0.0664","0.0594","","","0.1503","0.1562","","","","","","1.054","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053237","10.3386","0.0006","10.3386","0.0006","37.798","0.002","90","","90","","90","","4040.1","0.4","123","2","123","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C17 H36 Li N3 Zn -","- C17 H36 Li N3 Zn -","- C136 H288 Li8 N24 Zn8 -","8","1","","Saßmannshausen, Jörg; Klett, Jan; Kennedy, Alan R.; Parkinson, John A.; Armstrong, David","Taming the shrew: [TMEDALi-Zn(C2H4)2L] as a model compound for anionic ethene polymerisation","New Journal of Chemistry","2013","37","2","494","","10.1039/c2nj40874k","","","0.71073","MoKα","","0.0706","0.0442","","","0.0837","0.0867","","","","","","0.961","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053238","8.077","0.001","9.435","0.001","12.681","0.002","70.06","0.01","80.19","0.01","67.97","0.01","841.1","0.2","200","2","200","2","","","","","","","","5","P -1","-P 1","2","octaaquadysprosium 5,5'-azobis[tetrazolide]","","","- C6 H32 Dy2 N30 O16 -","- C6 H32 Dy2 N30 O16 -","- C6 H32 Dy2 N30 O16 -","1","0.5","","Knoll, Christian; Müller, Danny; Giester, Gerald; Ofner, Johannes; Lendl, Bernhard; Weinberger, Peter; Steinhauser, Georg","An unusually water-poor 5,5′-azobistetrazolate of dysprosium: stabilization of a nitrogen-rich heterocycle by a minimum of hydrogen bonds","New Journal of Chemistry","2013","37","12","3840","","10.1039/c3nj00492a","","","0.71073","MoKα","","0.025","0.0195","","","0.0416","0.0431","","","","","","1.041","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053239","30.805","0.007","30.805","0.007","14.937","0.003","90","","90","","90","","14174","5","110","","110","","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C39.07 H42.07 Cl0.22 N4 -","- C39.0731 H42.0731 Cl0.2193 N4 -","- C625.17 H673.17 Cl3.5088 N64 -","16","1","","Deans, Richard M.; Mass, Olga; Diers, James R.; Bocian, David F.; Lindsey, Jonathan S.","Serendipitous synthetic entrée to tetradehydro analogues of cobalamins","New Journal of Chemistry","2013","37","12","3964","","10.1039/c3nj00574g","","","0.71073","MoKα","","0.0963","0.053","","","0.1321","0.1543","","","","","","1.034","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053240","7.6351","0.0012","8.811","0.0008","16.5849","0.0019","77.5","0.009","86.211","0.01","76.035","0.01","1057","0.2","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C23 H31 N3 O3 -","- C23 H31 N3 O3 -","- C46 H62 N6 O6 -","2","1","","Klikar, Milan; Bureš, Filip; Pytela, Oldřich; Mikysek, Tomáš; Padělková, Zdeňka; Barsella, Alberto; Dorkenoo, Kokou; Achelle, Sylvain","N,N′-Dibutylbarbituric acid as an acceptor moiety in push‒pull chromophores","New Journal of Chemistry","2013","37","12","4230","","10.1039/c3nj00683b","","","0.71073","MoKα","","0.0631","0.0484","","","0.1149","0.1282","","","","","","1.091","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053241","7.878","0.0004","8.885","0.0008","14.7671","0.0016","82.567","0.007","84.778","0.007","76.935","0.006","996.38","0.15","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C21 H29 N3 O3 -","- C21 H29 N3 O3 -","- C42 H58 N6 O6 -","2","1","","Klikar, Milan; Bureš, Filip; Pytela, Oldřich; Mikysek, Tomáš; Padělková, Zdeňka; Barsella, Alberto; Dorkenoo, Kokou; Achelle, Sylvain","N,N′-Dibutylbarbituric acid as an acceptor moiety in push‒pull chromophores","New Journal of Chemistry","2013","37","12","4230","","10.1039/c3nj00683b","","","0.71073","MoKα","","0.1326","0.072","","","0.1436","0.1792","","","","","","1.127","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053242","12.393","0.005","12.925","0.005","20.31","0.009","93.317","0.005","91.661","0.005","100.267","0.005","3193","2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- B16 Cd3 H53.5 Na3.5 O79.5 V12 -","- B16 Cd3 Na3.5 O79.5 V12 -","- B32 Cd6 Na7 O159 V24 -","2","1","","Liu, Xing; Zhou, Jian; Xiao, Hong-Ping; Kong, Chunyang; Zou, Huahong; Tang, Qiuling; Li, Jianhui","Two new 3-D boratopolyoxovanadate architectures based on the [V12B16O50(OH)8]12− cluster with different metal linkers","New Journal of Chemistry","2013","37","12","4077","","10.1039/c3nj00793f","","","0.71073","MoKα","","0.083","0.0744","","","0.223","0.2316","","","","","","1.103","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053243","17.048","0.008","17.431","0.008","23.628","0.011","90","","90.063","0.008","90","","7021","6","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- B16 H51 Na O76 V12 Zn2 -","- B16 Na O76 V12 Zn2 -","- B64 Na4 O304 V48 Zn8 -","4","0.5","","Liu, Xing; Zhou, Jian; Xiao, Hong-Ping; Kong, Chunyang; Zou, Huahong; Tang, Qiuling; Li, Jianhui","Two new 3-D boratopolyoxovanadate architectures based on the [V12B16O50(OH)8]12− cluster with different metal linkers","New Journal of Chemistry","2013","37","12","4077","","10.1039/c3nj00793f","","","0.71073","MoKα","","0.0826","0.0721","","","0.208","0.2196","","","","","","1.036","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7053244","12.2233","0.0012","15.1078","0.0015","12.1652","0.0012","90","","105.227","0.001","90","","2167.6","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Ag2 F12 N12 P2 -","- C36 H40 Ag2 F12 N12 P2 -","- C72 H80 Ag4 F24 N24 P4 -","2","0.5","","Biffis, Andrea; Cipani, Matteo; Tubaro, Cristina; Basato, Marino; Costante, Michele; Bressan, Edoardo; Venzo, Alfonso; Graiff, Claudia","Dinuclear complexes of silver(i) and gold(i) with macrocyclic dicarbene ligands bearing a 2,6-lutidinyl bridge: synthesis, structural analysis and dynamic behaviour in solution","New Journal of Chemistry","2013","37","12","4176","","10.1039/c3nj01000g","","","0.71073","MoKα","","0.0353","0.0306","","","0.0822","0.0868","","","","","","1.051","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053245","10.8843","0.0006","11.3235","0.0007","12.6353","0.0007","72.9578","0.0008","79.9609","0.0009","69.2499","0.0008","1387.99","0.14","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H50 Au2 F12 N14 P2 -","- C50 H50 Au2 F12 N14 P2 -","- C50 H50 Au2 F12 N14 P2 -","1","0.5","","Biffis, Andrea; Cipani, Matteo; Tubaro, Cristina; Basato, Marino; Costante, Michele; Bressan, Edoardo; Venzo, Alfonso; Graiff, Claudia","Dinuclear complexes of silver(i) and gold(i) with macrocyclic dicarbene ligands bearing a 2,6-lutidinyl bridge: synthesis, structural analysis and dynamic behaviour in solution","New Journal of Chemistry","2013","37","12","4176","","10.1039/c3nj01000g","","","0.71073","MoKα","","0.0374","0.031","","","0.0782","0.081","","","","","","1.04","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053246","14.929","0.003","21.378","0.003","18.173","0.002","90","","108.889","0.011","90","","5487.6","1.5","293","2","293","2","","","","","","","","4","I 1 2/m 1","-I 2y","12","5,11,17,23-tetra-(tert-butyl)calix(4)arene 25,26- (dihydroxy)(27,28-(2,6-di-tert-butyl-4-methyl- phenyl))monophosphite,monohydrate","5,11,17,23-tetra-(tert-butyl)calix[4]arene 25,26-(dihydroxy){27,28-(2,6-di-tert-butyl- 4-methyl-phenyl)}monophosphite,monohydrate","","- C59 H79 O6 P -","- C59 H76 O5.94 P -","- C236 H304 O23.76 P4 -","4","0.5","","Maji, Pathik; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam","NMR and X-ray crystallographic studies of unsymmetrical 25,26;27,28-dibridged para-tert-butyl calix[4]arene bisphosphites with a large “through-space” P‒P coupling","New Journal of Chemistry","2010","34","7","1478","","10.1039/b903771c","","","0.71073","MoKα","","0.1373","0.1067","","","0.3228","0.3451","","","","","","1.306","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053247","10.28","0.005","27.784","0.005","17.984","0.005","90","0.005","91.06","0.005","90","0.005","5136","3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","5,11,17,23-tetra-(tert-butyl)calix(4)arene 25,26- (dihydroxy)(27,28-(2,6-di-isopropyl-phenyl)) monophosphite","5,11,17,23-tetra-(tert-butyl)calix[4]arene 25,26-(dihydroxy){27,28-(2,6-di-isopropyl-phenyl)} monophosphite","","- C56 H71 O5 P -","- C56 H71 O5 P -","- C224 H284 O20 P4 -","4","1","","Maji, Pathik; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam","NMR and X-ray crystallographic studies of unsymmetrical 25,26;27,28-dibridged para-tert-butyl calix[4]arene bisphosphites with a large “through-space” P‒P coupling","New Journal of Chemistry","2010","34","7","1478","","10.1039/b903771c","","","0.71073","MoKα","","0.2505","0.1108","","","0.2604","0.3289","","","","","","0.877","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053248","13.6778","0.0015","16.7394","0.0018","19.432","0.002","71.8","0.002","78.874","0.002","77.135","0.002","4083.7","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","5,11,17,23-tetra-(tert-butyl)calix(4)arene (25,26-(2,6-di- tert-butyl-4-methyl-phenyl) 27,28-(2,4-di-tert-butyl-phenyl))diphosphite","5,11,17,23-tetra-(tert-butyl)calix[4]arene {25,26-(2,6-di-tert-butyl-4-methyl-phenyl) 27,28-(2,4-di-tert-butyl-phenyl)}diphosphite","","- C73 H96 O6 P2 -","- C73 H96 O6 P2 -","- C146 H192 O12 P4 -","2","1","","Maji, Pathik; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam","NMR and X-ray crystallographic studies of unsymmetrical 25,26;27,28-dibridged para-tert-butyl calix[4]arene bisphosphites with a large “through-space” P‒P coupling","New Journal of Chemistry","2010","34","7","1478","","10.1039/b903771c","","","0.71073","MoKα","","0.2291","0.1151","","","0.3161","0.3908","","","","","","1.092","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053249","10.0674","0.0008","13.3559","0.0009","33.067","0.002","90","","98.054","0.002","90","","4402.3","0.5","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C49 H64 O6 -","- C49 H64 O6 -","- C196 H256 O24 -","4","1","","Gruber, Tobias; Gruner, Margit; Fischer, Conrad; Seichter, Wilhelm; Bombicz, Petra; Weber, Edwin","Conformational behaviour and first crystal structures of a calix[4]arene featuring a laterally positioned carboxylic acid function in unsolvated and solvent-complexed forms","New Journal of Chemistry","2010","34","2","250","","10.1039/b904489b","","","0.71073","MoKα","","0.1057","0.0604","","","0.1485","0.1613","","","","","","1.027","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053250","23.887","0.005","17.151","0.003","12.429","0.003","90","","90","","90","","5092","1.9","93","2","93","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C51 H72 O8 -","- C51 H70 O8 -","- C204 H280 O32 -","4","1","","Gruber, Tobias; Gruner, Margit; Fischer, Conrad; Seichter, Wilhelm; Bombicz, Petra; Weber, Edwin","Conformational behaviour and first crystal structures of a calix[4]arene featuring a laterally positioned carboxylic acid function in unsolvated and solvent-complexed forms","New Journal of Chemistry","2010","34","2","250","","10.1039/b904489b","","","0.71073","MoKα","","0.1028","0.0791","","","0.2169","0.2411","","","","","","1.054","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053251","23.9696","0.0006","17.1752","0.0005","12.4147","0.0003","90","","90","","90","","5110.9","0.2","93","2","93","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C55 H78 O8 -","- C55 H78 O8 -","- C220 H312 O32 -","4","1","","Gruber, Tobias; Gruner, Margit; Fischer, Conrad; Seichter, Wilhelm; Bombicz, Petra; Weber, Edwin","Conformational behaviour and first crystal structures of a calix[4]arene featuring a laterally positioned carboxylic acid function in unsolvated and solvent-complexed forms","New Journal of Chemistry","2010","34","2","250","","10.1039/b904489b","","","0.71073","MoKα","","0.0634","0.0566","","","0.147","0.1619","","","","","","1.044","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053252","37.8856","0.001","37.8856","0.001","16.3396","0.0009","90","","90","","120","","20310.5","1.4","295","2","295","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C58 H108 Cl4 N36 O38 -","- C58 H80 Cl4 N36 O32 -","- C522 H720 Cl36 N324 O288 -","9","0.5","","Wu, Xiao-jun; Hu, Kai; Meng, Xiang-gao; Cheng, Gong-zhen","A cucurbit[8]uril inclusion complex with 1,7-dimethyl-1,4,7,10-tetraazacyclododecane tetrachloride","New Journal of Chemistry","2010","34","1","17","","10.1039/b9nj00218a","","","0.71073","MoKα","","0.1487","0.0961","","","0.2676","0.2927","","","","","","0.957","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053253","10.1926","0.001","11.0478","0.001","13.096","0.0014","101.849","0.002","102.082","0.002","115.675","0.002","1224.1","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","1,4-di(bis(4'-hydroxyphenyl)methyl)benzene","1,4-di[bis(4'-hydroxyphenyl)methyl]benzene","","- C32 H26 O4 -","- C32 H26 O4 -","- C64 H52 O8 -","2","1","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1563","0.0786","","","0.1032","0.1248","","","","","","0.991","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053254","20.631","0.004","7.1465","0.0014","28.309","0.005","90","","90","","90","","4173.9","1.4","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","1:2 complex of 1,4-di(bis(4'-hydroxyphenyl)methyl)benzene and 4,4'-bipyridine-N,N'-dioxide","1:2 complex of 1,4-di[bis(4'-hydroxyphenyl)methyl]benzene and 4,4'-bipyridine-N,N'-dioxide","","- C52 H42 N4 O8 -","- C52 H42 N4 O8 -","- C208 H168 N16 O32 -","4","1","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1569","0.1249","","","0.2726","0.2957","","","","","","1.112","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053255","14.472","0.006","16.115","0.006","8.057","0.003","90","","93.044","0.007","90","","1876.4","1.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1:2 complex of 1,4-di(bis(4'-hydroxyphenyl)methyl)benzene and quinoxaline","1:2 complex of 1,4-di[bis(4'-hydroxyphenyl)methyl]benzene and quinoxaline","","- C48 H38 N4 O4 -","- C48 H38 N4 O4 -","- C96 H76 N8 O8 -","2","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1422","0.0829","","","0.1429","0.1627","","","","","","1.118","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053256","11.0387","0.0011","7.4017","0.0007","19.498","0.0019","90","","96.343","0.002","90","","1583.3","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-di(bis(4'-hydroxyphenyl)methyl)benzene dimethylsulfoxide solvate","1,4-di[bis(4'-hydroxyphenyl)methyl]benzene dimethylsulfoxide solvate","","- C36 H38 O6 S2 -","- C36 H38 O6 S2 -","- C72 H76 O12 S4 -","2","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.0899","0.0603","","","0.1273","0.139","","","","","","1.062","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053257","7.3791","0.0005","10.4359","0.0008","11.3692","0.0008","93.357","0.001","95.241","0.001","100.824","0.001","853.77","0.11","100","2","100","2","","","","","","","","3","P -1","-P 1","2","1,4-di(bis(4'-hydroxyphenyl)methyl)benzene ethylacetate solvate","1,4-di[bis(4'-hydroxyphenyl)methyl]benzene ethylacetate solvate","","- C40 H42 O8 -","- C40 H42 O8 -","- C40 H42 O8 -","1","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.0436","0.0401","","","0.1049","0.1078","","","","","","1.048","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053258","33.506","0.003","5.8797","0.0004","22.036","0.002","90","","115.061","0.002","90","","3932.5","0.6","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","1,4-di(bis(4'-hydroxyphenyl)methyl)benzene isopropanol solvate","1,4-di[bis(4'-hydroxyphenyl)methyl]benzene isopropanol solvate","","- C44 H58 O8 -","- C38 H42 O6 -","- C152 H168 O24 -","4","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1003","0.0759","","","0.2116","0.2296","","","","","","1.042","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053259","10.2976","0.0008","11.2084","0.0009","18.4225","0.0015","96.041","0.001","103.721","0.001","102.7","0.001","1987.1","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","1:1.5 complex of 1,4-di(bis(4'-hydroxyphenyl)methyl)benzene and Phenazine","1:1.5 complex of 1,4-di[bis(4'-hydroxyphenyl)methyl]benzene and Phenazine","","- C50 H38 N3 O4 -","- C50 H38 N3 O4 -","- C100 H76 N6 O8 -","2","1","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1302","0.0651","","","0.1538","0.183","","","","","","1.016","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053260","13.064","0.002","7.6296","0.0011","16.929","0.003","90","","99.722","0.002","90","","1663.1","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1:2 complex of 1,4-di(bis(4'-hydroxyphenyl)methyl)benzene and N,N'-pyrazinedioxide","1:2 complex of 1,4-di[bis(4'-hydroxyphenyl)methyl]benzene and N,N'-pyrazinedioxide","","- C40 H34 N4 O8 -","- C40 H34 N4 O8 -","- C80 H68 N8 O16 -","2","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.0725","0.0599","","","0.1334","0.1397","","","","","","1.141","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053261","9.039","0.004","10.605","0.004","13.461","0.006","101.94","0.007","98.428","0.008","112.198","0.007","1132.3","0.8","298","2","298","2","","","","","","","","3","P -1","-P 1","2","1,4-di(bis(3'-hydroxy,2'-,4'-dimethoxyphenyl)methyl)benzene dioxane solvate","1,4-di[bis(3'-hydroxy,2'-,4'-dimethoxyphenyl)methyl]benzene dioxane solvate","","- C48 H58 O16 -","- C48 H42 O16 -","- C48 H42 O16 -","1","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1617","0.0751","","","0.1797","0.2208","","","","","","0.99","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053262","10.855","0.0007","14.204","0.0009","14.8984","0.0009","90","","111.17","0.001","90","","2142.1","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4-di(bis(3'-hydroxy,2'-,4'-dimethoxyphenyl)methyl)benzene dimethylsulfoxide solvate","1,4-di[bis(3'-hydroxy,2'-,4'-dimethoxyphenyl)methyl]benzene dimethylsulfoxide solvate","","- C44 H54 O14 S2 -","- C44 H54 O14 S2 -","- C88 H108 O28 S4 -","2","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.0933","0.0641","","","0.1565","0.1742","","","","","","1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053263","23.799","0.002","8.0974","0.0008","18.3595","0.0015","90","","113.226","0.005","90","","3251.3","0.5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,4-di(bis(4'-hydroxy 3'-methylphenyl)methyl)benzene dimethylformamide solvate","1,4-di[bis(4'-hydroxy 3'-methylphenyl)methyl]benzene dimethylformamide solvate","","- C42 H48 N2 O6 -","- C36 H34 O4 -","- C144 H136 O16 -","4","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1083","0.067","","","0.1694","0.1857","","","","","","0.978","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053264","5.5173","0.0005","12.0094","0.0012","12.9806","0.0013","91.144","0.002","96.446","0.002","91.41","0.002","854.17","0.14","298","2","298","2","","","","","","","","4","P -1","-P 1","2","1,4-di(bis(4'-hydroxy 3'-methylphenyl)methyl)benzene nitromethane solvate","1,4-di[bis(4'-hydroxy 3'-methylphenyl)methyl]benzene nitromethane solvate","","- C38 H40 N2 O8 -","- C38 H40 N2 O8 -","- C38 H40 N2 O8 -","1","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.0979","0.0594","","","0.1388","0.1567","","","","","","1.023","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053265","11.34","0.002","8.2249","0.0015","21.892","0.004","90","","102.049","0.004","90","","1996.9","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,4-di(bis(4'-hydroxy 3',5'-dimethylphenyl)methyl)benzene dimethylsulfoxaide solvate","1,4-di[bis(4'-hydroxy 3',5'-dimethylphenyl)methyl]benzene dimethylsulfoxaide solvate","","- C44 H54 O6 S2 -","- C44 H54 O6 S2 -","- C88 H108 O12 S4 -","2","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.1919","0.1189","","","0.1888","0.2151","","","","","","1.181","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053266","15.009","0.0017","5.5072","0.0006","18.887","0.002","90","","104.85","0.002","90","","1509","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","1,4-di(bis(4'-hydroxy 3',5'-dimethylphenyl)methyl)benzene","1,4-di[bis(4'-hydroxy 3',5'-dimethylphenyl)methyl]benzene","","- C40 H42 O4 -","- C40 H42 O4 -","- C80 H84 O8 -","2","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.0834","0.0604","","","0.1338","0.1454","","","","","","1.042","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053267","8.7313","0.0007","10.2761","0.0009","11.4745","0.001","64.982","0.001","75.98","0.001","86.58","0.001","904.07","0.13","100","2","100","2","","","","","","","","3","P -1","-P 1","2","1,4-di(bis(4'-hydroxy 3',5'-dimethylphenyl)methyl)benzene toluene solvate","1,4-di[bis(4'-hydroxy 3',5'-dimethylphenyl)methyl]benzene toluene solvate","","- C47 H50 O4 -","- C47 H50 O4 -","- C47 H50 O4 -","1","0.5","","Thakuria, Ranjit; Sarma, Bipul; Nangia, Ashwini","Supramolecular networks of a H-shaped aromatic phenol host","New Journal of Chemistry","2010","34","4","623","","10.1039/b9nj00234k","","","0.71073","MoKα","","0.0945","0.0764","","","0.176","0.1881","","","","","","1.074","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053268","5.5591","0.0002","4.8698","0.0002","23.3593","0.0009","90","","93.448","0.002","90","","631.23","0.04","100","","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","","0.71073","MoKα","","0.0674","0.043","","","","0.1284","","","","","","0.867","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053269","5.5751","0.0002","4.8787","0.0002","23.403","0.0009","90","","93.223","0.002","90","","635.54","0.04","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","","0.71073","MoKα","","0.0972","0.0494","","","","0.1371","","","","","","1.039","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053270","5.5929","0.0003","4.8891","0.0002","23.4513","0.0009","90","","92.978","0.002","90","","640.39","0.05","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","","0.71073","MoKα","","0.1107","0.0531","","","","0.1535","","","","","","1.04","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053271","5.6215","0.0006","4.8939","0.0006","23.492","0.002","90","","92.76","0.006","90","","645.54","0.12","250","2","250","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","","0.71073","MoKα","","0.1685","0.0678","","","","0.1744","","","","","","1.019","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053272","5.6218","0.0004","4.9063","0.0003","23.526","0.0013","90","","92.48","0.004","90","","648.29","0.07","300","2","300","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,5-dihydroxybenzoic acid","2,5-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","","0.71073","MoKα","","0.165","0.0712","","","","0.2148","","","","","","1.031","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053273","5.6491","0.0003","4.9306","0.0003","23.6191","0.0011","90","","92.277","0.003","90","","657.35","0.06","350","2","350","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-dihydroxybenzoic acid","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","","0.71073","MoKα","","0.159","0.0626","","","","0.2239","","","","","","1.066","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053274","3.656","0.002","22.329","0.011","8.009","0.004","90","","99.76","0.04","90","","644.4","0.6","20","2","20","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,4-Dihydroxybenzoic acid","","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","neutron","","neutron","","0.0789","0.0789","","","0.2129","0.2129","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053275","3.669","0.002","22.3473","0.0012","8.012","0.004","90","","99.63","0.04","90","","647.7","0.5","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,4-Dihydroxybenzoic acid","","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","neutron","","neutron","","0.0813","0.0813","","","0.2226","0.2226","","","","","","1.013","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053276","3.686","0.002","22.368","0.013","8.015","0.004","90","","99.44","0.04","90","","651.9","0.6","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,4-Dihydroxybenzoic acid","","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","neutron","","neutron","","0.0744","0.0744","","","0.1931","0.1931","","","","","","1.047","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053277","5.545","0.003","4.877","0.003","23.3506","0.0011","90","","93.62","0.03","90","","630.2","0.5","20","2","20","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,5-Dihydroxybenzoic acid","","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","neutron","","neutron","","0.0927","0.0927","","","0.2903","0.2903","","","","","","1.429","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053278","5.564","0.003","4.879","0.003","23.3903","0.0011","90","","93.43","0.03","90","","633.8","0.5","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,5-Dihydroxybenzoic acid","","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","neutron","","neutron","","0.0796","0.0796","","","0.2251","0.2251","","","","","","1.058","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053279","5.597","0.003","4.897","0.003","23.47","0.013","90","","92.97","0.04","90","","642.4","0.6","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,5-Dihydroxybenzoic acid","","","- C7 H6 O4 -","- C7 H6 O4 -","- C28 H24 O16 -","4","1","","Adam, Martin S.; Gutmann, Matthias J.; Leech, Charlotte K.; Middlemiss, Derek S.; Parkin, Andrew; Thomas, Lynne H.; Wilson, Chick C.","Stability and cooperativity of hydrogen bonds in dihydroxybenzoic acids","New Journal of Chemistry","2010","34","1","85","","10.1039/b9nj00353c","","neutron","","neutron","","0.0815","0.0815","","","0.23","0.23","","","","","","0.978","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053280","9.9732","0.0019","8.5492","0.0016","28.664","0.006","90","","94.152","0.003","90","","2437.6","0.8","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ag2.001 As8 Fe3 Na4.999 O28 -","- Ag2 As8 Fe3 Na5 O28 -","- Ag8 As32 Fe12 Na20 O112 -","4","0.5","","Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian","Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4","New Journal of Chemistry","2010","34","2","287","","10.1039/b9nj00355j","","","0.71069","MoKα","","0.0264","0.0264","","","0.0273","0.0273","","","","1.36","1.36","1.36","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053281","9.9512","0.0003","8.5741","0.0002","28.8231","0.0008","90","","93.91","0.0012","90","","2453.54","0.12","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ag2 As8 Fe3 Na5 O28 -","- Ag2 As8 Fe3 Na5 O28 -","- Ag8 As32 Fe12 Na20 O112 -","4","0.5","","Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian","Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4","New Journal of Chemistry","2010","34","2","287","","10.1039/b9nj00355j","","","0.71069","MoKα","","0.0311","0.0311","","","0.032","0.032","","","","0.95","0.95","0.95","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053282","9.5375","0.0003","8.3886","0.0003","28.0971","0.0009","90","","93.623","0.0018","90","","2243.45","0.13","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ag5 Fe3 Na2 O28 P8 -","- Ag5 Fe3 Na2.004 O28 P8 -","- Ag20 Fe12 Na8.016 O112 P32 -","4","0.5","","Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian","Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4","New Journal of Chemistry","2010","34","2","287","","10.1039/b9nj00355j","","","0.71069","MoKα","","0.0262","0.0262","","","0.0264","0.0264","","","","0.93","0.93","0.93","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053283","28.551","0.005","8.3631","0.0015","30.064","0.006","90","","111.89","0.003","90","","6661","2","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ag5 Fe3 Na2 O28 P8 -","- Ag5.00067 Fe3 Na2.00033 O28 P8 -","- Ag60.008 Fe36 Na24.004 O336 P96 -","12","1.5","","Quarez, Eric; Mentré, Olivier; Djellab, Karim; Masquelier, Christian","Crystal structures and sodium/silver distributions within the ionic conductors Na5Ag2Fe3(As2O7)4 and Na2Ag5Fe3(P2O7)4","New Journal of Chemistry","2010","34","2","287","","10.1039/b9nj00355j","","","0.71069","MoKα","","0.0545","0.0545","","","0.0566","0.0566","","","","2.71","2.71","2.71","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053284","9.7332","0.0004","9.7332","0.0004","29.9414","0.0012","90","","90","","90","","2836.5","0.2","296","2","296","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C3 H3 N2 O3 Rb S -","- C3 H3 N2 O3 Rb S -","- C48 H48 N32 O48 Rb16 S16 -","16","1","","Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert","Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion","New Journal of Chemistry","2010","34","2","221","","10.1039/b9nj00361d","","","0.71073","MoKα","","0.0351","0.0259","","","0.1012","0.1169","","","","","","0.966","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053285","8.8211","0.0014","8.1086","0.0013","9.8888","0.0015","90","","91.56","0.003","90","","707.05","0.19","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C3 H3 Cs N2 O3 S -","- C3 H3 Cs N2 O3 S -","- C12 H12 Cs4 N8 O12 S4 -","4","1","","Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert","Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion","New Journal of Chemistry","2010","34","2","221","","10.1039/b9nj00361d","","","0.71073","MoKα","","0.0219","0.0191","","","0.0479","0.049","","","","","","1.085","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053286","7.0543","0.0007","7.7307","0.0008","8.6389","0.0009","72.572","0.002","74.37","0.002","76.045","0.002","426.22","0.08","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H18 Mg N4 O12 S2 -","- C6 H18 Mg N4 O12 S2 -","- C6 H18 Mg N4 O12 S2 -","1","0.5","","Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert","Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion","New Journal of Chemistry","2010","34","2","221","","10.1039/b9nj00361d","","","0.71073","MoKα","","0.0364","0.0326","","","0.0886","0.0915","","","","","","1.063","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053287","6.027","0.002","7.243","0.003","14.186","0.005","92.491","0.008","101.383","0.007","97.471","0.007","600.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H6 N4 O6 S2 Sr -","- C6 H6 N4 O6 S1.984 Sr -","- C12 H12 N8 O12 S3.968 Sr2 -","2","1","","Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert","Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion","New Journal of Chemistry","2010","34","2","221","","10.1039/b9nj00361d","","","0.71073","MoKα","","0.0269","0.0251","","","0.0646","0.0655","","","","","","1.074","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053288","9.0315","0.001","13.2968","0.0015","7.7103","0.0009","90","","109.747","0.002","90","","871.48","0.17","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 Cu N4 O12 S2 -","- C6 H18 Cu N4 O12 S2 -","- C12 H36 Cu2 N8 O24 S4 -","2","0.5","","Fernando, Isurika R.; Daskalakis, Nikos; Demadis, Konstantinos D.; Mezei, Gellert","Cation effect on the inorganic‒organic layered structure of pyrazole-4-sulfonate networks and inhibitory effects on copper corrosion","New Journal of Chemistry","2010","34","2","221","","10.1039/b9nj00361d","","","0.71073","MoKα","","0.0255","0.0238","","","0.0658","0.0669","","","","","","1.062","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053289","6.4698","0.0005","9.0499","0.0008","12.57","0.0011","97.219","0.006","93.131","0.005","96.888","0.005","723.07","0.11","190","2","190","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H3 F3 O2 S2 -","- C3 H3 F3 O2 S2 -","- C12 H12 F12 O8 S8 -","4","2","","Torrico-Vallejos, Sonia; Erben, Mauricio F.; Boese, Roland; Della Védova, Carlos O.","Methoxycarbonyl trifluoromethyl disulfide, CH3OC(O)SSCF3: synthesis, structure and conformational properties","New Journal of Chemistry","2010","34","7","1365","","10.1039/b9nj00382g","","","0.71073","MoKα","","0.0886","0.063","","","0.1926","0.221","","","","","","1.043","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053290","9.3446","0.0019","10.612","0.002","15.267","0.003","90","","107.7","0.03","90","","1442.3","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-(1-hydroxy-1,2-diphenylethyl)pyridine","4-(1-hydroxy-1,2-diphenylethyl)pyridine","","- C19 H17 N O -","- C19 H17 N O -","- C76 H68 N4 O4 -","4","1","","Báthori, Nikoletta B.; Bombicz, Petra; Bourne, Susan A.; Venter, Gerhard A.","Investigation of sublimation with and without dissociation in the chloride and nitrate salts of 4-(1-hydroxy-1,2-diphenylethyl)pyridine","New Journal of Chemistry","2010","34","3","405","","10.1039/b9nj00411d","","","0.71073","MoKα","","0.0558","0.037","","","0.0857","0.0932","","","","","","1.041","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053291","6.3219","0.0013","8.4477","0.0017","15.349","0.003","102.22","0.03","92.54","0.03","106.21","0.03","764.6","0.3","100","2","173","2","","","","","","","","5","P -1","-P 1","2","4-(1-hydroxy-1,2-diphenylethyl)pyridium chloride","4-(1-hydroxy-1,2-diphenylethyl)pyridium chloride","","- C19 H18 Cl N O -","- C19 H18 Cl N O -","- C38 H36 Cl2 N2 O2 -","2","1","","Báthori, Nikoletta B.; Bombicz, Petra; Bourne, Susan A.; Venter, Gerhard A.","Investigation of sublimation with and without dissociation in the chloride and nitrate salts of 4-(1-hydroxy-1,2-diphenylethyl)pyridine","New Journal of Chemistry","2010","34","3","405","","10.1039/b9nj00411d","","","0.71073","MoKα","","0.0426","0.0333","","","0.0836","0.0895","","","","","","1.036","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053292","6.3168","0.0013","8.1971","0.0016","16.497","0.003","100.78","0.03","91.2","0.03","100.44","0.03","823.9","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","4-(1-hydroxy-1,2-diphenylethyl)pyridium nitrate","4-(1-hydroxy-1,2-diphenylethyl)pyridium nitrate","","- C19 H18 N2 O4 -","- C19 H18 N2 O4 -","- C38 H36 N4 O8 -","2","1","","Báthori, Nikoletta B.; Bombicz, Petra; Bourne, Susan A.; Venter, Gerhard A.","Investigation of sublimation with and without dissociation in the chloride and nitrate salts of 4-(1-hydroxy-1,2-diphenylethyl)pyridine","New Journal of Chemistry","2010","34","3","405","","10.1039/b9nj00411d","","","0.71073","MoKα","","0.1045","0.0501","","","0.0998","0.1181","","","","","","1.036","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053293","8.8197","0.0011","12.0309","0.0013","12.1267","0.0015","98.231","0.006","104.297","0.006","104.816","0.006","1175.8","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","Dichloro-bis-(5-phenylpyrazole)zinc chloroform solvate","","- C19 H17 Cl5 N4 Zn -","- C19 H17 Cl5 N4 Zn -","- C38 H34 Cl10 N8 Zn2 -","2","1","","Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A.","The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host","New Journal of Chemistry","2010","34","1","52","","10.1039/b9nj00412b","","","0.71073","MoKα","","0.0554","0.0337","","","0.0737","0.0811","","","","","","1.066","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053294","10.6333","0.0009","11.5074","0.0011","17.861","0.0017","90","","97.665","0.005","90","","2166","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Bis(5-cyclohexylpyrazole)dichlorozinc(ii)","Bis(5-cyclohexylpyrazole)dichlorozinc(II)","","- C18 H28 Cl2 N4 Zn -","- C18 H28 Cl2 N4 Zn -","- C72 H112 Cl8 N16 Zn4 -","4","1","","Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A.","The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host","New Journal of Chemistry","2010","34","1","52","","10.1039/b9nj00412b","","","0.71073","MoKα","","0.0256","0.0203","","","0.0505","0.0532","","","","","","1.037","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053295","13.0349","0.0013","20.252","0.002","14.7727","0.0017","90","","113.506","0.005","90","","3576.1","0.7","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Dichloro-bis-(5-{2-thienyl}pyrazole)zinc","","- C14 H12 Cl2 N4 S2 Zn -","- C14 H12 Cl2 N4 S2 Zn -","- C112 H96 Cl16 N32 S16 Zn8 -","8","2","","Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A.","The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host","New Journal of Chemistry","2010","34","1","52","","10.1039/b9nj00412b","","","0.71073","MoKα","","0.1094","0.0435","","","0.0883","0.1164","","","","","","1.019","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053296","17.685","0.002","17.185","0.002","17.758","0.003","90","","90","","90","","5397","1.3","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Chloro-tris(5-phenylpyrazole)zinc(II) chloride","","- C27 H24 Cl2 N6 Zn -","- C27 H24 Cl2 N6 Zn -","- C216 H192 Cl16 N48 Zn8 -","8","1","","Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A.","The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host","New Journal of Chemistry","2010","34","1","52","","10.1039/b9nj00412b","","","0.71073","MoKα","","0.0542","0.0301","","","0.066","0.0766","","","","","","1.052","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053297","11.9059","0.0009","12.3024","0.0009","12.4108","0.0009","66.546","0.003","74.875","0.004","71.417","0.004","1561.8","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","Chloro-tris(5-cyclohexylpyrazole)zinc(II) nitrate","","- C27 H42 Cl N7 O3 Zn -","- C27 H42 Cl N7 O3 Zn -","- C54 H84 Cl2 N14 O6 Zn2 -","2","1","","Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A.","The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host","New Journal of Chemistry","2010","34","1","52","","10.1039/b9nj00412b","","","0.71073","MoKα","","0.0618","0.0432","","","0.0973","0.1078","","","","","","1.033","","","","has coordinates,has disorder","180086","2020-10-21","18:00:00",""
"7053298","11.5875","0.0016","15.191","0.003","18.27","0.003","90","","90","","90","","3216","0.9","150","2","150","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","Bromo-tris(5-cyclohexylpyrazole)zinc(II) nitrate hydrate","","- C27 H44 Br N7 O4 Zn -","- C27 H44 Br N7 O4 Zn -","- C108 H176 Br4 N28 O16 Zn4 -","4","0.5","","Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A.","The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host","New Journal of Chemistry","2010","34","1","52","","10.1039/b9nj00412b","","","0.71073","MoKα","","0.0535","0.0318","","","0.0764","0.0928","","","","","","1.118","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053299","24.414","0.003","16.933","0.002","19.071","0.004","90","","126.019","0.005","90","","6376.7","1.8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Chloro-tris(5-cyclohexylpyrazole)zinc(II) perchlorate","","- C27 H42 Cl2 N6 O4 Zn -","- C27 H42 Cl2 N6 O4 Zn -","- C216 H336 Cl16 N48 O32 Zn8 -","8","1","","Day, Jonathan; Marriott, Katie E. R.; Kilner, Colin A.; Halcrow, Malcolm A.","The effect of different ligand substituents on the chemistry of a zinc‒pyrazole anion host","New Journal of Chemistry","2010","34","1","52","","10.1039/b9nj00412b","","","0.71073","MoKα","","0.0852","0.0396","","","0.0724","0.0887","","","","","","1.027","","","","has coordinates","180086","2020-10-21","18:00:00",""
"7053300","12.602","0.001","19.3023","0.0015","34.983","0.003","90","","90","","90","","8509.5","1.2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Tetramethylammonium pentacarbonyl((2-phenylthiazol-5- yl)carbonyl)tungstate(1-)","Tetramethylammonium pentacarbonyl[(2-phenylthiazol-5- yl)carbonyl]tungstate(1-)","","- C19 H18 N2 O6 S W -","- C19 H18 N2 O6 S W -","- C304 H288 N32 O96 S16 W16 -","16","2","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0309","0.0241","","","0.0547","0.0572","","","","","","1.049","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053301","11.5111","0.0007","12.0437","0.0008","13.8342","0.0009","100.005","0.001","102.85","0.001","94.026","0.001","1829.6","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","pentacarbonyl-2kappa$5!C-(mu-(2-phenylthiazol-5-yl)carbonyl- 1kappaC:2kappaO)(triphenylphosphane-1kappaP)goldtungsten pentane solvate","pentacarbonyl-2κ^5^C-[μ-(2-phenylthiazol-5-yl)carbonyl- 1κC:2κO](triphenylphosphane-1κP)goldtungsten pentane solvate","","- C38 H33 Au N O6 P S W -","- C38 H33 Au N O6 P S W -","- C76 H66 Au2 N2 O12 P2 S2 W2 -","2","1","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0473","0.0397","","","0.087","0.0898","","","","","","1.074","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053302","22.688","0.004","9.0983","0.0015","21.294","0.003","90","","92.674","0.002","90","","4390.8","1.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","{[2-(1-piperidinyl)thiophen-5-yl]carbonyl}pentacarbonyl- tungstate(-I) tetramethylammonium salt","tetramethylammonium pentacarbonyl{[2-(1-piperidinyl)thiazol- 5-yl]carbonyl}tungstate(1-)","","- C18 H23 N3 O6 S W -","- C18 H23 N3 O6 S W -","- C144 H184 N24 O48 S8 W8 -","8","1","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0415","0.0387","","","0.0974","0.1","","","","","","1.08","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053303","17.336","0.002","26.055","0.003","7.4114","0.0009","90","","90","","90","","3347.7","0.7","100","2","100","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","[Methoxy(2-phenylthiazol-5-yl)carbene]pentacarbonyltungsten(0)","Pentacarbonyl[methoxy(2-phenylthiazol-5-yl)methylidene]tungsten","","- C16 H9 N O6 S W -","- C16 H9 N O6 S W -","- C128 H72 N8 O48 S8 W8 -","8","1","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0366","0.0312","","","0.0697","0.0719","","","","","","1.102","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053304","26.273","0.007","11.491","0.003","16.925","0.005","90","","111.94","0.004","90","","4740","2","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","cocrystallisate of pentacarbonyl(hydroxy(2-(1- piperidyl)thiazol-5- yl)methylidene)tungsten and tetramethylammonium pentacarbonyl((2-(1- piperidyl)thiazol-5-yl)carbonyl)tungstate(1-) bis- trichloromethane solvate","cocrystallisate of pentacarbonyl{hydroxy[2-(1-piperidyl)thiazol- 5-yl]methylidene}tungsten and tetramethylammonium pentacarbonyl{[2-(1-piperidyl)thiazol-5-yl]carbonyl}tungstate(1-) bis-trichloromethane solvate","","- C34 H37 Cl6 N5 O12 S2 W2 -","- C34 H37 Cl6 N5 O12 S2 W2 -","- C136 H148 Cl24 N20 O48 S8 W8 -","4","0.5","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0731","0.0525","","","0.1153","0.1245","","","","","","1.025","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053305","14.2229","0.0011","11.5834","0.0009","14.8108","0.0011","90","","106.345","0.001","90","","2341.5","0.3","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Chloro[(methoxy)(2-phenylthiazol-5-yl)carbene]gold(I)","Chloro[methoxy(2-phenylthiazol-5-yl)methylidene]gold","","- C11 H9 Au Cl N O S -","- C11 H9 Au Cl N O S -","- C88 H72 Au8 Cl8 N8 O8 S8 -","8","2","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.026","0.0234","","","0.0548","0.056","","","","","","1.04","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053306","8.657","0.002","8.917","0.002","16.718","0.004","98.687","0.004","96.49","0.004","118.054","0.003","1100.5","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","Chlorodicarbonylbis(pyridine)[2-(1-piperidinyl)thiazol-5- ylcarbyne]tungsten(IV)'","cis-dicarbonylchloro{[2-(1-piperidinyl)thiazol-5- yl]methylidyne}-cis-bis(pyridine)tungsten","","- C21 H21 Cl N4 O2 S W -","- C21 H21 Cl N4 O2 S W -","- C42 H42 Cl2 N8 O4 S2 W2 -","2","1","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0293","0.0268","","","0.0661","0.0671","","","","","","1.082","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053307","9.1923","0.0007","9.285","0.0008","15.7035","0.0013","101.302","0.001","92.103","0.001","105.72","0.001","1259.41","0.18","100","2","100","2","","","","","","","","7","P -1","-P 1","2","chlorodicarbonylbis(pyridine)[(2-phenylthiazol-5-yl) carbyne]tungsten(IV)","cis-dicarbonylchloro[(2-phenylthiazol-5-yl)methylidyne]- cis-bis(pyridine)tungsten dichloromethane solvate","","- C23 H18 Cl3 N3 O2 S W -","- C23 H18 Cl3 N3 O2 S W -","- C46 H36 Cl6 N6 O4 S2 W2 -","2","1","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0257","0.0241","","","0.0572","0.0579","","","","","","1.081","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053308","10.603","0.0014","11.8806","0.0016","11.932","0.0016","70.039","0.002","83.042","0.002","69.143","0.002","1320.2","0.3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","cis-dicarbonyl-2kappa$2!C-dichloro-1kappa,2kappa-(mu-(2-(1- piperidinyl)thiazol-5-yl)methylidyne-1kappaC$1!:2kappaC$1!) bis(pyridine-2kappaN)goldtungsten(Au—W) hemi-tetrahydrofuran solvate","cis-dicarbonyl-2κ^2^C-dichloro-1κ,2κ-{μ-[2-(1- piperidinyl)thiazol-5-yl]methylidyne-1κC^1^:2κC^1^} bis(pyridine-2κN)goldtungsten(Au—W) hemi-tetrahydrofuran solvate","","- C23 H25 Au Cl2 N4 O2.5 S W -","- C21 H21 Au Cl2 N4 O2 S W -","- C42 H42 Au2 Cl4 N8 O4 S2 W2 -","2","1","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0806","0.0623","","","0.1199","0.1259","","","","","","1.218","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053309","26.655","0.004","7.1269","0.0011","23.559","0.004","90","","121.419","0.002","90","","3819.2","1.1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","cis-dicarbonylchloro((4-methylphenyl)methylidyne)-cis- bis(pyridine)tungsten","cis-dicarbonylchloro[(4-methylphenyl)methylidyne]- cis-bis(pyridine)tungsten","","- C20 H17 Cl N2 O2 W -","- C20 H17 Cl N2 O2 W -","- C160 H136 Cl8 N16 O16 W8 -","8","1","","Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.","Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments","New Journal of Chemistry","2010","34","3","458","","10.1039/b9nj00413k","","","0.71073","MoKα","","0.0586","0.05","","","0.1295","0.1349","","","","","","1.064","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053310","20.51","0.002","7.0178","0.0008","23.495","0.003","90","","112.446","0.001","90","","3125.6","0.6","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H34 Mn N4 O12 S -","- C27 H32 Mn N4 O12 S -","- C108 H128 Mn4 N16 O48 S4 -","4","1","","Miao, Xiao-He; Zhu, Long-Guan","Supramolecular assembly under the control of the chelating ligand for the MnII/bridging ligands/3-sulfobenzoate system and catalytic properties for the disproportionation of hydrogen peroxide","New Journal of Chemistry","2010","34","11","2403","","10.1039/b9nj00428a","","","0.71073","MoKα","","0.0898","0.0649","","","0.169","0.1836","","","","","","1.162","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053311","11.7416","0.001","11.9663","0.001","12.9264","0.0011","69.042","0.001","89.555","0.001","67.904","0.001","1554.5","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H30 Mn N4 O8 S -","- C31 H30 Mn N4 O8 S -","- C62 H60 Mn2 N8 O16 S2 -","2","1","","Miao, Xiao-He; Zhu, Long-Guan","Supramolecular assembly under the control of the chelating ligand for the MnII/bridging ligands/3-sulfobenzoate system and catalytic properties for the disproportionation of hydrogen peroxide","New Journal of Chemistry","2010","34","11","2403","","10.1039/b9nj00428a","","","0.71073","MoKα","","0.0658","0.061","","","0.1294","0.1324","","","","","","1.139","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053312","7.4415","0.0008","20.268","0.002","10.2404","0.0011","90","","107.609","0.001","90","","1472.1","0.3","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H28 Mn N4 O9 S -","- C29 H28 Mn N4 O9 S -","- C58 H56 Mn2 N8 O18 S2 -","2","1","","Miao, Xiao-He; Zhu, Long-Guan","Supramolecular assembly under the control of the chelating ligand for the MnII/bridging ligands/3-sulfobenzoate system and catalytic properties for the disproportionation of hydrogen peroxide","New Journal of Chemistry","2010","34","11","2403","","10.1039/b9nj00428a","","","0.71073","MoKα","","0.0352","0.033","","","0.0726","0.0739","","","","","","1.032","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053313","13.7428","0.0015","13.7074","0.0015","14.2123","0.0015","90","","118.334","0.001","90","","2356.5","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H40 Mn2 N6 O14 S2 -","- C48 H40 Mn2 N6 O14 S2 -","- C96 H80 Mn4 N12 O28 S4 -","2","0.5","","Miao, Xiao-He; Zhu, Long-Guan","Supramolecular assembly under the control of the chelating ligand for the MnII/bridging ligands/3-sulfobenzoate system and catalytic properties for the disproportionation of hydrogen peroxide","New Journal of Chemistry","2010","34","11","2403","","10.1039/b9nj00428a","","","0.71073","MoKα","","0.0473","0.0376","","","0.0896","0.0949","","","","","","1.027","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053314","11.5737","0.0008","14.5456","0.001","22.7033","0.0015","90","","104.6","0.001","90","","3698.6","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H37 Mn N5 O10 S -","- C37 H27 Mn N5 O10 S -","- C148 H108 Mn4 N20 O40 S4 -","4","1","","Miao, Xiao-He; Zhu, Long-Guan","Supramolecular assembly under the control of the chelating ligand for the MnII/bridging ligands/3-sulfobenzoate system and catalytic properties for the disproportionation of hydrogen peroxide","New Journal of Chemistry","2010","34","11","2403","","10.1039/b9nj00428a","","","0.71073","MoKα","","0.0899","0.0639","","","0.1516","0.1657","","","","","","1.127","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053315","10.7849","0.0015","11.3475","0.0016","14.816","0.002","100.909","0.001","97.804","0.001","109.911","0.001","1634.2","0.4","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H29 Mn N5 O7 S -","- C37 H29 Mn N5 O7 S -","- C74 H58 Mn2 N10 O14 S2 -","2","1","","Miao, Xiao-He; Zhu, Long-Guan","Supramolecular assembly under the control of the chelating ligand for the MnII/bridging ligands/3-sulfobenzoate system and catalytic properties for the disproportionation of hydrogen peroxide","New Journal of Chemistry","2010","34","11","2403","","10.1039/b9nj00428a","","","0.71073","MoKα","","0.0487","0.0392","","","0.0946","0.0999","","","","","","1.067","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053316","7.473","0.001","21.153","0.001","13.311","0.001","90","","90","","90","","2104.2","0.3","150","0.1","150","0.1","","","","","","","","5","C c m 21","C 2c -2c","36","","","","- C20 H24 Fe O8 P2 -","- C20 H24 Fe O8 P2 -","- C80 H96 Fe4 O32 P8 -","4","0.5","","Carmichael, Duncan; Le Goff, Xavier F.; Muller, Eric","Studies of how redox chemistry influences the synthesis of transition metal phosphametallocenes: a convenient synthesis of 2,5-diester-substituted phosphametallocenes and 2,2′,5,5′-tetraester-substituted-1,1′-diphosphaferrocenes","New Journal of Chemistry","2010","34","7","1341","","10.1039/b9nj00440h","","","0.71069","MoKα","","0.0306","0.0264","","","0.0638","0.0654","","","","","","1.066","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053317","8.213","0.001","11.074","0.001","16.621","0.001","90","","101.473","0.001","90","","1481.5","0.2","150","0.1","150","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Fe O4 P -","- C15 H17 Fe O4 P -","- C60 H68 Fe4 O16 P4 -","4","1","","Carmichael, Duncan; Le Goff, Xavier F.; Muller, Eric","Studies of how redox chemistry influences the synthesis of transition metal phosphametallocenes: a convenient synthesis of 2,5-diester-substituted phosphametallocenes and 2,2′,5,5′-tetraester-substituted-1,1′-diphosphaferrocenes","New Journal of Chemistry","2010","34","7","1341","","10.1039/b9nj00440h","","","0.71069","MoKα","","0.0341","0.0268","","","0.0697","0.0731","","","","","","1.04","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053318","23.734","0.002","11.947","0.001","20.846","0.002","90","","103.37","0.003","90","","5750.7","0.9","100","2","100","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C90 F40 -","- C90 F40 -","- C360 F160 -","4","1","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.1486","0.1438","","","0.3828","0.3913","","","","","","1.158","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053319","21.4945","0.0003","10.1855","0.0004","20.2452","0.0007","90","","107.742","0.003","90","","4221.5","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C80 H14 F8 -","- C80 H14 F8 -","- C320 H56 F32 -","4","1","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.0929","0.0873","","","0.2291","0.2315","","","","","","1.088","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053320","13.189","0.001","17.205","0.001","20.177","0.002","90","","93.82","0.004","90","","4568.3","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C84 H8 Cl4 F4 -","- C84 Cl3.9996 F4 -","- C336 Cl15.9984 F16 -","4","1","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.1299","0.1078","","","0.2501","0.2617","","","","","","1.029","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053321","12.348","0.001","16.089","0.001","16.66","0.001","88.074","0.003","89.552","0.003","79.563","0.003","3253.2","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C96 H14 F40 -","- C96 F40 -","- C192 F80 -","2","1","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.0879","0.0783","","","0.1859","0.1922","","","","","","1.097","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053322","34.703","0.002","28.282","0.002","9.977","0.001","90","","90","","90","","9792.1","1.3","100","2","100","2","","","","","","","","3","A b a 2","A 2 -2ab","41","","","","- C82.5 H10.5 F16 -","- C82.5 F16 -","- C660 F128 -","8","","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.2133","0.104","","","0.2591","0.2881","","","","","","1.103","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053323","17.139","0.001","11.117","0.001","20.154","0.001","90","","107.078","0.004","90","","3670.7","0.4","100","2","100","2","","","","","","","","2","P 1 c 1","P -2yc","7","","","","- C74 F8 -","- C74 F8 -","- C296 F32 -","4","2","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.2121","0.1341","","","0.2956","0.3224","","","","","","1.032","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053324","12.065","0.001","16.414","0.001","16.44","0.001","92.965","0.003","95.77","0.003","101.288","0.003","3168","0.4","100","2","100","2","","","","","","","","2","P -1","-P 1","2","","","","- C94 F48 -","- C94 F48 -","- C188 F96 -","2","1","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.0877","0.07","","","0.1766","0.1857","","","","","","1.029","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053325","21.4","0.001","19.73","0.001","30.49","0.002","90","","90","","90","","12873.5","1.2","100","2","100","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C94 F48 -","- C94 F48 -","- C752 F384 -","8","1","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.194","0.0793","","","0.1823","0.1983","","","","","","1.199","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053326","22.599","0.002","16.53","0.001","11.926","0.001","90","","90","","90","","4455.1","0.6","100","2","100","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- C86 F32 -","- C86 F32 -","- C344 F128 -","4","0.5","","Gruzinskaya, Natalia I.; Silin, Andrey I.; Pimenova, Anna S.; Khavrel, Pavel A.; Markov, Vitaliy Yu.; Sidorov, Lev N.; Kemnitz, Erhard; Troyanov, Sergey I.","Synthesis and structure of cycloperfluoroalkylated derivatives of C70, C70(C2F4) and C70(C4F8)n, n = 1‒6","New Journal of Chemistry","2010","34","2","243","","10.1039/b9nj00444k","","","0.905","synchrotron","","0.1662","0.0667","","","0.1601","0.1791","","","","","","1.164","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053327","5.6906","0.0008","12.8","0.0018","21.55","0.003","90","","95.392","0.002","90","","1562.7","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 Ce N O9 P -","- C7 H19 Ce N O9 P -","- C28 H76 Ce4 N4 O36 P4 -","4","1","","Zhang, Na; Sun, Zhengang; Zhu, Yanyu; Zhang, Jing; Liu, Lei; Huang, Cuiying; Lu, Xin; Wang, Weinan; Tong, Fei","Synthesis, crystal structure and luminescence properties of eight new lanthanide carboxyphosphonates with a 3D framework structure","New Journal of Chemistry","2010","34","11","2429","","10.1039/b9nj00456d","","","0.71073","MoKα","","0.0982","0.0643","","","0.1733","0.1954","","","","","","1.078","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053328","5.6068","0.0008","13.382","0.0018","21.192","0.003","90","","95.892","0.002","90","","1581.6","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 N O9 P Pr -","- C7 H19 N O9 P Pr -","- C28 H76 N4 O36 P4 Pr4 -","4","1","","Zhang, Na; Sun, Zhengang; Zhu, Yanyu; Zhang, Jing; Liu, Lei; Huang, Cuiying; Lu, Xin; Wang, Weinan; Tong, Fei","Synthesis, crystal structure and luminescence properties of eight new lanthanide carboxyphosphonates with a 3D framework structure","New Journal of Chemistry","2010","34","11","2429","","10.1039/b9nj00456d","","","0.71073","MoKα","","0.0728","0.0519","","","0.1357","0.1509","","","","","","1.106","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053329","5.5871","0.0006","13.424","0.0015","21.157","0.002","90","","96.148","0.001","90","","1577.7","0.3","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 N Nd O9 P -","- C7 H19 N Nd O9 P -","- C28 H76 N4 Nd4 O36 P4 -","4","1","","Zhang, Na; Sun, Zhengang; Zhu, Yanyu; Zhang, Jing; Liu, Lei; Huang, Cuiying; Lu, Xin; Wang, Weinan; Tong, Fei","Synthesis, crystal structure and luminescence properties of eight new lanthanide carboxyphosphonates with a 3D framework structure","New Journal of Chemistry","2010","34","11","2429","","10.1039/b9nj00456d","","","0.71073","MoKα","","0.048","0.039","","","0.1124","0.1192","","","","","","1.133","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053330","5.5462","0.001","13.343","0.003","21.164","0.004","90","","96.516","0.003","90","","1556.1","0.5","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 N O9 P Sm -","- C7 H19 N O9 P Sm -","- C28 H76 N4 O36 P4 Sm4 -","4","1","","Zhang, Na; Sun, Zhengang; Zhu, Yanyu; Zhang, Jing; Liu, Lei; Huang, Cuiying; Lu, Xin; Wang, Weinan; Tong, Fei","Synthesis, crystal structure and luminescence properties of eight new lanthanide carboxyphosphonates with a 3D framework structure","New Journal of Chemistry","2010","34","11","2429","","10.1039/b9nj00456d","","","0.71073","MoKα","","0.0988","0.0626","","","0.1643","0.1871","","","","","","1.052","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053331","5.534","0.001","13.436","0.003","20.891","0.004","90","","96.159","0.003","90","","1544.4","0.5","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 Gd N O9 P -","- C7 H19 Gd N O9 P -","- C28 H76 Gd4 N4 O36 P4 -","4","1","","Zhang, Na; Sun, Zhengang; Zhu, Yanyu; Zhang, Jing; Liu, Lei; Huang, Cuiying; Lu, Xin; Wang, Weinan; Tong, Fei","Synthesis, crystal structure and luminescence properties of eight new lanthanide carboxyphosphonates with a 3D framework structure","New Journal of Chemistry","2010","34","11","2429","","10.1039/b9nj00456d","","","0.71073","MoKα","","0.1095","0.0621","","","0.146","0.1717","","","","","","1.041","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053332","5.5234","0.001","13.349","0.002","20.586","0.004","90","","95.29","0.002","90","","1511.4","0.5","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 N O9 P Y -","- C7 H19 N O9 P Y -","- C28 H76 N4 O36 P4 Y4 -","4","1","","Zhang, Na; Sun, Zhengang; Zhu, Yanyu; Zhang, Jing; Liu, Lei; Huang, Cuiying; Lu, Xin; Wang, Weinan; Tong, Fei","Synthesis, crystal structure and luminescence properties of eight new lanthanide carboxyphosphonates with a 3D framework structure","New Journal of Chemistry","2010","34","11","2429","","10.1039/b9nj00456d","","","0.71073","MoKα","","0.1023","0.0708","","","0.2002","0.2248","","","","","","1.099","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053333","5.5313","0.0007","13.396","0.0017","20.934","0.003","90","","96.177","0.002","90","","1542.1","0.4","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19 Eu N O9 P -","- C7 H19 Eu N O9 P -","- C28 H76 Eu4 N4 O36 P4 -","4","1","","Zhang, Na; Sun, Zhengang; Zhu, Yanyu; Zhang, Jing; Liu, Lei; Huang, Cuiying; Lu, Xin; Wang, Weinan; Tong, Fei","Synthesis, crystal structure and luminescence properties of eight new lanthanide carboxyphosphonates with a 3D framework structure","New Journal of Chemistry","2010","34","11","2429","","10.1039/b9nj00456d","","","0.71073","MoKα","","0.0788","0.0524","","","0.1337","0.1544","","","","","","1.079","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053334","10.2037","0.0013","10.3235","0.0015","20.243","0.003","103.109","0.007","98.62","0.008","90.554","0.007","2051.2","0.5","113","2","113","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H23 Eu F9 N3 O6 S3 -","- C41 H23 Eu F9 N3 O6 S3 -","- C82 H46 Eu2 F18 N6 O12 S6 -","2","1","","Chen, Zhuqi; Ding, Fei; Hao, Feng; Guan, Ming; Bian, Zuqiang; Ding, Bei; Huang, Chunhui","Synthesis and electroluminescent property of novel europium complexes with oxadiazole substituted 1,10-phenanthroline and 2,2′-bipyridine ligands","New Journal of Chemistry","2010","34","3","487","","10.1039/b9nj00461k","","","0.7107","MoKα","","0.063","0.0554","","","0.1224","0.1266","","","","","","1.104","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053335","7.5561","0.0005","8.1977","0.0008","8.3331","0.0006","88.322","0.007","79.154","0.006","67.174","0.008","466.71","0.07","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C9 H14 O3 -","- C9 H14 O3 -","- C18 H28 O6 -","2","1","","Clausen, Henrik F.; Chevallier, Marie S.; Spackman, Mark A.; Iversen, Bo B.","Three new co-crystals of hydroquinone: crystal structures and Hirshfeld surface analysis of intermolecular interactions","New Journal of Chemistry","2010","34","2","193","","10.1039/b9nj00463g","","","0.7107","MoKα","","0.084","0.0466","","","0.1104","0.1287","","","","","","1.413","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053336","11.1325","0.0006","9.041","0.0005","21.0854","0.0011","90","","100.098","0.004","90","","2089.3","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C80 H120 N8 O24 -","8","1","","Clausen, Henrik F.; Chevallier, Marie S.; Spackman, Mark A.; Iversen, Bo B.","Three new co-crystals of hydroquinone: crystal structures and Hirshfeld surface analysis of intermolecular interactions","New Journal of Chemistry","2010","34","2","193","","10.1039/b9nj00463g","","","0.71073","MoKα","","0.1307","0.0621","","","0.142","0.1623","","","","","","1.078","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053337","5.5742","0.0001","9.8776","0.0003","17.6573","0.0004","101.171","0.001","92.245","0.002","99.443","0.002","938.33","0.04","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H26 N O6 -","- C20 H26 N O6 -","- C40 H52 N2 O12 -","2","1","","Clausen, Henrik F.; Chevallier, Marie S.; Spackman, Mark A.; Iversen, Bo B.","Three new co-crystals of hydroquinone: crystal structures and Hirshfeld surface analysis of intermolecular interactions","New Journal of Chemistry","2010","34","2","193","","10.1039/b9nj00463g","","","0.71073","MoKα","","0.0838","0.0542","","","0.1092","0.1211","","","","","","1.034","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053338","10.0098","0.0013","23.815","0.003","13.7457","0.0018","90","","93.593","0.002","90","","3270.3","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C78 H70 Dy2 N4 O12 -","- C78 H70 Dy2 N4 O12 -","- C156 H140 Dy4 N8 O24 -","2","0.5","","Ye, Hong-Mei; Ren, Ning; Zhang, Jian-Jun; Sun, Shu-Jing; Wang, Juan-Fen","Crystal structures, luminescent and thermal properties of a new series of lanthanide complexes with 4-ethylbenzoic acid","New Journal of Chemistry","2010","34","3","533","","10.1039/b9nj00504h","","","0.71073","MoKα","","0.0337","0.0302","","","0.0676","0.0699","","","","","","0.999","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053339","10.5709","0.0018","11.734","0.002","13.976","0.003","80.499","0.005","83.494","0.005","82.076","0.006","1686.2","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H70 Ho2 N4 O12 -","- C78 H70 Ho2 N4 O12 -","- C78 H70 Ho2 N4 O12 -","1","0.5","","Ye, Hong-Mei; Ren, Ning; Zhang, Jian-Jun; Sun, Shu-Jing; Wang, Juan-Fen","Crystal structures, luminescent and thermal properties of a new series of lanthanide complexes with 4-ethylbenzoic acid","New Journal of Chemistry","2010","34","3","533","","10.1039/b9nj00504h","","","0.71073","MoKα","","0.0355","0.0306","","","0.0586","0.0609","","","","","","1.003","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053340","12.1236","0.0013","15.7615","0.0018","18.7822","0.0018","77.917","0.003","74.75","0.003","87.543","0.003","3385.6","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H70 Eu2 N4 O12 -","- C78 H70 Eu2 N4 O12 -","- C156 H140 Eu4 N8 O24 -","2","1","","Ye, Hong-Mei; Ren, Ning; Zhang, Jian-Jun; Sun, Shu-Jing; Wang, Juan-Fen","Crystal structures, luminescent and thermal properties of a new series of lanthanide complexes with 4-ethylbenzoic acid","New Journal of Chemistry","2010","34","3","533","","10.1039/b9nj00504h","","","0.71073","MoKα","","0.0389","0.0313","","","0.0699","0.0747","","","","","","0.999","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053341","12.0849","0.0013","15.7273","0.0018","18.7487","0.0019","77.978","0.003","74.991","0.003","87.569","0.003","3366.1","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H70 N4 O12 Tb2 -","- C78 H70 N4 O12 Tb2 -","- C156 H140 N8 O24 Tb4 -","2","1","","Ye, Hong-Mei; Ren, Ning; Zhang, Jian-Jun; Sun, Shu-Jing; Wang, Juan-Fen","Crystal structures, luminescent and thermal properties of a new series of lanthanide complexes with 4-ethylbenzoic acid","New Journal of Chemistry","2010","34","3","533","","10.1039/b9nj00504h","","","0.71073","MoKα","","0.0453","0.0371","","","0.0837","0.0895","","","","","","1.001","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053342","10.8233","0.0017","12.664","0.002","13.627","0.002","77.966","0.008","79.457","0.008","71.233","0.006","1716","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H70 N4 Nd2 O12 -","- C78 H70 N4 Nd2 O12 -","- C78 H70 N4 Nd2 O12 -","1","0.5","","Ye, Hong-Mei; Ren, Ning; Zhang, Jian-Jun; Sun, Shu-Jing; Wang, Juan-Fen","Crystal structures, luminescent and thermal properties of a new series of lanthanide complexes with 4-ethylbenzoic acid","New Journal of Chemistry","2010","34","3","533","","10.1039/b9nj00504h","","","0.71073","MoKα","","0.0405","0.0359","","","0.0725","0.075","","","","","","1.005","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053343","12.1337","0.001","15.78","0.0014","18.7575","0.0015","77.814","0.002","74.551","0.003","87.505","0.003","3383.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C78 H70 N4 O12 Sm2 -","- C78 H70 N4 O12 Sm2 -","- C156 H140 N8 O24 Sm4 -","2","1","","Ye, Hong-Mei; Ren, Ning; Zhang, Jian-Jun; Sun, Shu-Jing; Wang, Juan-Fen","Crystal structures, luminescent and thermal properties of a new series of lanthanide complexes with 4-ethylbenzoic acid","New Journal of Chemistry","2010","34","3","533","","10.1039/b9nj00504h","","","0.71073","MoKα","","0.0429","0.0348","","","0.0707","0.075","","","","","","1","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053344","9.841","0.005","10.09","0.004","10.239","0.004","82.85","0.03","61.73","0.02","76.85","0.03","871.8","0.7","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C15 H20 Cl Fe N O2 Pt S -","- C15 H20 Cl Fe N O2 Pt S -","- C30 H40 Cl2 Fe2 N2 O4 Pt2 S2 -","2","1","","López, Concepción; Pérez, Sonia; Solans, Xavier; Font-Bardía, Mercè; Calvet, Teresa","Influence of the substituent R1 on the reactivity of [(η5-C5H5)Fe{(η5-C5H4)‒CHN‒(R1)‒OH}] {R1 = ‒CH2‒CH2‒ or 1,2-C6H4} with platinum(ii) and on the properties of the complexes","New Journal of Chemistry","2010","34","4","676","","10.1039/b9nj00509a","","","0.71073","MoKα","","0.0305","0.0298","","","0.0867","0.0872","","","","","","1.215","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053345","9.841","0.008","11.04","0.006","13.762","0.008","96.46","0.03","96.67","0.04","107.3","0.04","1400.7","1.6","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H29 Cl Fe N O P Pt -","- C31 H29 Cl Fe N O P Pt -","- C62 H58 Cl2 Fe2 N2 O2 P2 Pt2 -","2","1","","López, Concepción; Pérez, Sonia; Solans, Xavier; Font-Bardía, Mercè; Calvet, Teresa","Influence of the substituent R1 on the reactivity of [(η5-C5H5)Fe{(η5-C5H4)‒CHN‒(R1)‒OH}] {R1 = ‒CH2‒CH2‒ or 1,2-C6H4} with platinum(ii) and on the properties of the complexes","New Journal of Chemistry","2010","34","4","676","","10.1039/b9nj00509a","","","0.71073","MoKα","","0.1426","0.0611","","","0.1027","0.116","","","","","","0.843","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053346","12.779","0.001","19.042","0.002","19.653","0.001","62.541","0.007","78.889","0.006","70.056","0.007","3985.4","0.6","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C76 H66 Cl4 F6 Ir N10 P -","- C76 H66 Cl4 F6 Ir N10 P -","- C152 H132 Cl8 F12 Ir2 N20 P2 -","2","1","","Araya, Juan C.; Gajardo, Juana; Moya, Sergio A.; Aguirre, Pedro; Toupet, Loïc; Williams, J. A. Gareth; Escadeillas, Muriel; Le Bozec, Hubert; Guerchais, Véronique","Modulating the luminescence of an iridium(iii) complex incorporating a di(2-picolyl)anilino-appended bipyridine ligand with Zn2+ cations","New Journal of Chemistry","2010","34","1","21","","10.1039/b9nj00515c","","","0.71069","MoKα","","0.0533","0.0425","","","0.1166","0.1316","","","","","","0.541","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053347","13.786","0.0003","21.2076","0.0004","16.8447","0.0004","90","","92.363","0.001","90","","4920.66","0.18","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C52 H34 N O11 Os3 P2 Re S -","- C52 H34 N O11 Os3 P2 Re S -","- C208 H136 N4 O44 Os12 P8 Re4 S4 -","4","1","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","1.54178","CuKα","","0.0298","0.0266","","","0.0641","0.0656","","","","","","1.02","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053348","8.4909","0.0003","10.1166","0.0009","15.1573","0.0011","70.739","0.005","83.786","0.004","88.325","0.006","1221.87","0.15","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H4 Mn N O13 Os3 S -","- C18 H4 Mn N O13 Os3 S -","- C36 H8 Mn2 N2 O26 Os6 S2 -","2","1","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","0.71073","MoKα","","0.0387","0.0267","","","0.0672","0.0695","","","","","","1.048","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053349","8.5181","0.0003","10.1387","0.0004","15.1751","0.0006","70.434","0.002","83.813","0.003","88.009","0.005","1227.69","0.08","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H4 Mn N O13 Ru3 S -","- C18 H4 Mn N O13 Ru3 S -","- C36 H8 Mn2 N2 O26 Ru6 S2 -","2","1","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","0.71073","MoKα","","0.0335","0.027","","","0.0716","0.0744","","","","","","1.125","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053350","9.4089","0.0001","19.4738","0.0002","15.7618","0.001","90","","92.619","0.001","90","","2884.97","0.19","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H8 N2 O12 Ru4 S -","- C22 H8 N2 O12 Ru4 S -","- C88 H32 N8 O48 Ru16 S4 -","4","1","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","0.71073","MoKα","","0.0506","0.0285","","","0.0567","0.0621","","","","","","1.031","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053351","10.4465","0.0001","15.4234","0.0002","18.4256","0.0002","86.755","0.001","84.108","0.001","88.237","0.001","2947.39","0.06","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H8 Fe2 N2 O13 Re2 S2 -","- C23 H8 Fe2 N2 O13 Re2 S2 -","- C92 H32 Fe8 N8 O52 Re8 S8 -","4","2","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","1.54178","CuKα","","0.0295","0.0275","","","0.0705","0.0715","","","","","","1.095","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053352","9.179","0.0009","19.723","0.002","15.1253","0.0015","90","","91.587","0.008","90","","2737.2","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H8 Fe4 N2 O12 S -","- C22 H8 Fe4 N2 O12 S -","- C88 H32 Fe16 N8 O48 S4 -","4","1","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","0.71073","MoKα","","0.0734","0.0354","","","0.0721","0.0782","","","","","","0.944","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053353","13.1359","0.0013","15.1378","0.0015","18.6633","0.0019","90","","98.3","0.001","90","","3672.3","0.6","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C35 H19 N O12 Os3 P Re S -","- C35 H19 N O12 Os3 P Re S -","- C140 H76 N4 O48 Os12 P4 Re4 S4 -","4","1","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","0.71073","MoKα","","0.0246","0.0195","","","0.043","0.0443","","","","","","1.013","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053354","8.4394","0.0015","10.1739","0.0018","15.109","0.003","70.584","0.002","84.14","0.003","88.119","0.003","1217.1","0.4","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H4 N O13 Os3 Re S -","- C18 H4 N O13 Os3 Re S -","- C36 H8 N2 O26 Os6 Re2 S2 -","2","1","","Ghosh, Shishir; Khanam, Kamrun N.; Hossain, G. M. Golzar; Haworth, Daniel T.; Lindeman, Sergey V.; Hogarth, Graeme; Kabir, Shariff E.","The rational synthesis of tetranuclear heterometallic butterfly clusters: reactions of [M2(CO)6(μ-pyS)2] (M = Re, Mn) with group VIII metal carbonyls","New Journal of Chemistry","2010","34","9","1875","","10.1039/b9nj00526a","","","0.71073","MoKα","","0.0507","0.0467","","","0.1293","0.133","","","","","","1.134","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053355","23.322","0.001","23.322","0.001","12.278","0.001","90","","90","","90","","6678.2","0.7","150","2","150","2","","","","","","","","4","P 42/m n m","-P 4n 2n","136","tetra-n-butylammonium valerate clathrate hydrate","tetra-n-butylammonium valerate clathrate hydrate","","- C21 H124.6 N O41.8 -","- C21 H45 N O41.804 -","- C84 H180 N4 O167.216 -","4","0.25","","Rodionova, Tatyana; Komarov, Vladislav; Lipkowski, Janusz; Kuratieva, Natalia","The structure of the ionic clathrate hydrate of tetrabutylammonium valerate (C4H9)4NC4H9CO2·39.8H2O","New Journal of Chemistry","2010","34","3","432","","10.1039/b9nj00530g","","","0.71073","MoKα","","0.0718","0.0672","","","0.2012","0.2074","","","","","","1.027","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053356","10.1428","0.0003","19.0295","0.0006","17.0312","0.0005","90","","102.607","0.002","90","","3207.98","0.17","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C43 H35 N O2 -","- C43 H35 N O2 -","- C172 H140 N4 O8 -","4","1","","Kurjatschij, Sandra; Seichter, Wilhelm; Weber, Edwin","Synthesis and structures of crystalline solvates formed of pyridinium N-phenoxide (Reichardt's-type) betaine dyes and alcohols","New Journal of Chemistry","2010","34","7","1465","","10.1039/b9nj00540d","","","0.71073","MoKα","","0.0653","0.0471","","","0.131","0.1538","","","","","","1.1","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053357","10.45","0.0007","19.7456","0.0011","16.6334","0.0009","90","","105.934","0.003","90","","3300.3","0.3","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C44 H37 N O2 -","- C44 H37 N O2 -","- C176 H148 N4 O8 -","4","1","","Kurjatschij, Sandra; Seichter, Wilhelm; Weber, Edwin","Synthesis and structures of crystalline solvates formed of pyridinium N-phenoxide (Reichardt's-type) betaine dyes and alcohols","New Journal of Chemistry","2010","34","7","1465","","10.1039/b9nj00540d","","","0.71073","MoKα","","0.099","0.0549","","","0.1402","0.1859","","","","","","1.054","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053358","10.8713","0.0002","16.8352","0.0004","18.9751","0.0004","90","","92.713","0.001","90","","3468.94","0.13","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C45 H41 N O3 -","- C45 H41 N O3 -","- C180 H164 N4 O12 -","4","1","","Kurjatschij, Sandra; Seichter, Wilhelm; Weber, Edwin","Synthesis and structures of crystalline solvates formed of pyridinium N-phenoxide (Reichardt's-type) betaine dyes and alcohols","New Journal of Chemistry","2010","34","7","1465","","10.1039/b9nj00540d","","","0.71073","MoKα","","0.0725","0.0508","","","0.1268","0.1499","","","","","","1.092","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053359","8.8952","0.0002","18.8888","0.0003","21.0329","0.0004","90","","90.084","0.001","90","","3533.94","0.12","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C47 H43 N O2 -","- C47 H43 N O2 -","- C188 H172 N4 O8 -","4","1","","Kurjatschij, Sandra; Seichter, Wilhelm; Weber, Edwin","Synthesis and structures of crystalline solvates formed of pyridinium N-phenoxide (Reichardt's-type) betaine dyes and alcohols","New Journal of Chemistry","2010","34","7","1465","","10.1039/b9nj00540d","","","0.71073","MoKα","","0.0757","0.0495","","","0.1297","0.1623","","","","","","1.07","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053360","11.9196","0.0003","19.0346","0.0004","16.6949","0.0005","90","","98.11","0.001","90","","3749.94","0.17","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C47 H45 N O3 -","- C47 H45 N O3 -","- C188 H180 N4 O12 -","4","1","","Kurjatschij, Sandra; Seichter, Wilhelm; Weber, Edwin","Synthesis and structures of crystalline solvates formed of pyridinium N-phenoxide (Reichardt's-type) betaine dyes and alcohols","New Journal of Chemistry","2010","34","7","1465","","10.1039/b9nj00540d","","","0.71073","MoKα","","0.0781","0.052","","","0.1378","0.1656","","","","","","1.036","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053361","13.26","0.0005","17.3132","0.0006","18.2974","0.0006","90","","104.518","0.002","90","","4066.5","0.3","90","2","90","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H45 N O4 -","- C52 H45 N O4 -","- C208 H180 N4 O16 -","4","1","","Kurjatschij, Sandra; Seichter, Wilhelm; Weber, Edwin","Synthesis and structures of crystalline solvates formed of pyridinium N-phenoxide (Reichardt's-type) betaine dyes and alcohols","New Journal of Chemistry","2010","34","7","1465","","10.1039/b9nj00540d","","","0.71073","MoKα","","0.121","0.0717","","","0.1867","0.2407","","","","","","1.052","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053362","18.822","0.001","18.822","0.001","18.822","0.001","104.15","0.01","104.15","0.01","104.15","0.01","5932.3","0.9","193","2","193","2","","","","","","","","4","R -3 c :R","-P 3* 2n","167","2,6-Di(3-methylphenyl)-4-(2,4,6-triphenyl-1-pyridino)- phenolat-Isopropanol (1:1)","2,6-Di(3-methylphenyl)-4-(2,4,6-triphenyl-1-pyridino)-phenolat- Isopropanol (1:1)","","- C46 H41 N O2 -","- C46 H40 N O2 -","- C276 H240 N6 O12 -","6","0.5","","Kurjatschij, Sandra; Seichter, Wilhelm; Weber, Edwin","Synthesis and structures of crystalline solvates formed of pyridinium N-phenoxide (Reichardt's-type) betaine dyes and alcohols","New Journal of Chemistry","2010","34","7","1465","","10.1039/b9nj00540d","","","1.54178","CuKα","","0.0955","0.0559","","","0.1592","0.1882","","","","","","1.015","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053363","7.273","0.0004","8.8712","0.0005","9.7087","0.0005","81.238","0.001","70.799","0.001","67.737","0.001","547.19","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H9 N3 O2 S -","- C12 H9 N3 O2 S -","- C24 H18 N6 O4 S2 -","2","1","","Semeniuc, Radu F.; Reamer, Thomas J.; Smith, Mark D.","8-Quinoline based ligands and their metallic derivatives: A structural and statistical investigation of quinoline π‒π stacking interactions","New Journal of Chemistry","2010","34","3","439","","10.1039/b9nj00547a","","","0.71073","MoKα","","0.0355","0.0334","","","0.0852","0.0866","","","","","","1.086","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053364","12.7305","0.0006","13.6623","0.0007","16.9108","0.0008","90","","107.898","0.001","90","","2798.9","0.2","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H18 Ag F3 N6 O7 S3 -","- C25 H18 Ag F3 N6 O7 S3 -","- C100 H72 Ag4 F12 N24 O28 S12 -","4","1","","Semeniuc, Radu F.; Reamer, Thomas J.; Smith, Mark D.","8-Quinoline based ligands and their metallic derivatives: A structural and statistical investigation of quinoline π‒π stacking interactions","New Journal of Chemistry","2010","34","3","439","","10.1039/b9nj00547a","","","0.71073","MoKα","","0.0592","0.0364","","","0.0665","0.0729","","","","","","0.908","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053365","25.4562","0.0008","8.5807","0.0003","26.1156","0.0009","90","","93.666","0.001","90","","5692.8","0.3","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C25.5 H21 Ag B F4 N6 O4.5 S2 -","- C25.5 H21 Ag B F4 N6 O4.5 S2 -","- C204 H168 Ag8 B8 F32 N48 O36 S16 -","8","1","","Semeniuc, Radu F.; Reamer, Thomas J.; Smith, Mark D.","8-Quinoline based ligands and their metallic derivatives: A structural and statistical investigation of quinoline π‒π stacking interactions","New Journal of Chemistry","2010","34","3","439","","10.1039/b9nj00547a","","","0.71073","MoKα","","0.038","0.0352","","","0.0927","0.0948","","","","","","1.069","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053366","15.7237","0.0008","15.7237","0.0008","14.9552","0.0016","90","","90","","90","","3697.4","0.5","150","2","150","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C72 H60 Cl4 Cu2 N16 O22 -","- C72 H60 Cl4 Cu2 N16 O22 -","- C144 H120 Cl8 Cu4 N32 O44 -","2","0.125","","Adarsh, N. N.; Tocher, Derek A.; Ribas, Joan; Dastidar, Parthasarathi","Metalla-macro-tricyclic cryptands: anion encapsulation and selective separation of sulfate via in situ crystallization","New Journal of Chemistry","2010","34","11","2458","","10.1039/b9nj00556k","","","0.71073","MoKα","","0.0833","0.0658","","","0.1639","0.1743","","","","","","1.053","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053367","12.874","0.003","13.211","0.003","14.871","0.004","103.703","0.003","99.287","0.003","112.473","0.003","2179.4","0.9","100","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H92 Cu2 N16 O34 S2 -","- C72 H64 Cu2 N16 O24 S2 -","- C72 H64 Cu2 N16 O24 S2 -","1","0.5","","Adarsh, N. N.; Tocher, Derek A.; Ribas, Joan; Dastidar, Parthasarathi","Metalla-macro-tricyclic cryptands: anion encapsulation and selective separation of sulfate via in situ crystallization","New Journal of Chemistry","2010","34","11","2458","","10.1039/b9nj00556k","","","0.71073","MoKα","","0.0577","0.0457","","","0.1207","0.1288","","","","","","0.999","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053368","13.089","0.005","13.512","0.005","14.983","0.009","105.233","0.012","97.716","0.012","113.793","0.008","2251.2","1.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C74 H88 Cu2 F12 N16 O22 Si2 -","- C74 H64 Cu2 F12 N16 O23.12 Si2 -","- C74 H64 Cu2 F12 N16 O23.12 Si2 -","1","0.5","","Adarsh, N. N.; Tocher, Derek A.; Ribas, Joan; Dastidar, Parthasarathi","Metalla-macro-tricyclic cryptands: anion encapsulation and selective separation of sulfate via in situ crystallization","New Journal of Chemistry","2010","34","11","2458","","10.1039/b9nj00556k","","","0.71073","MoKα","","0.0795","0.0568","","","0.1508","0.166","","","","","","1.058","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053369","13.3131","0.0012","21.518","0.003","8.2174","0.001","90","","122.982","0.005","90","","1974.7","0.4","100","2","100","2","","","","","","","","5","C 1 m 1","C -2y","8","","","","- C36 H39.4 Cu N10 O15.7 -","- C36 H29 Cu N10 O13 -","- C72 H58 Cu2 N20 O26 -","2","0.5","","Adarsh, N. N.; Tocher, Derek A.; Ribas, Joan; Dastidar, Parthasarathi","Metalla-macro-tricyclic cryptands: anion encapsulation and selective separation of sulfate via in situ crystallization","New Journal of Chemistry","2010","34","11","2458","","10.1039/b9nj00556k","","","0.71073","MoKα","","0.0574","0.0531","","","0.1273","0.1303","","","","","","1.007","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053370","7.1978","0.0004","16.6218","0.001","20.5689","0.0012","90","","96.226","0.001","90","","2446.4","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Cu N4 O13 S -","- C18 H28 Cu N4 O13 S -","- C72 H112 Cu4 N16 O52 S4 -","4","1","","Adarsh, N. N.; Tocher, Derek A.; Ribas, Joan; Dastidar, Parthasarathi","Metalla-macro-tricyclic cryptands: anion encapsulation and selective separation of sulfate via in situ crystallization","New Journal of Chemistry","2010","34","11","2458","","10.1039/b9nj00556k","","","0.71073","MoKα","","0.0345","0.0273","","","0.0738","0.0779","","","","","","1.056","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053371","7.816","0.005","14.875","0.013","15.196","0.011","63.78","0.03","81.62","0.03","81.61","0.03","1561","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 Ag5 O16 Yb -","- C32 H16 Ag5 O16 Yb -","- C64 H32 Ag10 O32 Yb2 -","2","1","","Jin, Jing; Niu, Shuyun; Han, Qian; Chi, Yuxian","Synthesis and structure of a series of new luminescent Ag‒Ln coordination polymers and the influence of the introduction of an Ag(i) ion on NIR luminescence from the Ln(iii) centre","New Journal of Chemistry","2010","34","6","1176","","10.1039/b9nj00565j","","","0.71073","MoKα","","0.124","0.1043","","","0.2492","0.2639","","","","","","1.057","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053372","7.9028","0.0011","14.954","0.002","15.182","0.002","63.4592","0.0017","81.4312","0.0019","81.2837","0.0017","1579.9","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 Ag5 Eu O16 -","- C32 H16 Ag5 Eu O16 -","- C64 H32 Ag10 Eu2 O32 -","2","1","","Jin, Jing; Niu, Shuyun; Han, Qian; Chi, Yuxian","Synthesis and structure of a series of new luminescent Ag‒Ln coordination polymers and the influence of the introduction of an Ag(i) ion on NIR luminescence from the Ln(iii) centre","New Journal of Chemistry","2010","34","6","1176","","10.1039/b9nj00565j","","","0.71073","MoKα","","0.0481","0.0335","","","0.067","0.0724","","","","","","1.031","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053373","7.8516","0.0016","14.938","0.003","15.208","0.003","63.69","0.03","81.53","0.03","81.41","0.03","1574.4","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 Ag5 Er O16 -","- C32 H16 Ag5 Er O16 -","- C64 H32 Ag10 Er2 O32 -","2","1","","Jin, Jing; Niu, Shuyun; Han, Qian; Chi, Yuxian","Synthesis and structure of a series of new luminescent Ag‒Ln coordination polymers and the influence of the introduction of an Ag(i) ion on NIR luminescence from the Ln(iii) centre","New Journal of Chemistry","2010","34","6","1176","","10.1039/b9nj00565j","","","0.71073","MoKα","","0.0862","0.0632","","","0.1652","0.1843","","","","","","1.073","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053374","7.858","0.005","14.94","0.01","15.211","0.011","63.63","0.03","81.49","0.03","81.38","0.02","1575.2","1.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 Ag5 Ho O16 -","- C32 H16 Ag5 Ho O16 -","- C64 H32 Ag10 Ho2 O32 -","2","1","","Jin, Jing; Niu, Shuyun; Han, Qian; Chi, Yuxian","Synthesis and structure of a series of new luminescent Ag‒Ln coordination polymers and the influence of the introduction of an Ag(i) ion on NIR luminescence from the Ln(iii) centre","New Journal of Chemistry","2010","34","6","1176","","10.1039/b9nj00565j","","","0.71073","MoKα","","0.1","0.0741","","","0.1948","0.2151","","","","","","1.046","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053375","6.265","0.005","12.133","0.005","15.07","0.005","101.754","0.005","96.69","0.005","93.917","0.005","1108.9","1.1","180","","180","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H64 Br2 N2 O4 S2 -","- C42 H64 Br2 N2 O4 S2 -","- C42 H64 Br2 N2 O4 S2 -","1","0.5","","Franc, Grégory; Badetti, Elena; Duhayon, Carine; Coppel, Yannick; Turrin, Cédric-Olivier; Majoral, Jean-Pierre; Sebastián, Rosa-María; Caminade, Anne-Marie","An efficient synthesis combining phosphorus dendrimers and 15-membered triolefinic azamacrocycles: towards the stabilization of platinum nanoparticles","New Journal of Chemistry","2010","34","3","547","","10.1039/b9nj00568d","","","0.71073","MoKα","","0.0576","0.033","","0.0425","0.0377","0.0377","","","","","","1.1095","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053376","9.108","0.002","9.656","0.002","10.017","0.002","103.676","0.006","107.108","0.003","95.654","0.004","804.6","0.3","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H15 N2 P Se -","- C18 H15 N2 P Se -","- C36 H30 N4 P2 Se2 -","2","1","","Hua, Guoxiong; Fuller, Amy L.; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and X-ray structures of new phosphorus‒selenium heterocycles with an E‒P(Se)‒E′ (E, E′ = N, S, Se) linkage","New Journal of Chemistry","2010","34","8","1565","","10.1039/b9nj00570f","","","0.71073","MoKα","","0.0645","0.0478","","","0.0744","0.0818","","","","","","1.002","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053377","9.761","0.003","10.318","0.003","12.94","0.004","112.187","0.01","95.998","0.013","109.128","0.014","1100.6","0.6","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H23 N2 P Se -","- C26 H23 N2 P Se -","- C52 H46 N4 P2 Se2 -","2","1","","Hua, Guoxiong; Fuller, Amy L.; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and X-ray structures of new phosphorus‒selenium heterocycles with an E‒P(Se)‒E′ (E, E′ = N, S, Se) linkage","New Journal of Chemistry","2010","34","8","1565","","10.1039/b9nj00570f","","","0.71073","MoKα","","0.1063","0.0642","","","0.1219","0.1349","","","","","","1.081","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053378","5.3325","0.0007","21.151","0.003","10.6495","0.0015","90","","95.255","0.005","90","","1196.1","0.3","93","2","93","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 N P S Se -","- C12 H10 N P S Se -","- C48 H40 N4 P4 S4 Se4 -","4","1","","Hua, Guoxiong; Fuller, Amy L.; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and X-ray structures of new phosphorus‒selenium heterocycles with an E‒P(Se)‒E′ (E, E′ = N, S, Se) linkage","New Journal of Chemistry","2010","34","8","1565","","10.1039/b9nj00570f","","","0.71073","MoKα","","0.0257","0.0232","","","0.0486","0.0506","","","","","","1.05","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053379","8.5293","0.0006","9.9922","0.0007","18.1201","0.0012","90","","94.3449","0.0013","90","","1539.87","0.18","125.1","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 P S2 Se -","- C16 H11 P S2 Se -","- C64 H44 P4 S8 Se4 -","4","1","","Hua, Guoxiong; Fuller, Amy L.; Li, Yang; Slawin, Alexandra M. Z.; Woollins, J. Derek","Synthesis and X-ray structures of new phosphorus‒selenium heterocycles with an E‒P(Se)‒E′ (E, E′ = N, S, Se) linkage","New Journal of Chemistry","2010","34","8","1565","","10.1039/b9nj00570f","","","0.71075","MoKα","","0.0722","0.0465","","","0.0819","0.0888","","","","","","1.074","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053380","16.9671","0.0012","10.0972","0.0007","25.6043","0.0019","90","","104.276","0.002","90","","4251.1","0.5","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C49 H57 N O8 S -","- C49 H57 N O8 S -","- C196 H228 N4 O32 S4 -","4","2","","Patra, Subrata; Maity, Debdeep; Sen, Anik; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Effect of steric crowding on ion selectivity for calix-crown hybrid ionophores: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2010","34","12","2796","","10.1039/b9nj00587k","","","0.71073","MoKα","","0.0914","0.0649","","","0.1264","0.1367","","","","","","1.076","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053381","14.7394","0.0011","17.0425","0.0013","20.6798","0.0016","74.873","0.003","82.029","0.002","75.019","0.002","4830.1","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H65 N O10 S -","- C53 H65 N O10 S -","- C212 H260 N4 O40 S4 -","4","2","","Patra, Subrata; Maity, Debdeep; Sen, Anik; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Effect of steric crowding on ion selectivity for calix-crown hybrid ionophores: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2010","34","12","2796","","10.1039/b9nj00587k","","","0.71073","MoKα","","0.0813","0.0649","","","0.1755","0.191","","","","","","1.026","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053382","15.3737","0.0015","14.3951","0.0015","27.451","0.003","90","","105.396","0.002","90","","5857.1","1.1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C65 H89 N O8 S -","- C65 H89 N O8 S -","- C260 H356 N4 O32 S4 -","4","1","","Patra, Subrata; Maity, Debdeep; Sen, Anik; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Effect of steric crowding on ion selectivity for calix-crown hybrid ionophores: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2010","34","12","2796","","10.1039/b9nj00587k","","","0.71073","MoKα","","0.1425","0.0953","","","0.1721","0.1895","","","","","","1.168","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053383","17.422","0.002","16.931","0.002","20.781","0.003","90","","110.187","0.002","90","","5753.3","1.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C63 H71 N3 O10 S3 -","- C63 H71 N3 O10 S3 -","- C252 H284 N12 O40 S12 -","4","1","","Patra, Subrata; Maity, Debdeep; Sen, Anik; Suresh, E.; Ganguly, Bishwajit; Paul, Parimal","Effect of steric crowding on ion selectivity for calix-crown hybrid ionophores: experimental, molecular modeling and crystallographic studies","New Journal of Chemistry","2010","34","12","2796","","10.1039/b9nj00587k","","","0.71073","MoKα","","0.1328","0.0998","","","0.1916","0.2051","","","","","","1.197","","","","has coordinates","288193","2023-12-08","17:12:24",""
"7053384","15.838","0.002","13.7249","0.0017","13.4162","0.0017","90","","94.828","0.002","90","","2906","0.6","293","2","293","2","","","","","","","Synthesis","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H13 N2 O4 -","- C17 H13 N2 O4 -","- C136 H104 N16 O32 -","8","1","","Linares, Maholy; Briceño, Alexander","Solid-state synthesis of head-to-tail photodimers from supramolecular assemblies directed by charge-assisted hydrogen bonds","New Journal of Chemistry","2010","34","4","587","","10.1039/b9nj00608g","","","0.7107","MoKα","","0.144","0.081","","","0.2077","0.2438","","","","","","1.059","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053385","7.559","0.004","10.106","0.006","11.41","0.007","104.767","0.01","106.763","0.01","108.177","0.001","733.8","0.7","293","2","293","2","","","","","","","Synthesis","4","P -1","-P 1","2","","","","- C18 H14 N O4 -","- C18 H14 N O4 -","- C36 H28 N2 O8 -","2","1","","Linares, Maholy; Briceño, Alexander","Solid-state synthesis of head-to-tail photodimers from supramolecular assemblies directed by charge-assisted hydrogen bonds","New Journal of Chemistry","2010","34","4","587","","10.1039/b9nj00608g","","","0.71073","MoKα","","0.08","0.0613","","","0.1504","0.1642","","","","","","1.066","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053386","7.4116","0.0015","9.874","0.002","12.082","0.002","66.39","0.03","73.94","0.03","79.39","0.03","775.9","0.3","293","2","293","2","","","","","","","Synthesis","5","P -1","-P 1","2","","","","- C18 H13 Cl N O4 -","- C18 H13 Cl N O4 -","- C36 H26 Cl2 N2 O8 -","2","1","","Linares, Maholy; Briceño, Alexander","Solid-state synthesis of head-to-tail photodimers from supramolecular assemblies directed by charge-assisted hydrogen bonds","New Journal of Chemistry","2010","34","4","587","","10.1039/b9nj00608g","","","0.71073","MoKα","","0.138","0.078","","","0.1496","0.1759","","","","","","1.137","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053387","7.037","0.003","19.262","0.007","11.197","0.005","90","","102.653","0.013","90","","1480.9","1.1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 N O5 -","- C18 H14 N O5 -","- C72 H56 N4 O20 -","4","1","","Linares, Maholy; Briceño, Alexander","Solid-state synthesis of head-to-tail photodimers from supramolecular assemblies directed by charge-assisted hydrogen bonds","New Journal of Chemistry","2010","34","4","587","","10.1039/b9nj00608g","","","0.7107","MoKα","","0.1275","0.0818","","","0.1867","0.2099","","","","","","1.142","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053388","10.786","0.005","9.682","0.004","19.379","0.008","90","","97.802","0.009","90","","2005","1.5","293","2","293","2","","","","","","","Synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H38 Cl2 N2 O10 S2 -","- C40 H38 Cl2 N2 O10 S2 -","- C80 H76 Cl4 N4 O20 S4 -","2","0.5","","Linares, Maholy; Briceño, Alexander","Solid-state synthesis of head-to-tail photodimers from supramolecular assemblies directed by charge-assisted hydrogen bonds","New Journal of Chemistry","2010","34","4","587","","10.1039/b9nj00608g","","","0.7107","MoKα","","0.0877","0.0609","","","0.1486","0.1662","","","","","","1.08","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053389","14.2968","0.0002","36.8876","0.0003","14.6319","0.0002","90","","110.886","0.001","90","","7209.45","0.16","100","2","100","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C119 H170 Gd2 N2 O65 P2 S8 -","- C119 H102 Gd2 N2 O65 P2 S8 -","- C238 H204 Gd4 N4 O130 P4 S16 -","2","0.5","","Ling, Irene; Alias, Yatimah; Sobolev, Alexandre N.; Raston, Colin L.","Multi-component bi-layers featuring [1-octyl-2,3-dimethylimidazolium ∩p-sulfonatocalix[4]arene] supermolecules","New Journal of Chemistry","2010","34","3","414","","10.1039/b9nj00612e","","","0.71073","MoKα","","0.1322","0.0909","","","0.2241","0.2425","","","","","","1.002","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053390","13.245","0.0002","14.6552","0.0003","15.3003","0.0003","103.867","0.002","100.692","0.001","98.878","0.001","2771.1","0.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C41 H71 Gd N2 O29 S4 -","- C41 H70.98 Gd N2 O28.99 S4 -","- C82 H141.96 Gd2 N4 O57.98 S8 -","2","1","","Ling, Irene; Alias, Yatimah; Sobolev, Alexandre N.; Raston, Colin L.","Multi-component bi-layers featuring [1-octyl-2,3-dimethylimidazolium ∩p-sulfonatocalix[4]arene] supermolecules","New Journal of Chemistry","2010","34","3","414","","10.1039/b9nj00612e","","","0.71073","MoKα","","0.0404","0.0323","","","0.0819","0.0836","","","","","","1.005","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053391","15.05","0.002","12.1206","0.0019","15.425","0.002","90","","105.596","0.012","90","","2710.2","0.7","100","2","100","2","","","","","","","","5","P 1 n 1","P -2yac","7","N-(2-oxo-1-((1Z)-1,3,3,3-tetrafluoroprop-1-en-1-yl) -1,2- dihydropyrimidin-4-yl)benzamide","N-{2-oxo-1-[(1Z)-1,3,3,3-tetrafluoroprop-1-en-1-yl] -1,2-dihydropyrimidin-4-yl}benzamide","","- C14 H9 F4 N3 O2 -","- C14 H9 F4 N3 O2 -","- C112 H72 F32 N24 O16 -","8","4","","Wójtowicz-Rajchel, Hanna; Pasikowska, Magda; Olejniczak, Anna; Katrusiak, Andrzej; Koroniak, Henryk","Fluorinated enamines of nucleobases as precursors of nucleoside analogues. Synthesis, spectroscopic and structural studies","New Journal of Chemistry","2010","34","5","894","","10.1039/b9nj00617f","","","0.71073","MoKα","","0.0969","0.0822","","","0.2454","0.2706","","","","","","1.14","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053392","14.1973","0.0002","13.6585","0.0002","14.7835","0.0003","90","","111.938","0.001","90","","2659.14","0.08","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H5 Cl12 N10 P3 -","- C8 H5 Cl12 N10 P3 -","- C32 H20 Cl48 N40 P12 -","4","1","","Saplinova, Tatyana; Lehnert, Christian; Böhme, Uwe; Wagler, Jörg; Kroke, Edwin","Melem- and melamine-derived iminophosphoranes","New Journal of Chemistry","2010","34","9","1893","","10.1039/b9nj00621d","","","0.71073","MoKα","","0.0401","0.0299","","","0.0691","0.0722","","","","","","1.044","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053393","10.2641","0.0007","11.7367","0.0008","15.4861","0.0011","80.333","0.003","80.019","0.003","76.39","0.003","1769.9","0.2","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C3 Cl9 N6 P3 -","- C3 Cl9 N6 P3 -","- C12 Cl36 N24 P12 -","4","2","","Saplinova, Tatyana; Lehnert, Christian; Böhme, Uwe; Wagler, Jörg; Kroke, Edwin","Melem- and melamine-derived iminophosphoranes","New Journal of Chemistry","2010","34","9","1893","","10.1039/b9nj00621d","","","0.71073","MoKα","","0.0368","0.0273","","","0.0625","0.0649","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053394","13.4575","0.0005","20.1036","0.0009","15.6687","0.0006","90","","93.93","0.002","90","","4229.1","0.3","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H38 Br2 Cl2 N6 P2 -","- C45 H38 Br2 Cl2 N6 P2 -","- C180 H152 Br8 Cl8 N24 P8 -","4","1","","Saplinova, Tatyana; Lehnert, Christian; Böhme, Uwe; Wagler, Jörg; Kroke, Edwin","Melem- and melamine-derived iminophosphoranes","New Journal of Chemistry","2010","34","9","1893","","10.1039/b9nj00621d","","","0.71073","MoKα","","0.0735","0.0418","","","0.0992","0.1074","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053395","18.0719","0.0003","18.0719","0.0003","14.7542","0.0006","90","","90","","120","","4173.1","0.2","220","2","220","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C12 H4 Cl11 N10 P3 -","- C11.9999 H3.99996 Cl11 N10 P3 -","- C71.9996 H23.9998 Cl65.9999 N60 P18 -","6","0.333333","","Saplinova, Tatyana; Lehnert, Christian; Böhme, Uwe; Wagler, Jörg; Kroke, Edwin","Melem- and melamine-derived iminophosphoranes","New Journal of Chemistry","2010","34","9","1893","","10.1039/b9nj00621d","","","0.71073","MoKα","","0.0364","0.0296","","","0.0698","0.0734","","","","","","1.053","","","","has coordinates,has disorder","180087","2020-10-21","18:00:00",""
"7053396","16.2023","0.0004","16.2023","0.0004","16.2023","0.0004","90","","90","","90","","4253.34","0.18","150","2","150","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C20 H19 Br0.79 Cl3.21 P -","- C20 H19 Br0.78755 Cl3.21243 P -","- C160 H152 Br6.3004 Cl25.6994 P8 -","8","0.333333","","Saplinova, Tatyana; Lehnert, Christian; Böhme, Uwe; Wagler, Jörg; Kroke, Edwin","Melem- and melamine-derived iminophosphoranes","New Journal of Chemistry","2010","34","9","1893","","10.1039/b9nj00621d","","","0.71073","MoKα","","0.0652","0.027","","","0.0544","0.0637","","","","","","1.024","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7053397","14.0193","0.0005","14.1055","0.0006","15.1516","0.0006","103.179","0.002","96.281","0.002","112.237","0.001","2635.91","0.19","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H55 Br2 Cl3 N7 P2 -","- C54 H55 Br2 Cl3 N7 P2 -","- C108 H110 Br4 Cl6 N14 P4 -","2","1","","Saplinova, Tatyana; Lehnert, Christian; Böhme, Uwe; Wagler, Jörg; Kroke, Edwin","Melem- and melamine-derived iminophosphoranes","New Journal of Chemistry","2010","34","9","1893","","10.1039/b9nj00621d","","","0.71073","MoKα","","0.0628","0.0357","","","0.077","0.0825","","","","","","1.062","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7053398","9.7552","0.0009","15.9976","0.0013","17.384","0.0016","90","","99.527","0.002","90","","2675.5","0.4","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H33 B N2 -","- C34 H33 B N2 -","- C136 H132 B4 N8 -","4","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.1043","0.0487","","","0.1115","0.1414","","","","","","1.016","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053399","6.605","0.0001","15.57","0.0003","11.7069","0.0002","90","","97.551","0.001","90","","1193.5","0.04","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H15 I N2 -","- C11 H15 I N2 -","- C44 H60 I4 N8 -","4","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.0424","0.0286","","","0.0597","0.0626","","","","","","1.05","","","","has coordinates","180087","2020-10-21","18:00:00",""
"7053400","15.4539","0.0012","12.1945","0.0007","15.6621","0.0012","90","","113.353","0.002","90","","2709.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 F6 N2 P -","- C11 H15 F6 N2 P -","- C88 H120 F48 N16 P8 -","8","2","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.2109","0.0878","","","0.2234","0.3527","","","","","","1.012","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053401","11.0219","0.0004","15.3857","0.0005","16.9442","0.0006","90","","90","","90","","2873.39","0.17","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H15 F3 N2 O3 S -","- C12 H15 F3 N2 O3 S -","- C96 H120 F24 N16 O24 S8 -","8","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.0621","0.0364","","","0.0885","0.0963","","","","","","1.074","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053402","9.804","0.0003","9.3589","0.0002","11.3818","0.0003","90","","95.559","0.001","90","","1039.42","0.05","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H32 Cl2 N4 O4 -","- C16 H32 Cl2 N4 O4 -","- C32 H64 Cl4 N8 O8 -","2","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.0538","0.0452","","","0.1184","0.1248","","","","","","1.048","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053403","15.8396","0.0012","7.3779","0.0006","26.074","0.002","90","","92.798","0.002","90","","3043.5","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H19 F6 N2 P -","- C13 H19 F6 N2 P -","- C104 H152 F48 N16 P8 -","8","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.0759","0.0523","","","0.1585","0.1791","","","","","","1.028","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053404","18.62","0.003","16.793","0.002","9.9862","0.0009","90","","90","","90","","3122.5","0.7","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C38 H41 B N2 -","- C38 H41 B N2 -","- C152 H164 B4 N8 -","4","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.0539","0.0357","","","0.0773","0.0843","","","","","","1.013","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053405","7.6986","0.0004","13.1654","0.0008","12.2445","0.0008","90","","98.824","0.002","90","","1226.35","0.13","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H36 I2 N4 -","- C22 H24 I2 N4 -","- C44 H48 I4 N8 -","2","0.5","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.0406","0.0313","","","0.0889","0.0928","","","","","","1.09","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053406","7.4346","0.0002","12.6309","0.0003","24.8045","0.0007","81.599","0.001","88.396","0.001","73.34","0.001","2207.33","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H78 Br2 N4 O3 -","- C40 H62 Br2 N4 O3 -","- C80 H124 Br4 N8 O6 -","2","1","","Dechambenoit, Pierre; Ferlay, Sylvie; Kyritsakas, Nathalie; Hosseini, Mir Wais","Amidinium based ionic liquids","New Journal of Chemistry","2010","34","6","1184","","10.1039/b9nj00625g","","","0.71073","MoKα","","0.0778","0.06","","","0.1898","0.2039","","","","","","1.054","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053407","7.214","0.002","24.228","0.003","12.995","0.003","90","","107.46","0.02","90","","2166.6","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tris((4-methylpiperazin-1-yl)methyl)phosphine","tris((4-methylpiperazin-1-yl)methyl)phosphine","","- C18 H39 N6 P -","- C18 H39 N6 P -","- C72 H156 N24 P4 -","4","1","","Starosta, Radosław; Florek, Magdalena; Król, Jarosław; Puchalska, Małgorzata; Kochel, Andrzej","Copper(i) iodide complexes containing new aliphatic aminophosphine ligands and diimines—luminescent properties and antibacterial activity","New Journal of Chemistry","2010","34","7","1441","","10.1039/b9nj00636b","","","0.71073","MoKα","","0.1409","0.0504","","","0.0979","0.1249","","","","","","0.946","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053408","9.675","0.003","10.196","0.005","23.342","0.004","83.32","0.03","81.16","0.05","63.86","0.04","2039.5","1.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","bis(Iodo-(1,10-phenanthroline-N,N')-(tris(morpholinomethyl)phosphine-P)-copper(I)) bis((mu2-Iodo)-(1,10-phenanthroline-N,N')-copper(I))","bis(Iodo-(1,10-phenanthroline-N,N')-(tris(morpholinomethyl)phosphine-P)-copper(I)) bis((mu2-Iodo)-(1,10-phenanthroline-N,N')-copper(I))","","- C39 H46 Cu2 I2 N7 O3 P -","- C39 H46 Cu2 I2 N7 O3 P -","- C78 H92 Cu4 I4 N14 O6 P2 -","2","1","","Starosta, Radosław; Florek, Magdalena; Król, Jarosław; Puchalska, Małgorzata; Kochel, Andrzej","Copper(I) iodide complexes containing new aliphatic aminophosphine ligands and diimines—luminescent properties and antibacterial activity","New Journal of Chemistry","2010","34","7","1441","","10.1039/b9nj00636b","","","0.71073","MoKα","","0.0619","0.0351","","","0.0713","0.0799","","","","","","0.952","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053409","9.284","0.004","20.925","0.005","10.092","0.003","90","","118.76","0.03","90","","1718.7","1.1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","tris(morpholinomethyl)phosphine","tris(morpholinomethyl)phosphine","","- C15 H30 N3 O3 P -","- C15 H30 N3 O3 P -","- C60 H120 N12 O12 P4 -","4","1","","Starosta, Radosław; Florek, Magdalena; Król, Jarosław; Puchalska, Małgorzata; Kochel, Andrzej","Copper(i) iodide complexes containing new aliphatic aminophosphine ligands and diimines—luminescent properties and antibacterial activity","New Journal of Chemistry","2010","34","7","1441","","10.1039/b9nj00636b","","","0.71073","MoKα","","0.1016","0.0503","","","0.096","0.1115","","","","","","0.947","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053410","12.799","0.003","18.4","0.004","19.828","0.003","64.78","0.04","71.94","0.05","86.62","0.03","4002","2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Iodo-(1,10-phenanthroline-N,N')-(tris((4-methylpiperazin-1-yl)methyl) phosphine-P)-copper(I) toluene solvate","Iodo-(1,10-phenanthroline-N,N')-(tris((4-methylpiperazin-1-yl)methyl) phosphine-P)-copper(I) toluene solvate","","- C37 H55 Cu I N8 P -","- C37 H55 Cu I N8 P -","- C148 H220 Cu4 I4 N32 P4 -","4","2","","Starosta, Radosław; Florek, Magdalena; Król, Jarosław; Puchalska, Małgorzata; Kochel, Andrzej","Copper(I) iodide complexes containing new aliphatic aminophosphine ligands and diimines—luminescent properties and antibacterial activity","New Journal of Chemistry","2010","34","7","1441","","10.1039/b9nj00636b","","","0.71073","MoKα","","0.1518","0.0984","","","0.2529","0.2704","","","","","","1.143","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053411","20.691","0.004","20.691","0.003","9.996","0.005","90","","90","","120","","3706","2","100","2","100","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","tris((4-ethylpiperazin-1-yl)methyl)phosphine","tris((4-ethylpiperazin-1-yl)methyl)phosphine","","- C21 H45 N6 P -","- C21 H45 N6 P -","- C126 H270 N36 P6 -","6","0.333333","","Starosta, Radosław; Florek, Magdalena; Król, Jarosław; Puchalska, Małgorzata; Kochel, Andrzej","Copper(i) iodide complexes containing new aliphatic aminophosphine ligands and diimines—luminescent properties and antibacterial activity","New Journal of Chemistry","2010","34","7","1441","","10.1039/b9nj00636b","","","0.71073","MoKα","","0.0337","0.027","","","0.0612","0.0643","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053412","16.86","0.003","22.734","0.005","23.243","0.005","90","","90","","90","","8909","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C78 H80 N30 Ni6 O13 -","- C78 H80 N30 Ni6 O13 -","- C312 H320 N120 Ni24 O52 -","4","0.5","","Sun, Baiwang; Chen, Xiaodan; Li, Zhongshu; Zhang, Lei; Zhao, Qihua","A novel large Ni-azido circle with tridentate (NNO) Schiff base co-ligands: hexagonal structure and ferromagnetic properties","New Journal of Chemistry","2010","34","2","190","","10.1039/b9nj00646j","","","0.71073","MoKα","","0.0839","0.0558","","","0.1217","0.1314","","","","","","1.099","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053413","77.222","0.015","15.608","0.003","18.684","0.004","90","","96.85","0.03","90","","22359","8","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C60 H76 Li2 N6 -","- C60 H76 Li2 N6 -","- C960 H1216 Li32 N96 -","16","2","","Jenter, Jelena; Roesky, Peter W.","Dimeric complexes of lithium and sodium forming a tetrametallacyclobuta[1,2:1,4:2,3:3,4]tetracyclopentane structure","New Journal of Chemistry","2010","34","8","1541","","10.1039/b9nj00651f","","","0.71073","MoKα","","0.1572","0.091","","","0.2177","0.2499","","","","","","0.995","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053414","11.205","0.002","12.304","0.003","24.047","0.005","83.2","0.03","80.33","0.03","80.59","0.03","3210.1","1.2","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C70.5 H88 N6 Na2 -","- C70.5 H88 N6 Na2 -","- C141 H176 N12 Na4 -","2","1","","Jenter, Jelena; Roesky, Peter W.","Dimeric complexes of lithium and sodium forming a tetrametallacyclobuta[1,2:1,4:2,3:3,4]tetracyclopentane structure","New Journal of Chemistry","2010","34","8","1541","","10.1039/b9nj00651f","","","0.71073","MoKα","","0.1129","0.0699","","","0.1774","0.1976","","","","","","1.003","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053415","14.055","0.004","4.6342","0.0011","16.179","0.004","90","","95.38","0.02","90","","1049.2","0.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H15 O3 P -","- C10 H15 O3 P -","- C40 H60 O12 P4 -","4","1","","Murugavel, Ramaswamy; Singh, Mayank Pratap","One, two, and three methylene phosphonic acid groups (‒CH2PO3H2) on a mesitylene ring: synthesis, characterization and aspects of supramolecular aggregation","New Journal of Chemistry","2010","34","9","1846","","10.1039/b9nj00691e","","","0.71073","MoKα","","0.1591","0.0566","","","0.1112","0.1255","","","","","","0.673","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053416","13.687","0.005","21.666","0.005","7.258","0.005","90","","90","","90","","2152.3","1.8","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H24 O7 P2 -","- C13 H20 O7 P2 -","- C52 H80 O28 P8 -","4","1","","Murugavel, Ramaswamy; Singh, Mayank Pratap","One, two, and three methylene phosphonic acid groups (‒CH2PO3H2) on a mesitylene ring: synthesis, characterization and aspects of supramolecular aggregation","New Journal of Chemistry","2010","34","9","1846","","10.1039/b9nj00691e","","","0.71073","MoKα","","0.1886","0.0977","","","0.2464","0.2652","","","","","","0.756","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053417","9.7623","0.0007","17.876","0.002","10.4978","0.0008","90","","107.936","0.009","90","","1742.9","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H23 O10 P3 -","- C12 H23 O10 P3 -","- C48 H92 O40 P12 -","4","1","","Murugavel, Ramaswamy; Singh, Mayank Pratap","One, two, and three methylene phosphonic acid groups (‒CH2PO3H2) on a mesitylene ring: synthesis, characterization and aspects of supramolecular aggregation","New Journal of Chemistry","2010","34","9","1846","","10.1039/b9nj00691e","","","0.71073","MoKα","","0.0465","0.0368","","","0.1009","0.1055","","","","","","1.136","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053418","11.91","0.001","19.351","0.002","21.617","0.003","90","","90.2","0.01","90","","4982","1","200","","200","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C43 H39.5 F12 N10.5 P2 Ru -","- C43 H39.5 F12 N10.5 P2 Ru -","- C172 H158 F48 N42 P8 Ru4 -","4","1","","Das Adhikary, Sirsendu; Samanta, Tapastaru; Roymahapatra, Gourisankar; Loiseau, Frédérique; Jouvenot, Damien; Giri, Santanab; Chattaraj, Pratim K.; Dinda, Joydev","Synthesis, structure and electrochemical behaviour of Ru(ii)- and Pt(ii)-carbene complexes of the NCN-pincer 1,3-bis(2-pyridylmethyl)-1H-benzimidazolium chloride","New Journal of Chemistry","2010","34","9","1974","","10.1039/b9nj00698b","","","0.71073","MoKα","","0.0632","0.0632","","0.0659","","0.0659","","","1.948","","","1.948","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053419","9.0758","0.0005","9.2281","0.0005","9.3635","0.0005","64.225","0.001","81.697","0.001","70.435","0.001","665.42","0.06","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C30 H34 N4 O5 -","- C30 H34 N4 O5 -","- C30 H34 N4 O5 -","1","1","","Lenev, Denis A.; Lyssenko, Konstantin A.; Kostyanovsky, Remir G.","The chiral drug Albicar: resolution of its racemate via complexation with BINOL","New Journal of Chemistry","2010","34","3","403","","10.1039/b9nj00701f","","","0.71073","MoKα","","0.0329","0.0321","","","0.0856","0.0864","","","","","","1.021","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053420","13.6031","0.0009","8.0726","0.0005","13.6339","0.0009","90","","118.061","0.001","90","","1321.17","0.15","110","2","110","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 N2 O4 -","- C15 H14 N2 O4 -","- C60 H56 N8 O16 -","4","1","","Gibson, Elizabeth A.; Duhme-Klair, Anne-K.; Perutz, Robin N.","Design and synthesis of water soluble (metallo)porphyrins with pendant arms: studies of binding to xanthine oxidase","New Journal of Chemistry","2010","34","6","1125","","10.1039/b9nj00736a","","","0.71073","MoKα","","0.0403","0.0364","","","0.0979","0.1011","","","","","","1.033","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053421","7.8645","0.0004","13.3014","0.0007","16.7157","0.0009","86.066","0.001","88.383","0.001","87.054","0.001","1741.65","0.16","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H32 Ag F3 N4 O7 S -","- C35 H32 Ag F3 N4 O7 S -","- C70 H64 Ag2 F6 N8 O14 S2 -","2","1","","Mayoral, María José; Ovejero, Paloma; Campo, José Antonio; Heras, José Vicente; Torres, María Rosario; Lodeiro, Carlos; Cano, Mercedes","Silver pyrazole complexes with tunable liquid crystals and luminescent properties","New Journal of Chemistry","2010","34","12","2766","","10.1039/b9nj00753a","","","0.71073","MoKα","","0.0961","0.0795","","","0.2428","0.2641","","","","","","1.072","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053422","10.2226","0.0007","21.9026","0.0014","12.9463","0.0009","90","","109.93","0.002","90","","2725.1","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H27 Ag N4 O5 S -","- C27 H27 Ag N4 O5 S -","- C108 H108 Ag4 N16 O20 S4 -","4","1","","Mayoral, María José; Ovejero, Paloma; Campo, José Antonio; Heras, José Vicente; Torres, María Rosario; Lodeiro, Carlos; Cano, Mercedes","Silver pyrazole complexes with tunable liquid crystals and luminescent properties","New Journal of Chemistry","2010","34","12","2766","","10.1039/b9nj00753a","","","0.71073","MoKα","","0.1149","0.0448","","","0.1253","0.1499","","","","","","0.945","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053423","15.533","0.005","12.135","0.002","36.868","0.007","90","","99.88","0.02","90","","6846","3","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28.1 H35.3 Cl4 N6 O3.55 S0.55 -","- C28.1 H30 Cl4 N6 O3.55 S0.55 -","- C224.8 H240 Cl32 N48 O28.4 S4.4 -","8","1","","Kannappan, Ramu; Bucher, Christophe; Saint-Aman, Eric; Moutet, Jean-Claude; Milet, Anne; Oltean, Mircea; Métay, Estelle; Pellet-Rostaing, Stéphane; Lemaire, Marc; Chaix, Carole","Viologen-based redox-switchable anion-binding receptors","New Journal of Chemistry","2010","34","7","1373","","10.1039/b9nj00757a","","","0.71073","MoKα","","0.0899","0.0899","","0.125","","0.125","","","1.984","","","1.984","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7053424","18.43","0.001","9.537","0.003","20.999","0.004","90","","91.64","0.02","90","","3689.4","1.4","200","","200","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H36 I4 N6 O3 S -","- C28.5 H36 I4 N6 O3 S0.5 -","- C114 H144 I16 N24 O12 S2 -","4","0.5","","Kannappan, Ramu; Bucher, Christophe; Saint-Aman, Eric; Moutet, Jean-Claude; Milet, Anne; Oltean, Mircea; Métay, Estelle; Pellet-Rostaing, Stéphane; Lemaire, Marc; Chaix, Carole","Viologen-based redox-switchable anion-binding receptors","New Journal of Chemistry","2010","34","7","1373","","10.1039/b9nj00757a","","","0.71073","MoKα","","0.0365","0.0365","","0.0447","","0.0447","","","1.891","","","1.891","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7053425","23.589","0.004","19.661","0.003","8.559","0.002","90","","90","","90","","3969.5","1.3","293","","293","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C13 H15 F12 N3 O P2 -","- C13 H15 F12 N3 O P2 -","- C104 H120 F96 N24 O8 P16 -","8","1","","Kannappan, Ramu; Bucher, Christophe; Saint-Aman, Eric; Moutet, Jean-Claude; Milet, Anne; Oltean, Mircea; Métay, Estelle; Pellet-Rostaing, Stéphane; Lemaire, Marc; Chaix, Carole","Viologen-based redox-switchable anion-binding receptors","New Journal of Chemistry","2010","34","7","1373","","10.1039/b9nj00757a","","","1.54178","CuKα","","0.0717","0.0717","","0.1152","","0.1152","","","2.001","","","2.001","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7053426","8.79","0.0018","22.9","0.005","10.496","0.002","90","","100.13","0.03","90","","2079.8","0.8","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H17 Cl Ir N2 O P -","- C22 H17 Cl Ir N2 O P -","- C88 H68 Cl4 Ir4 N8 O4 P4 -","4","1","","Beeren, Sophie R.; Dabb, Serin L.; Edwards, Gavin; Smith, Matthew K.; Willis, Anthony C.; Messerle, Barbara A.","Improving intramolecular hydroamination Rh(i) and Ir(i) catalysts through targeted ligand modification","New Journal of Chemistry","2010","34","6","1200","","10.1039/b9nj00759h","","","0.71073","MoKα","","0.0359","0.0256","","","0.06","0.0651","","","","","","0.993","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053427","10.78","0.002","14.674","0.003","14.848","0.003","81.77","0.03","73.3","0.03","76","0.03","2176","0.9","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H49 B Ir N2 P -","- C53 H49 B Ir N2 P -","- C106 H98 B2 Ir2 N4 P2 -","2","1","","Beeren, Sophie R.; Dabb, Serin L.; Edwards, Gavin; Smith, Matthew K.; Willis, Anthony C.; Messerle, Barbara A.","Improving intramolecular hydroamination Rh(i) and Ir(i) catalysts through targeted ligand modification","New Journal of Chemistry","2010","34","6","1200","","10.1039/b9nj00759h","","","0.71073","MoKα","","0.0611","0.0368","","","0.0757","0.0862","","","","","","1.026","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053428","12.002","0.002","11.376","0.002","15.535","0.003","90","","94.51","0.03","90","","2114.5","0.7","200","2","200","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 F3 N2 O4 P Rh S -","- C19 H17 F3 N2 O4 P Rh S -","- C76 H68 F12 N8 O16 P4 Rh4 S4 -","4","1","","Beeren, Sophie R.; Dabb, Serin L.; Edwards, Gavin; Smith, Matthew K.; Willis, Anthony C.; Messerle, Barbara A.","Improving intramolecular hydroamination Rh(i) and Ir(i) catalysts through targeted ligand modification","New Journal of Chemistry","2010","34","6","1200","","10.1039/b9nj00759h","","","0.71073","MoKα","","0.06","0.0371","","","0.0862","0.0985","","","","","","1.005","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053429","9.657","0.0019","10.144","0.002","21.513","0.004","90","","90","","90","","2107.4","0.7","290","2","290","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C22 H17 Cl N2 O P Rh -","- C22 H17 Cl N2 O P Rh -","- C88 H68 Cl4 N8 O4 P4 Rh4 -","4","1","","Beeren, Sophie R.; Dabb, Serin L.; Edwards, Gavin; Smith, Matthew K.; Willis, Anthony C.; Messerle, Barbara A.","Improving intramolecular hydroamination Rh(i) and Ir(i) catalysts through targeted ligand modification","New Journal of Chemistry","2010","34","6","1200","","10.1039/b9nj00759h","","","0.71073","MoKα","","0.0458","0.0288","","","0.0588","0.066","","","","","","0.987","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053430","10.5808","0.0001","20.0102","0.0003","12.2975","0.0002","90","","100.372","0.001","90","","2561.13","0.06","200","","200","","","","","","","","from UNSW","9","P 1 21/c 1","-P 2ybc","14","","","","- C23.5 H18 Cl F3 N2 O4 P Rh S -","- C23.5 H18 Cl F3 N2 O4 P Rh S -","- C94 H72 Cl4 F12 N8 O16 P4 Rh4 S4 -","4","1","","Beeren, Sophie R.; Dabb, Serin L.; Edwards, Gavin; Smith, Matthew K.; Willis, Anthony C.; Messerle, Barbara A.","Improving intramolecular hydroamination Rh(i) and Ir(i) catalysts through targeted ligand modification","New Journal of Chemistry","2010","34","6","1200","","10.1039/b9nj00759h","","","0.71073","MoKα","","0.0495","0.028","","0.0887","0.0665","0.0887","","","","","","0.9769","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053431","7.889","0.0009","9.822","0.0011","10.928","0.0012","87.205","0.004","86.952","0.003","69.015","0.003","789.08","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H40 N4 O10 Zn2 -","- C30 H40 N4 O10 Zn2 -","- C30 H40 N4 O10 Zn2 -","1","0.5","","Khatua, Snehadrinarayan; Kang, Jina; Churchill, David G.","Direct dizinc displacement approach for efficient detection of Cu2+ in aqueous media: acetate versus phenolate bridging platforms","New Journal of Chemistry","2010","34","6","1163","","10.1039/b9nj00770a","","","0.71073","MoKα","","0.0689","0.0444","","","0.1219","0.1525","","","","","","1.049","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053432","25.723","0.001","10.273","0.002","6.031","0.001","90","","90","","90","","1593.7","0.4","173","2","173","2","","","","","","","","6","C m c 21","C 2c -2","36","2-chloro-1,3-bis(perfluorophenyl)imidazolidine-4,5-dione","2-chloro-1,3-bis(perfluorophenyl)imidazolidine-4,5-dione","","- C15 H Cl F10 N2 O2 -","- C15 H Cl F10 N2 O2 -","- C60 H4 Cl4 F40 N8 O8 -","4","0.5","","Hobbs, Matthew G.; Forster, Taryn D.; Borau-Garcia, Javier; Knapp, Chrissy J.; Tuononen, Heikki M.; Roesler, Roland","The influence of electron delocalization upon the stability and structure of potential N-heterocyclic carbene precursors with 1,3-diaryl-imidazolidine-4,5-dione skeletons","New Journal of Chemistry","2010","34","7","1295","","10.1039/b9nj00771g","","","0.71073","MoKα","","0.0563","0.0374","","","0.0774","0.0835","","","","","","1.098","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053433","21.883","0.001","14.616","0.001","21.925","0.001","90","","96.91","0.001","90","","6961.6","0.7","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H46 N4 O5 -","- C42 H46 N4 O5 -","- C336 H368 N32 O40 -","8","1","","Hobbs, Matthew G.; Forster, Taryn D.; Borau-Garcia, Javier; Knapp, Chrissy J.; Tuononen, Heikki M.; Roesler, Roland","The influence of electron delocalization upon the stability and structure of potential N-heterocyclic carbene precursors with 1,3-diaryl-imidazolidine-4,5-dione skeletons","New Journal of Chemistry","2010","34","7","1295","","10.1039/b9nj00771g","","","0.71073","MoKα","","0.0954","0.0579","","","0.1342","0.157","","","","","","1.018","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053434","19.3","0.002","12.239","0.002","11.804","0.001","90","","90","","90","","2788.3","0.6","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C29 H38 N2 O4 -","- C29 H38 N2 O4 -","- C116 H152 N8 O16 -","4","1","","Hobbs, Matthew G.; Forster, Taryn D.; Borau-Garcia, Javier; Knapp, Chrissy J.; Tuononen, Heikki M.; Roesler, Roland","The influence of electron delocalization upon the stability and structure of potential N-heterocyclic carbene precursors with 1,3-diaryl-imidazolidine-4,5-dione skeletons","New Journal of Chemistry","2010","34","7","1295","","10.1039/b9nj00771g","","","0.71073","MoKα","","0.0887","0.0551","","","0.1098","0.1275","","","","","","1.078","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053435","25.917","0.002","9.789","0.001","6.04","0.001","90","","90","","90","","1532.4","0.3","173","2","173","2","","","","","","","","5","C m c 21","C 2c -2","36","2-fluoro-1,3-bis(perfluorophenyl)imidazolidine-4,5-dione","2-fluoro-1,3-bis(perfluorophenyl)imidazolidine-4,5-dione","","- C15 H F11 N2 O2 -","- C15 H F11 N2 O2 -","- C60 H4 F44 N8 O8 -","4","0.5","","Hobbs, Matthew G.; Forster, Taryn D.; Borau-Garcia, Javier; Knapp, Chrissy J.; Tuononen, Heikki M.; Roesler, Roland","The influence of electron delocalization upon the stability and structure of potential N-heterocyclic carbene precursors with 1,3-diaryl-imidazolidine-4,5-dione skeletons","New Journal of Chemistry","2010","34","7","1295","","10.1039/b9nj00771g","","","0.71073","MoKα","","0.0856","0.0587","","","0.0985","0.108","","","","","","1.185","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053436","13.992","0.0009","10.152","0.0014","12.991","0.0015","90","","102.895","0.006","90","","1798.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-methoxy-1,3-bis(2,6-dimethylphenyl)imidazolidine-4,5-dione","2-methoxy-1,3-bis(2,6-dimethylphenyl)imidazolidine-4,5-dione","","- C20 H22 N2 O3 -","- C20 H22 N2 O3 -","- C80 H88 N8 O12 -","4","1","","Hobbs, Matthew G.; Forster, Taryn D.; Borau-Garcia, Javier; Knapp, Chrissy J.; Tuononen, Heikki M.; Roesler, Roland","The influence of electron delocalization upon the stability and structure of potential N-heterocyclic carbene precursors with 1,3-diaryl-imidazolidine-4,5-dione skeletons","New Journal of Chemistry","2010","34","7","1295","","10.1039/b9nj00771g","","","0.71073","MoKα","","0.1031","0.0697","","","0.1638","0.1944","","","","","","1.081","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053437","10.983","0.002","10.056","0.002","12.375","0.003","90","","90","","90","","1366.8","0.5","296","2","296","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C16 H15 N3 -","- C16 H15 N3 -","- C64 H60 N12 -","4","1","","Beyer, Beatrice; Ulbricht, Christoph; Winter, Andreas; Hager, Martin D.; Hoogenboom, Richard; Herzer, Nicole; Baumann, Stefan O.; Kickelbick, Guido; Görls, Helmar; Schubert, Ulrich S.","Unexpected metal-mediated oxidation of hydroxymethyl groups to coordinated carboxylate groups by bis-cyclometalated iridium(iii) centers","New Journal of Chemistry","2010","34","11","2622","","10.1039/b9nj00785g","","","0.71073","MoKα","","0.0515","0.0351","","","0.0911","0.1032","","","","","","1.086","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053438","9.0879","0.0004","9.1648","0.0004","29.408","0.0014","90","","90","","90","","2449.36","0.19","300","2","300","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H13 N3 O -","- C15 H13 N3 O -","- C120 H104 N24 O8 -","8","1","","Beyer, Beatrice; Ulbricht, Christoph; Winter, Andreas; Hager, Martin D.; Hoogenboom, Richard; Herzer, Nicole; Baumann, Stefan O.; Kickelbick, Guido; Görls, Helmar; Schubert, Ulrich S.","Unexpected metal-mediated oxidation of hydroxymethyl groups to coordinated carboxylate groups by bis-cyclometalated iridium(iii) centers","New Journal of Chemistry","2010","34","11","2622","","10.1039/b9nj00785g","","","0.71073","MoKα","","0.056","0.0461","","","0.1254","0.1377","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053439","7.4938","0.0004","8.0177","0.0003","17.8009","0.0011","90","","93.744","0.003","90","","1067.25","0.1","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N3 O -","- C11 H13 N3 O -","- C44 H52 N12 O4 -","4","1","","Beyer, Beatrice; Ulbricht, Christoph; Winter, Andreas; Hager, Martin D.; Hoogenboom, Richard; Herzer, Nicole; Baumann, Stefan O.; Kickelbick, Guido; Görls, Helmar; Schubert, Ulrich S.","Unexpected metal-mediated oxidation of hydroxymethyl groups to coordinated carboxylate groups by bis-cyclometalated iridium(iii) centers","New Journal of Chemistry","2010","34","11","2622","","10.1039/b9nj00785g","","","0.71073","MoKα","","0.0964","0.0546","","","0.1324","0.1537","","","","","","1.037","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053440","19.804","0.004","20.246","0.004","21.28","0.004","90","","98.08","0.02","90","","8448","3","123","2","123","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","(Bis-(mu-2-4-(Diphenylphosphino)methyl-1,2-catecholato)-bis- (mu-2-3-(diphenylphosphino)methyl-hydro-1,2-catecholato)- (dimethylforamide)-yttrium(iii)) chloride dimethylformamide solvate","[Bis-(mu-2-4-(Diphenylphosphino)methyl-1,2-catecholato)-bis-(mu-2-3- (diphenylphosphino)methyl-hydro-1,2-catecholato)-(dimethylforamide)- yttrium(III)] chloride dimethylformamide solvate","","- C88 H90 Cl N4 O12 P4 Pd2 Y -","- C88 H90 Cl N4 O12 P4 Pd2 Y -","- C352 H360 Cl4 N16 O48 P16 Pd8 Y4 -","4","1","","Chikkali, Samir H.; Nieger, Martin; Gudat, Dietrich","Stoichiometry controlled self-assembly of tri- and octa-nuclear palladium‒yttrium complexes","New Journal of Chemistry","2010","34","7","1348","","10.1039/c0nj00020e","","","0.71073","MoKα","","0.134","0.0627","","","0.1002","0.1198","","","","","","1.11","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053441","16.374","0.0002","18.8825","0.0002","20.612","0.0003","67.152","0.001","70.115","0.001","74.181","0.001","5449.58","0.13","100","2","100","2","","","","","","","","8","P -1","-P 1","2","(mu4-hydroxo-octakis-(mu-3-3-(diphenyl)methyl-1,2- catecholato)-tetra-(dimethylformamide)-tetra-yttrium(iii)-tetra- palladium(ii))trichloride dimethylformamide solvate (penta)hydrate","[mu4-hydroxo-octakis-(mu-3-3-(diphenyl)methyl-1,2-catecholato)-tetra- (dimethylformamide)-tetra-yttrium(III)-tetra-palladium(II)]trichloride dimethylformamide solvate (penta)hydrate","","- C200 H243 Cl3 N16 O38 P8 Pd4 Y4 -","- C200 H232 Cl3 N16 O38.001 P8 Pd4 Y4 -","- C200 H232 Cl3 N16 O38.001 P8 Pd4 Y4 -","1","0.5","","Chikkali, Samir H.; Nieger, Martin; Gudat, Dietrich","Stoichiometry controlled self-assembly of tri- and octa-nuclear palladium‒yttrium complexes","New Journal of Chemistry","2010","34","7","1348","","10.1039/c0nj00020e","","","0.71073","MoKα","","0.1049","0.0754","","","0.1931","0.2138","","","","","","1.034","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053442","19.5034","0.0006","8.3637","0.0002","18.1644","0.0006","90","","105.259","0.001","90","","2858.53","0.15","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","BrS2PO","","","- C14 H8 Br O P S2 -","- C14 H8 Br O P S2 -","- C112 H64 Br8 O8 P8 S16 -","8","2","","Durben, Stefan; Linder, Thomas; Baumgartner, Thomas","Dithienophosphole-capped π-conjugated oligomers","New Journal of Chemistry","2010","34","8","1585","","10.1039/c0nj00026d","","","0.7107","MoKα","","0.0698","0.0545","","","0.1514","0.174","","","","","","1.106","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053443","53.017","0.002","14.983","0.0005","19.943","0.0009","90","","100.564","0.003","90","","15573.3","1.1","150","0.1","150","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C61 H127 Li O2 Si12 -","- C61 H127 Li O2 Si12 -","- C488 H1016 Li8 O16 Si96 -","8","1","","Yamaguchi, Torahiko; Ichinohe, Masaaki; Sekiguchi, Akira","Addition of methyllithium to disilyne RSiSiR (R = SiiPr[CH(SiMe3)2]), giving a disilenyllithium, and its unexpected isomerization to a disilacyclopropylsilyllithium","New Journal of Chemistry","2010","34","8","1544","","10.1039/c0nj00027b","","","0.7107","MoKα","","0.1387","0.0632","","","0.1434","0.1738","","","","","","0.907","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053444","8.3832","0.0017","12.547","0.003","13.805","0.003","87.6","0.03","83.31","0.03","85.67","0.03","1437.3","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H42 N2 O2 -","- C36 H42 N2 O2 -","- C72 H84 N4 O4 -","2","1","","Yu, Dingyi; Peng, Tai; Zhang, Hongyu; Bi, Hai; Zhang, Jingying; Wang, Yue","Basket-shaped quinacridone cyclophanes: synthesis, solid-state structures, and properties","New Journal of Chemistry","2010","34","10","2213","","10.1039/c0nj00028k","","","0.71073","MoKα","","0.2037","0.0726","","","0.1643","0.2195","","","","","","0.927","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053445","9.7987","0.0002","10.3575","0.0002","14.5382","0.0003","84.875","0.0006","85.4051","0.0006","71.0572","0.0008","1387.95","0.05","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C30.4 H28.8 B Cl0.8 F4 N P Rh -","- C30.4 H28.8 B Cl0.8 F4 N P Rh -","- C60.8 H57.6 B2 Cl1.6 F8 N2 P2 Rh2 -","2","1","","Carrasco, Ariadna Campos; Pidko, Evgeny A.; Masdeu-Bultó, Anna M.; Lutz, Martin; Spek, Anthony L.; Vogt, Dieter; Müller, Christian","2-(2′-Pyridyl)-4,6-diphenylphosphinine versus 2-(2′-pyridyl)-4,6-diphenylpyridine: an evaluation of their coordination chemistry towards Rh(i)","New Journal of Chemistry","2010","34","8","1547","","10.1039/c0nj00030b","","","0.71073","MoKα","","0.0586","0.0396","","","0.0872","0.0949","","","","","","1.047","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053446","7.4699","0.0007","13.7427","0.0012","24.527","0.002","90","","100.25","0.005","90","","2477.7","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 B F4 N2 Rh -","- C30 H28 B F4 N2 Rh -","- C120 H112 B4 F16 N8 Rh4 -","4","1","","Carrasco, Ariadna Campos; Pidko, Evgeny A.; Masdeu-Bultó, Anna M.; Lutz, Martin; Spek, Anthony L.; Vogt, Dieter; Müller, Christian","2-(2′-Pyridyl)-4,6-diphenylphosphinine versus 2-(2′-pyridyl)-4,6-diphenylpyridine: an evaluation of their coordination chemistry towards Rh(i)","New Journal of Chemistry","2010","34","8","1547","","10.1039/c0nj00030b","","","0.71073","MoKα","","0.0286","0.0232","","","0.055","0.0574","","","","","","1.06","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053447","9.811","0.0001","17.193","0.0003","24.807","0.0005","90","","90","","90","","4184.46","0.12","173","","173","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H13 As F12 O3 -","- C20 H13 As F12 O3 -","- C160 H104 As8 F96 O24 -","8","1","","Jiang, Xin-Dong; Matsukawa, Shiro; Fukuzaki, Yuta; Yamamoto, Yohsuke","Formation of epoxides from pentacoordinated organoarsenic compounds with a β-hydroxyethyl group","New Journal of Chemistry","2010","34","8","1623","","10.1039/c0nj00035c","","","0.71069","MoKα","","0.0462","0.0398","","","0.1146","0.1305","","","","","","1.123","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053448","9.234","0.0001","10.985","0.0002","14.118","0.0004","85.094","0.001","80.621","0.001","66.995","0.001","1300.18","0.05","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H15 As F12 O3 -","- C26 H15 As F12 O3 -","- C52 H30 As2 F24 O6 -","2","1","","Jiang, Xin-Dong; Matsukawa, Shiro; Fukuzaki, Yuta; Yamamoto, Yohsuke","Formation of epoxides from pentacoordinated organoarsenic compounds with a β-hydroxyethyl group","New Journal of Chemistry","2010","34","8","1623","","10.1039/c0nj00035c","","","0.71069","MoKα","","0.0576","0.0505","","","0.1292","0.1446","","","","","","1.178","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053449","40.395","0.0008","12.072","0.0002","26.7","0.0006","90","","93.526","0.001","90","","12995.6","0.4","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H21 As F12 O3 -","- C32 H21 As F12 O3 -","- C512 H336 As16 F192 O48 -","16","2","","Jiang, Xin-Dong; Matsukawa, Shiro; Fukuzaki, Yuta; Yamamoto, Yohsuke","Formation of epoxides from pentacoordinated organoarsenic compounds with a β-hydroxyethyl group","New Journal of Chemistry","2010","34","8","1623","","10.1039/c0nj00035c","","","0.71069","MoKα","","0.0924","0.064","","","0.1789","0.2135","","","","","","1.112","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053450","9.996","0.0001","12.368","0.0002","14.945","0.0003","105.926","0.001","105.845","0.001","103.15","0.001","1615.32","0.05","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H15 As F20 O3 -","- C30 H15 As F20 O3 -","- C60 H30 As2 F40 O6 -","2","1","","Jiang, Xin-Dong; Matsukawa, Shiro; Fukuzaki, Yuta; Yamamoto, Yohsuke","Formation of epoxides from pentacoordinated organoarsenic compounds with a β-hydroxyethyl group","New Journal of Chemistry","2010","34","8","1623","","10.1039/c0nj00035c","","","0.71069","MoKα","","0.0455","0.0381","","","0.1046","0.1215","","","","","","1.145","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053451","39.9674","0.0001","9.583","0.0005","26.4609","0.0006","90","","127.4","0.001","90","","8051.2","0.5","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C37 H23 As Cl2 F20 O3 -","- C37 H23 As Cl2 F20 O3 -","- C296 H184 As8 Cl16 F160 O24 -","8","1","","Jiang, Xin-Dong; Matsukawa, Shiro; Fukuzaki, Yuta; Yamamoto, Yohsuke","Formation of epoxides from pentacoordinated organoarsenic compounds with a β-hydroxyethyl group","New Journal of Chemistry","2010","34","8","1623","","10.1039/c0nj00035c","","","0.71069","MoKα","","0.0889","0.0658","","","0.1789","0.2053","","","","","","1.162","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053452","9.1","0.003","11.571","0.003","9.634","0.003","90","","105.692","0.003","90","","976.6","0.5","173","2","173","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C14 H24 F3 In O8 -","- C14 H24 F3 In O8 -","- C28 H48 F6 In2 O16 -","2","0.5","","Cooper, Benjamin F. T.; Macdonald, Charles L. B.","Alternative syntheses of univalent indium salts including a direct route from indium metal","New Journal of Chemistry","2010","34","8","1551","","10.1039/c0nj00036a","","","0.71073","MoKα","","0.106","0.0552","","","0.0917","0.104","","","","","","0.989","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053453","12.0817","0.0001","19.7073","0.0003","18.584","0.0002","90","","108.699","0.001","90","","4191.25","0.09","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H69 Ca N3 O Si2 -","- C39 H69 Ca N3 O Si2 -","- C156 H276 Ca4 N12 O4 Si8 -","4","1","","Crimmin, Mark R.; Hill, Michael S.; Hitchcock, Peter B.; Mahon, Mary F.","Synthesis of β-diketiminato calcium silylamides and their reactions with triethylaluminium","New Journal of Chemistry","2010","34","8","1572","","10.1039/c0nj00042f","","","0.71073","MoKα","","0.0889","0.0496","","","0.1291","0.1526","","","","","","1.023","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053454","26.9889","0.0011","26.9889","0.0011","11.5798","0.0003","90","","90","","90","","8434.7","0.5","173","2","173","2","","","","","","","synthesis as described","5","P 42/n :2","-P 4bc","86","","","","- C37.5 H65 Ca N3 Si2 -","- C37.5 H65 Ca N3 Si2 -","- C300 H520 Ca8 N24 Si16 -","8","1","","Crimmin, Mark R.; Hill, Michael S.; Hitchcock, Peter B.; Mahon, Mary F.","Synthesis of β-diketiminato calcium silylamides and their reactions with triethylaluminium","New Journal of Chemistry","2010","34","8","1572","","10.1039/c0nj00042f","","x-ray","0.71073","MoKα","","0.1658","0.0807","","","0.1715","0.2088","","","","","","1.028","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053455","11.1238","0.0002","20.7676","0.0004","19.6414","0.0003","90","","98.304","0.001","90","","4489.88","0.14","173","2","173","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H76 Al2 Ca N2 -","- C43 H76 Al2 Ca N2 -","- C172 H304 Al8 Ca4 N8 -","4","1","","Crimmin, Mark R.; Hill, Michael S.; Hitchcock, Peter B.; Mahon, Mary F.","Synthesis of β-diketiminato calcium silylamides and their reactions with triethylaluminium","New Journal of Chemistry","2010","34","8","1572","","10.1039/c0nj00042f","","x-ray","0.71073","MoKα","","0.1256","0.1004","","","0.2539","0.2742","","","","","","1.06","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053456","14.862","0.002","5.888","0.002","18.1","0.003","90","","93.09","0.01","90","","1581.6","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H12 O S2 -","- C21 H12 O S2 -","- C84 H48 O4 S8 -","4","1","","Porzio, William; Destri, Silvia; Pasini, Mariacecilia; Giovanella, Umberto; Ragazzi, Massimo; Scavia, Guido; Kotowski, Dariusz; Zotti, Gianni; Vercelli, Barbara","Synthesis and characterisation of fluorenone‒thiophene-based donor‒acceptor oligomers: role of moiety sequence upon packing and electronic properties","New Journal of Chemistry","2010","34","9","1961","","10.1039/c0nj00045k","","","0.71073","MoKα","","0.2126","0.0564","","0.1853","0.1357","","","","1.007","1.185","1.185","","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053457","9.6724","0.0011","8.4355","0.001","29.307","0.003","90","","96.981","0.002","90","","2373.5","0.5","123","","123","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H35 B12 N3 -","- C15 H35 B12 N3 -","- C60 H140 B48 N12 -","4","1","","El-Zaria, Mohamed E.; Genady, Afaf R.; Nakamura, Hiroyuki","Synthesis of triazolyl methyl-substituted amino- and oxy-undecahydrododecaborates for potential application in boron neutron capture therapy","New Journal of Chemistry","2010","34","8","1612","","10.1039/c0nj00046a","","","0.71073","MoKα","","0.0727","0.0494","","","0.1134","0.1233","","","","","","1.027","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053458","16.5356","0.0012","18.6466","0.0014","29.656","0.002","90","","90","","90","","9143.9","1.1","123","","123","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C35 H86 B12 N O -","- C35 H86 B12 N2 O -","- C280 H688 B96 N16 O8 -","8","1","","El-Zaria, Mohamed E.; Genady, Afaf R.; Nakamura, Hiroyuki","Synthesis of triazolyl methyl-substituted amino- and oxy-undecahydrododecaborates for potential application in boron neutron capture therapy","New Journal of Chemistry","2010","34","8","1612","","10.1039/c0nj00046a","","","0.71073","MoKα","","0.1322","0.0927","","","0.1717","0.1905","","","","","","1.049","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053459","16.2568","0.0003","9.5968","0.0002","11.0282","0.0002","90","","118.958","0.001","90","","1505.43","0.05","153","2","153","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 Ge -","- C18 H16 Ge -","- C72 H64 Ge4 -","4","0.5","","Uhl, Werner; Rohling, Martina; Kösters, Jutta","Hydroalumination of dialkynylgermanes—synthesis of alkenyl‒alkynylgermanes with intramolecular aluminium‒carbon interactions","New Journal of Chemistry","2010","34","8","1630","","10.1039/c0nj00050g","","","1.54184","CuKα","","0.028","0.0266","","","0.0716","0.0728","","","","","","1.058","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053460","11.8818","0.0002","17.637","0.0003","23.273","0.0003","74.141","0.001","81.102","0.001","79.039","0.001","4578.53","0.13","243","2","243","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H59 Al Ge Si4 -","- C42 H59 Al Ge Si4 -","- C168 H236 Al4 Ge4 Si16 -","4","2","","Uhl, Werner; Rohling, Martina; Kösters, Jutta","Hydroalumination of dialkynylgermanes—synthesis of alkenyl‒alkynylgermanes with intramolecular aluminium‒carbon interactions","New Journal of Chemistry","2010","34","8","1630","","10.1039/c0nj00050g","","","1.54184","CuKα","","0.0886","0.076","","","0.199","0.2104","","","","","","1.24","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053461","11.0026","0.0002","13.7703","0.0002","33.8233","0.0005","90","","90","","90","","5124.54","0.14","153","2","153","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H35 Al Ge -","- C26 H35 Al Ge -","- C208 H280 Al8 Ge8 -","8","2","","Uhl, Werner; Rohling, Martina; Kösters, Jutta","Hydroalumination of dialkynylgermanes—synthesis of alkenyl‒alkynylgermanes with intramolecular aluminium‒carbon interactions","New Journal of Chemistry","2010","34","8","1630","","10.1039/c0nj00050g","","","1.54184","CuKα","","0.0269","0.0261","","","0.0681","0.0686","","","","","","1.037","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053462","8.4449","0.0003","9.9162","0.0004","20.1186","0.0007","87.777","0.002","87.692","0.002","66.821","0.002","1547.02","0.1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H39 Al Ge -","- C36 H39 Al Ge -","- C72 H78 Al2 Ge2 -","2","1","","Uhl, Werner; Rohling, Martina; Kösters, Jutta","Hydroalumination of dialkynylgermanes—synthesis of alkenyl‒alkynylgermanes with intramolecular aluminium‒carbon interactions","New Journal of Chemistry","2010","34","8","1630","","10.1039/c0nj00050g","","","1.54178","CuKα","","0.0413","0.0362","","","0.0954","0.0996","","","","","","1.045","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053463","10.0303","0.0002","30.7031","0.0005","10.9998","0.0002","90","","98.733","0.001","90","","3348.24","0.11","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H43 Al Ge -","- C38 H43 Al Ge -","- C152 H172 Al4 Ge4 -","4","1","","Uhl, Werner; Rohling, Martina; Kösters, Jutta","Hydroalumination of dialkynylgermanes—synthesis of alkenyl‒alkynylgermanes with intramolecular aluminium‒carbon interactions","New Journal of Chemistry","2010","34","8","1630","","10.1039/c0nj00050g","","","1.54184","CuKα","","0.0363","0.033","","","0.0863","0.0884","","","","","","1.027","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053464","12.3334","0.0003","12.9518","0.0004","17.4667","0.0005","107.738","0.001","97.2601","0.001","93.3283","0.0016","2622.37","0.13","103","2","103","2","","","","","","","","5","P -1","-P 1","2","biferrocenyldiphosphene","","","- C47 H76 Fe2 P2 Si6 -","- C47 H76 Fe2 P2 Si6 -","- C94 H152 Fe4 P4 Si12 -","2","1","","Sasamori, Takahiro; Hori, Akimi; Kaneko, Yoshikazu; Tokitoh, Norihiro","Synthesis, structures and properties of biferrocenyl- and ruthenocenyl-substituted diphosphenes","New Journal of Chemistry","2010","34","8","1560","","10.1039/c0nj00062k","","","0.71069","MoKα","","0.0688","0.0365","","","0.0612","0.0669","","","","","","1.014","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053465","9.6151","0.0001","10.6365","0.0002","24.852","0.0004","97.9195","0.0007","96.8663","0.0006","110.167","0.0008","2324.61","0.06","103","2","103","2","","","","","","","","5","P -1","-P 1","2","ruthenocenyldiphosphene","","","- C37 H68 P2 Ru Si6 -","- C37 H68 P2 Ru Si6 -","- C74 H136 P4 Ru2 Si12 -","2","1","","Sasamori, Takahiro; Hori, Akimi; Kaneko, Yoshikazu; Tokitoh, Norihiro","Synthesis, structures and properties of biferrocenyl- and ruthenocenyl-substituted diphosphenes","New Journal of Chemistry","2010","34","8","1560","","10.1039/c0nj00062k","","","0.71069","MoKα","","0.0332","0.0297","","","0.076","0.0784","","","","","","1.052","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053471","7.3067","0.0006","8.9226","0.0008","9.7407","0.0008","76.265","0.002","88.597","0.002","70.435","0.002","580.21","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H21 Cu N7 O3 S2 -","- C19 H14 Cu N7 O3 S2 -","- C19 H14 Cu N7 O3 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0645","0.0633","","","0.1642","0.1647","","","","","","1.314","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053472","8.899","0.004","9.728","0.004","12.736","0.006","77.685","0.014","71.179","0.012","68.753","0.013","966.8","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H42 Cu N10 O6 S2 -","- C28 H42 Cu N10 O6 S2 -","- C28 H42 Cu N10 O6 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0935","0.0707","","","0.2204","0.2363","","","","","","1.137","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053473","7.474","0.003","9.371","0.003","10.441","0.004","80.422","0.01","89.867","0.01","76.38","0.01","700.3","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H32 Cu N8 O4 S2 -","- C24 H32 Cu N8 O4 S2 -","- C24 H32 Cu N8 O4 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0432","0.0353","","","0.1004","0.1035","","","","","","1.049","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053474","7.808","0.003","8.946","0.003","10.837","0.006","102.017","0.014","104.357","0.015","111.247","0.01","645.2","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H26 Cu N6 O6 S2 -","- C20 H22 Cu N6 O6 S2 -","- C20 H22 Cu N6 O6 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.055","0.0424","","","0.1138","0.1286","","","","","","1.038","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053475","13.243","0.003","14.68","0.003","9.1658","0.0018","90","","109.618","0.006","90","","1678.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H44 Cu N8 O6 S2 -","- C24 H26 Cu N6 O4 S2 -","- C48 H52 Cu2 N12 O8 S4 -","2","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.1211","0.0612","","","0.1439","0.1656","","","","","","0.918","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053476","10.069","0.003","14.339","0.003","14.469","0.004","75.382","0.007","85.836","0.007","76.313","0.007","1963.8","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H42 Cu N10 O6 S2 -","- C32 H42 Cu N10 O6 S2 -","- C64 H84 Cu2 N20 O12 S4 -","2","1","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0829","0.0583","","","0.1734","0.1866","","","","","","1.227","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053477","7.4123","0.0004","10.5479","0.0006","14.0519","0.0008","83.276","0.002","75.937","0.002","89.908","0.002","1057.97","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H50 Cu N8 O4 S2 -","- C42 H50 Cu N8 O4 S2 -","- C42 H50 Cu N8 O4 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0539","0.0458","","","0.1361","0.1401","","","","","","1.031","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053478","7.4307","0.0003","10.5364","0.0004","14.0517","0.0005","91.139","0.001","103.47","0.001","91.626","0.001","1069.06","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H50 Cu N8 O4 S2 -","- C40 H36 Cu N8 O4 S2 -","- C40 H36 Cu N8 O4 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0499","0.0418","","","0.1231","0.1307","","","","","","0.827","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053479","7.4296","0.0013","10.7026","0.0019","14.433","0.003","105.255","0.005","100.958","0.006","90.074","0.005","1085.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H50 Cu N8 O4 S2 -","- C44 H50 Cu N8 O4 S2 -","- C44 H50 Cu N8 O4 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0917","0.0738","","","0.1978","0.2044","","","","","","1.405","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053480","11.099","0.003","12.396","0.003","13.677","0.003","95.279","0.007","98.762","0.007","111.365","0.007","1709.6","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H33 Cu N9 O6 S2 -","- C28 H33 Cu N9 O6 S2 -","- C56 H66 Cu2 N18 O12 S4 -","2","1","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.1459","0.086","","","0.2138","0.2407","","","","","","0.944","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053481","7.3122","0.0017","9.953","0.002","12.917","0.003","99.909","0.006","105.708","0.006","110.183","0.006","811.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H28 Cu N8 O6 S2 -","- C30 H28 Cu N8 O6 S2 -","- C30 H28 Cu N8 O6 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0362","0.0324","","","0.0937","0.096","","","","","","1.067","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053482","9.8451","0.0013","14.9205","0.0019","22.721","0.003","90","","97.076","0.004","90","","3312.2","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H72 Cu N10 O6 S2 -","- C72 H72 Cu N10 O6 S2 -","- C144 H144 Cu2 N20 O12 S4 -","2","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0817","0.0478","","","0.1155","0.1356","","","","","","1.023","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053483","8.1263","0.0013","10.0055","0.0017","15.295","0.003","73.118","0.004","87.475","0.004","87.115","0.004","1187.9","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H38 Cu N12 O8 S2 -","- C50 H38 Cu N12 O8 S2 -","- C50 H38 Cu N12 O8 S2 -","1","0.5","","Rajput, Lalit; Biradha, Kumar","Assembling coordination networks of bis-amido pyridines via hydrogen bonds: isostructurality and large hydrophobic cavities for guest inclusion","New Journal of Chemistry","2010","34","11","2415","","10.1039/c0nj00070a","","","0.71073","MoKα","","0.0466","0.0381","","","0.1007","0.1056","","","","","","0.957","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053484","10.1551","0.0012","19.124","0.002","15.2374","0.0018","90","","90","","90","","2959.2","0.6","120","2","120","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C32 H36 N4 O6 Zn2 -","- C32 H36 N4 O6 Zn2 -","- C128 H144 N16 O24 Zn8 -","4","1","","García-Deibe, Ana M.; Fondo, Matilde; Ocampo, Noelia; Sanmartín, Jesús; Gómez-Fórneas, Esther","Design of chiral homodinuclear complexes based on the coordinating behaviour of some symmetric ligands","New Journal of Chemistry","2010","34","6","1073","","10.1039/c0nj00071j","","","0.71073","MoKα","","0.0368","0.0269","","","0.0561","0.0604","","","","","","1.074","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7053485","12.0335","0.0017","11.6409","0.0016","27.861","0.004","90","","94.4","0.002","90","","3891.3","0.9","120","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H40 Br3 N5 O7 Zn2 -","- C35 H40 Br3 N5 O7 Zn2 -","- C140 H160 Br12 N20 O28 Zn8 -","4","1","","García-Deibe, Ana M.; Fondo, Matilde; Ocampo, Noelia; Sanmartín, Jesús; Gómez-Fórneas, Esther","Design of chiral homodinuclear complexes based on the coordinating behaviour of some symmetric ligands","New Journal of Chemistry","2010","34","6","1073","","10.1039/c0nj00071j","","","0.71073","MoKα","","0.0736","0.0445","","","0.0859","0.0965","","","","","","1.06","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053486","9.7803","0.0006","18.3376","0.0012","16.0545","0.0011","90","","101.608","0.001","90","","2820.4","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H32 F6 N3 O5 P -","- C26 H32 F6 N3 O5 P -","- C104 H128 F24 N12 O20 P4 -","4","1","","Park, Ki-Min; Kim, Hyun Jee; Moon, Suk-Hee; Vittal, Jagadese J.; Jung, Jong Hwa; Lee, Shim Sung","Surprisingly stable ammonium ion complex of a non-cyclic crown-type polyether: solid and solution studies","New Journal of Chemistry","2010","34","4","603","","10.1039/c0nj00074d","","","0.71073","MoKα","","0.0826","0.0537","","","0.1501","0.1706","","","","","","1.041","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053487","11.4705","0.0014","21.891","0.003","30.387","0.004","90","","90","","90","","7630.2","1.7","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","04357","","","- C49 H113 Ba2 K O Si10 -","- C49 H113 Ba2 K O Si10 -","- C196 H452 Ba8 K4 O4 Si40 -","4","1","","Quisenberry, Keith T.; White, Rosemary E.; Hanusa, Timothy P.; Brennessel, William W.","Allyl complexes of the heavy alkaline-earth metals: molecular structure and catalytic behavior","New Journal of Chemistry","2010","34","8","1579","","10.1039/c0nj00084a","","","0.71073","MoKα","","0.045","0.0349","","","0.0819","0.0882","","","","","","1.031","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053488","14.901","0.0008","14.901","0.0008","16.825","0.002","90","","90","","90","","3735.8","0.5","173","2","173","2","","","","","","","","5","P 42/n :2","-P 4bc","86","04227","","","- C26 H58 O2 Si4 Sr -","- C26 H58 O2 Si4 Sr -","- C104 H232 O8 Si16 Sr4 -","4","0.5","","Quisenberry, Keith T.; White, Rosemary E.; Hanusa, Timothy P.; Brennessel, William W.","Allyl complexes of the heavy alkaline-earth metals: molecular structure and catalytic behavior","New Journal of Chemistry","2010","34","8","1579","","10.1039/c0nj00084a","","","0.71073","MoKα","","0.066","0.0419","","","0.1067","0.1243","","","","","","1.031","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053489","10.2332","0.0002","11.2688","0.0002","17.574","0.0004","88.139","0.001","89.748","0.001","77.463","0.001","1977.19","0.07","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H62 Li4 N4 O7 Si -","- C34 H62 Li4 N4 O7 Si -","- C68 H124 Li8 N8 O14 Si2 -","2","1","","Andrews, Philip C.; Bull, Steven D.; Koutsaplis, Magdaline","Homo- and heteroanionic alkali metal aza-enolate aggregates derived from o-methylvalerolactim ether","New Journal of Chemistry","2010","34","8","1678","","10.1039/c0nj00088d","","","0.71073","MoKα","","0.0855","0.0591","","","0.1386","0.156","","","","","","1.032","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053490","10.061","0.002","14.802","0.003","17.141","0.003","90","","90.52","0.03","90","","2552.6","0.9","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H88 Li4 N10 O4 -","- C42 H88 Li4 N10 O4 -","- C84 H176 Li8 N20 O8 -","2","0.5","","Andrews, Philip C.; Bull, Steven D.; Koutsaplis, Magdaline","Homo- and heteroanionic alkali metal aza-enolate aggregates derived from o-methylvalerolactim ether","New Journal of Chemistry","2010","34","8","1678","","10.1039/c0nj00088d","","","0.71073","MoKα","","0.1393","0.0719","","","0.1732","0.2035","","","","","","1.025","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053491","10.745","0.002","11.472","0.002","12.207","0.002","69.4","0.03","64.82","0.03","82.48","0.03","1274.3","0.6","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H70 Li8 N8 O7 -","- C46 H70 Li8 N8 O7 -","- C46 H70 Li8 N8 O7 -","1","0.5","","Andrews, Philip C.; Bull, Steven D.; Koutsaplis, Magdaline","Homo- and heteroanionic alkali metal aza-enolate aggregates derived from o-methylvalerolactim ether","New Journal of Chemistry","2010","34","8","1678","","10.1039/c0nj00088d","","","0.71073","MoKα","","0.0989","0.0703","","","0.1709","0.1916","","","","","","1.027","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053492","20.235","0.004","15.067","0.003","18.853","0.004","90","","109.41","0.03","90","","5421","2","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C44 H92 Li6 N8 O6 -","- C44 H92 Li6 N8 O6 -","- C176 H368 Li24 N32 O24 -","4","0.5","","Andrews, Philip C.; Bull, Steven D.; Koutsaplis, Magdaline","Homo- and heteroanionic alkali metal aza-enolate aggregates derived from o-methylvalerolactim ether","New Journal of Chemistry","2010","34","8","1678","","10.1039/c0nj00088d","","","0.71073","MoKα","","0.0787","0.0519","","","0.129","0.146","","","","","","1.036","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053493","10.32","0.002","19.468","0.004","15.943","0.003","90","","107.89","0.03","90","","3048.2","1.2","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H52 N6 Na2 O2 -","- C24 H52 N6 Na2 O2 -","- C96 H208 N24 Na8 O8 -","4","1","","Andrews, Philip C.; Bull, Steven D.; Koutsaplis, Magdaline","Homo- and heteroanionic alkali metal aza-enolate aggregates derived from o-methylvalerolactim ether","New Journal of Chemistry","2010","34","8","1678","","10.1039/c0nj00088d","","","0.71073","MoKα","","0.0842","0.0667","","","0.182","0.1976","","","","","","1.04","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053494","19.661","0.004","21.434","0.004","17.18","0.003","90","","90","","90","","7240","2","123","2","123","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C52 H116 K4 Li4 N12 O8 -","- C52 H116 K4 Li4 N12 O8 -","- C208 H464 K16 Li16 N48 O32 -","4","0.5","","Andrews, Philip C.; Bull, Steven D.; Koutsaplis, Magdaline","Homo- and heteroanionic alkali metal aza-enolate aggregates derived from o-methylvalerolactim ether","New Journal of Chemistry","2010","34","8","1678","","10.1039/c0nj00088d","","","0.71073","MoKα","","0.1375","0.0802","","","0.2073","0.2471","","","","","","1.036","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053495","10.642","0.002","25.648","0.005","9.4569","0.0019","90","","97.89","0.03","90","","2556.8","0.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","(Ag(L))OTf","","","- C23 H26 Ag F3 N4 O5 S -","- C23 H26 Ag F3 N4 O5 S -","- C92 H104 Ag4 F12 N16 O20 S4 -","4","1","","Huang, Yong-Qing; Liu, Guang-Xiang; Zhou, Xia-Ying; Okamura, Taka-aki; Su, Zhi; Fan, Jian; Sun, Wei-Yin; Yu, Jin-Quan; Ueyama, Norikazu","Syntheses, crystal structures and properties of silver(i) and copper(ii) complexes with an oxazoline-containing tetradentate ligand","New Journal of Chemistry","2010","34","11","2436","","10.1039/c0nj00092b","","","0.71073","MoKα","","0.0852","0.0697","","","0.1867","0.2026","","","","","","1.025","","","","has coordinates,has disorder","180088","2020-10-21","18:00:00",""
"7053496","17.0542","0.0011","7.8076","0.0005","18.7729","0.0012","90","","95.793","0.001","90","","2486.9","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 Ag F3 N4 O5 S -","- C23 H26 Ag F3 N4 O5 S -","- C92 H104 Ag4 F12 N16 O20 S4 -","4","1","","Huang, Yong-Qing; Liu, Guang-Xiang; Zhou, Xia-Ying; Okamura, Taka-aki; Su, Zhi; Fan, Jian; Sun, Wei-Yin; Yu, Jin-Quan; Ueyama, Norikazu","Syntheses, crystal structures and properties of silver(i) and copper(ii) complexes with an oxazoline-containing tetradentate ligand","New Journal of Chemistry","2010","34","11","2436","","10.1039/c0nj00092b","","","0.71073","MoKα","","0.085","0.0631","","","0.1544","0.1668","","","","","","1.053","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053497","5.5352","0.0007","11.4453","0.0014","22.023","0.003","82.72","0.002","83.933","0.002","87.015","0.002","1375.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H64 Ag2 N14 O18 -","- C48 H52 Ag2 N14 O18 -","- C48 H52 Ag2 N14 O18 -","1","0.5","","Huang, Yong-Qing; Liu, Guang-Xiang; Zhou, Xia-Ying; Okamura, Taka-aki; Su, Zhi; Fan, Jian; Sun, Wei-Yin; Yu, Jin-Quan; Ueyama, Norikazu","Syntheses, crystal structures and properties of silver(i) and copper(ii) complexes with an oxazoline-containing tetradentate ligand","New Journal of Chemistry","2010","34","11","2436","","10.1039/c0nj00092b","","","0.71073","MoKα","","0.1015","0.0777","","","0.2188","0.2367","","","","","","1.024","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053498","14.0161","0.0008","8.7983","0.0005","40.648","0.002","90","","98.399","0.001","90","","4958.9","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H56 Ag2 N10 O11 -","- C45 H52 Ag2 N10 O11 -","- C180 H208 Ag8 N40 O44 -","4","0.5","","Huang, Yong-Qing; Liu, Guang-Xiang; Zhou, Xia-Ying; Okamura, Taka-aki; Su, Zhi; Fan, Jian; Sun, Wei-Yin; Yu, Jin-Quan; Ueyama, Norikazu","Syntheses, crystal structures and properties of silver(i) and copper(ii) complexes with an oxazoline-containing tetradentate ligand","New Journal of Chemistry","2010","34","11","2436","","10.1039/c0nj00092b","","","0.71073","MoKα","","0.0801","0.0728","","","0.1654","0.1695","","","","","","1.222","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053499","15.25","0.009","8.2253","0.0005","39.011","0.002","90","","100.425","0.001","90","","4813","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H26 Ag B F4 N4 O2 -","- C22 H26 Ag B F4 N4 O2 -","- C176 H208 Ag8 B8 F32 N32 O16 -","8","1","","Huang, Yong-Qing; Liu, Guang-Xiang; Zhou, Xia-Ying; Okamura, Taka-aki; Su, Zhi; Fan, Jian; Sun, Wei-Yin; Yu, Jin-Quan; Ueyama, Norikazu","Syntheses, crystal structures and properties of silver(i) and copper(ii) complexes with an oxazoline-containing tetradentate ligand","New Journal of Chemistry","2010","34","11","2436","","10.1039/c0nj00092b","","","0.71073","MoKα","","0.0703","0.0614","","","0.1578","0.1638","","","","","","1.137","","","","has coordinates","180088","2020-10-21","18:00:00",""
"7053500","13.3839","0.0019","15.715","0.002","26.095","0.004","90","","94.42","0.005","90","","5472.2","1.3","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(Cu4(L)2(OCH3)2(OH)2)(NO3)2-0.32(H2O)","[Cu4(L)2(OCH3)2(OH)2](NO3)2-0.32(H2O)","","- C46 H60.64 Cu4 N12 O20.63 -","- C46 H58 Cu4 N12 O20.3155 -","- C184 H232 Cu16 N48 O81.262 -","4","1","","Huang, Yong-Qing; Liu, Guang-Xiang; Zhou, Xia-Ying; Okamura, Taka-aki; Su, Zhi; Fan, Jian; Sun, Wei-Yin; Yu, Jin-Quan; Ueyama, Norikazu","Syntheses, crystal structures and properties of silver(i) and copper(ii) complexes with an oxazoline-containing tetradentate ligand","New Journal of Chemistry","2010","34","11","2436","","10.1039/c0nj00092b","","","0.71075","MoKα","","0.093","0.073","","","0.1795","0.1904","","","","","","1.098","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053501","5.795","0.005","15.097","0.005","10.982","0.005","90","0.005","99.368","0.005","90","0.005","948","1","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C30 H16 N2 -","- C30 H16 N2 -","- C60 H32 N4 -","2","1","","Niebel, Claude; Lokshin, Vladimir; Ben-Asuly, Amos; Marine, Wladimir; Karapetyan, Artak; Khodorkovsky, Vladimir","Dibenzo[2,3:5,6]pyrrolizino[1,7-bc]indolo[1,2,3-lm]carbazole: a new electron donor","New Journal of Chemistry","2010","34","7","1243","","10.1039/c0nj00100g","","","0.71073","MoKα","","0.1067","0.085","","","0.1975","0.216","","","","","","1.112","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7053502","12.555","0.0002","15.352","0.0002","20.174","0.0004","75.303","0.001","74.156","0.001","67.192","0.001","3399.93","0.1","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H98 Cr2 N10 O2 -","- C66 H98 Cr2 N10 O2 -","- C132 H196 Cr4 N20 O4 -","2","1","","Lin, Kuan-Ming; Wang, Po-Yang; Shieh, Yun-Jen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive N‒N bond cleavage and coupling of organic azides mediated by chromium(i) and vanadium(i) β-diketiminate","New Journal of Chemistry","2010","34","8","1737","","10.1039/c0nj00114g","","","0.71073","MoKα","","0.1157","0.0907","","","0.2529","0.2796","","","","","","1.053","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053503","12.2715","0.0003","19.3946","0.0005","16.4428","0.0005","90","","100.074","0.001","90","","3853.07","0.18","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H59 N4 Si2 V -","- C35 H59 N4 Si2 V -","- C140 H236 N16 Si8 V4 -","4","1","","Lin, Kuan-Ming; Wang, Po-Yang; Shieh, Yun-Jen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive N‒N bond cleavage and coupling of organic azides mediated by chromium(i) and vanadium(i) β-diketiminate","New Journal of Chemistry","2010","34","8","1737","","10.1039/c0nj00114g","","","0.71073","MoKα","","0.1358","0.0819","","","0.1764","0.2081","","","","","","1.098","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053504","18.3009","0.0006","10.2668","0.0003","20.8551","0.0007","90","","96.085","0.001","90","","3896.4","0.2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H59 N4 Si2 V -","- C35 H59 N4 Si2 V -","- C140 H236 N16 Si8 V4 -","4","1","","Lin, Kuan-Ming; Wang, Po-Yang; Shieh, Yun-Jen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive N‒N bond cleavage and coupling of organic azides mediated by chromium(i) and vanadium(i) β-diketiminate","New Journal of Chemistry","2010","34","8","1737","","10.1039/c0nj00114g","","","0.71073","MoKα","","0.1308","0.0747","","","0.1789","0.2253","","","","","","1.045","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053505","10.8881","0.0005","12.8734","0.0005","16.1682","0.0008","105.496","0.002","90.87","0.002","91.47","0.002","2182.58","0.17","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C47 H63 Cr N6 O -","- C43 H55 Cr N6 -","- C86 H110 Cr2 N12 -","2","1","","Lin, Kuan-Ming; Wang, Po-Yang; Shieh, Yun-Jen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive N‒N bond cleavage and coupling of organic azides mediated by chromium(i) and vanadium(i) β-diketiminate","New Journal of Chemistry","2010","34","8","1737","","10.1039/c0nj00114g","","","0.71073","MoKα","","0.1541","0.085","","","0.198","0.2268","","","","","","0.988","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053506","9.1132","0.0009","20.144","0.002","20.551","0.002","90","","90.35","0.002","90","","3772.6","0.6","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H59 Cr N3 Si2 -","- C35 H59 Cr N3 Si2 -","- C140 H236 Cr4 N12 Si8 -","4","1","","Lin, Kuan-Ming; Wang, Po-Yang; Shieh, Yun-Jen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive N‒N bond cleavage and coupling of organic azides mediated by chromium(i) and vanadium(i) β-diketiminate","New Journal of Chemistry","2010","34","8","1737","","10.1039/c0nj00114g","","","0.71073","MoKα","","0.0767","0.0537","","","0.1476","0.1685","","","","","","1.052","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053507","19.7038","0.0004","10.9155","0.0003","23.6118","0.0006","90","","104.198","0.001","90","","4923.2","0.2","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H76 N4 O0.5 V -","- C49 H71 N4 V -","- C196 H284 N16 V4 -","4","1","","Lin, Kuan-Ming; Wang, Po-Yang; Shieh, Yun-Jen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive N‒N bond cleavage and coupling of organic azides mediated by chromium(i) and vanadium(i) β-diketiminate","New Journal of Chemistry","2010","34","8","1737","","10.1039/c0nj00114g","","","0.71073","MoKα","","0.1711","0.0975","","","0.2259","0.2565","","","","","","1.056","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7053508","19.4976","0.0007","18.3271","0.0006","11.299","0.0004","90","","90","","90","","4037.5","0.2","200","2","200","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C43 H55 N4 V -","- C43 H55 N4 V -","- C172 H220 N16 V4 -","4","0.5","","Lin, Kuan-Ming; Wang, Po-Yang; Shieh, Yun-Jen; Chen, Hong-Zhang; Kuo, Ting-Shen; Tsai, Yi-Chou","Reductive N‒N bond cleavage and coupling of organic azides mediated by chromium(i) and vanadium(i) β-diketiminate","New Journal of Chemistry","2010","34","8","1737","","10.1039/c0nj00114g","","","0.71073","MoKα","","0.1052","0.0564","","","0.1529","0.1918","","","","","","1.032","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053509","8.2786","0.0011","42.999","0.005","9.273","0.0012","90","","93.458","0.003","90","","3294.9","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H40 B Fe P -","- C40 H40 B Fe P -","- C160 H160 B4 Fe4 P4 -","4","1","","Bebbington, Magnus W. P.; Bontemps, Sébastien; Bouhadir, Ghenwa; Hanton, Martin J.; Tooze, Robert P.; van Rensburg, Hendrick; Bourissou, Didier","A 1,1′-ferrocenyl phosphine-borane: synthesis, structure and evaluation in Rh-catalyzed hydroformylation","New Journal of Chemistry","2010","34","8","1556","","10.1039/c0nj00117a","","","0.71073","MoKα","","0.1648","0.0756","","","0.1057","0.1269","","","","","","1.018","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053510","15.746","0.002","16.859","0.002","19.937","0.003","90","","90","","90","","5292.5","1.2","173","2","173","2","","","","","","","","5","P n c a","-P 2a 2n","60","","","","- C58 H72 P2 Pt S2 -","- C58 H72 P2 Pt S2 -","- C232 H288 P8 Pt4 S8 -","4","0.5","","Nakajima, Yumiko; Nakatani, Mitsuharu; Hayashi, Kyohei; Shiraishi, Yu; Takita, Ryo; Okazaki, Masaaki; Ozawa, Fumiyuki","Synthesis and structures of platinum diphenylacetylene and dithiolate complexes bearing diphosphinidenecyclobutene ligands (DPCB-Y)","New Journal of Chemistry","2010","34","8","1713","","10.1039/c0nj00118j","","","0.7107","MoKα","","0.0287","0.0232","","","0.078","0.0848","","","","","","0.627","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053511","9.264","0.002","16.459","0.004","20.29","0.005","97.529","0.005","91.894","0.005","91.27","0.005","3064.3","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H82 O2 P2 Pt -","- C68 H82 O2 P2 Pt -","- C136 H164 O4 P4 Pt2 -","2","1","","Nakajima, Yumiko; Nakatani, Mitsuharu; Hayashi, Kyohei; Shiraishi, Yu; Takita, Ryo; Okazaki, Masaaki; Ozawa, Fumiyuki","Synthesis and structures of platinum diphenylacetylene and dithiolate complexes bearing diphosphinidenecyclobutene ligands (DPCB-Y)","New Journal of Chemistry","2010","34","8","1713","","10.1039/c0nj00118j","","x-ray","0.7107","MoKα","","0.0444","0.0354","","","0.0831","0.0886","","","","","","1.04","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053512","9.164","0.003","16.791","0.005","21.506","0.007","70.738","0.008","82.039","0.012","87.536","0.012","3093.8","1.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H76 F6 P2 Pt -","- C68 H76 F6 P2 Pt -","- C136 H152 F12 P4 Pt2 -","2","1","","Nakajima, Yumiko; Nakatani, Mitsuharu; Hayashi, Kyohei; Shiraishi, Yu; Takita, Ryo; Okazaki, Masaaki; Ozawa, Fumiyuki","Synthesis and structures of platinum diphenylacetylene and dithiolate complexes bearing diphosphinidenecyclobutene ligands (DPCB-Y)","New Journal of Chemistry","2010","34","8","1713","","10.1039/c0nj00118j","","x-ray","0.7107","MoKα","","0.0501","0.0425","","","0.1011","0.1077","","","","","","0.94","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053513","9.477","0.004","11.489","0.005","29.035","0.013","86.858","0.015","88.386","0.015","80.386","0.014","3112","2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H76 F6 P2 Pt -","- C68 H76 F6 P2 Pt -","- C136 H152 F12 P4 Pt2 -","2","1","","Nakajima, Yumiko; Nakatani, Mitsuharu; Hayashi, Kyohei; Shiraishi, Yu; Takita, Ryo; Okazaki, Masaaki; Ozawa, Fumiyuki","Synthesis and structures of platinum diphenylacetylene and dithiolate complexes bearing diphosphinidenecyclobutene ligands (DPCB-Y)","New Journal of Chemistry","2010","34","8","1713","","10.1039/c0nj00118j","","","0.7107","MoKα","","0.0707","0.0554","","","0.1253","0.1371","","","","","","1.088","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053514","10.8407","0.001","17.0681","0.0018","19.0121","0.0017","79.591","0.006","73.981","0.006","85.655","0.006","3324.3","0.6","295","2","295","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H34 P2 Pt -","- C40 H34 P2 Pt -","- C160 H136 P8 Pt4 -","4","2","","Nakajima, Yumiko; Nakatani, Mitsuharu; Hayashi, Kyohei; Shiraishi, Yu; Takita, Ryo; Okazaki, Masaaki; Ozawa, Fumiyuki","Synthesis and structures of platinum diphenylacetylene and dithiolate complexes bearing diphosphinidenecyclobutene ligands (DPCB-Y)","New Journal of Chemistry","2010","34","8","1713","","10.1039/c0nj00118j","","x-ray","0.7107","MoKα","","0.0829","0.056","","","0.1367","0.1512","","","","","","1.009","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053515","19.008","0.009","14.477","0.004","19.693","0.006","90","","111.193","0.004","90","","5053","3","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C55 H74 Cl2 O P2 Pt -","- C55 H74 Cl2 O P2 Pt -","- C220 H296 Cl8 O4 P8 Pt4 -","4","1","","Nakajima, Yumiko; Nakatani, Mitsuharu; Hayashi, Kyohei; Shiraishi, Yu; Takita, Ryo; Okazaki, Masaaki; Ozawa, Fumiyuki","Synthesis and structures of platinum diphenylacetylene and dithiolate complexes bearing diphosphinidenecyclobutene ligands (DPCB-Y)","New Journal of Chemistry","2010","34","8","1713","","10.1039/c0nj00118j","","","0.7107","MoKα","","0.0524","0.0485","","","0.1454","0.1499","","","","","","1.056","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053516","10.3016","0.0002","19.496","0.0003","18.7092","0.0004","90","","94.4224","0.0007","90","","3746.37","0.12","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H63 B F N -","- C40 H63 B F N -","- C160 H252 B4 F4 N4 -","4","1","","Bresner, Christopher; Haynes, Cally J. E.; Addy, David A.; Broomsgrove, Alexander E. J.; Fitzpatrick, Philip; Vidovic, Dragoslav; Thompson, Amber L.; Fallis, Ian A.; Aldridge, Simon","Comparative structural and thermodynamic studies of fluoride and cyanide binding by PhBMes2 and related triarylborane Lewis acids","New Journal of Chemistry","2010","34","8","1652","","10.1039/c0nj00120a","","","0.71073","MoKα","","0.059","0.0407","","0.0994","0.0926","0.0994","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053517","18.0486","0.0002","15.7241","0.0001","25.824","0.0002","90","","90","","90","","7328.8","0.11","150","","150","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C37 H51 B K N O6 -","- C37 H51 B K N O6 -","- C296 H408 B8 K8 N8 O48 -","8","1","","Bresner, Christopher; Haynes, Cally J. E.; Addy, David A.; Broomsgrove, Alexander E. J.; Fitzpatrick, Philip; Vidovic, Dragoslav; Thompson, Amber L.; Fallis, Ian A.; Aldridge, Simon","Comparative structural and thermodynamic studies of fluoride and cyanide binding by PhBMes2 and related triarylborane Lewis acids","New Journal of Chemistry","2010","34","8","1652","","10.1039/c0nj00120a","","","0.71073","MoKα","","0.0884","0.0459","","0.088","0.0468","0.0468","","","","","","1.095","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053518","12.5667","0.0002","13.3168","0.0003","13.9064","0.0003","102.277","0.001","110.042","0.001","109.954","0.001","1906.52","0.07","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C80 H106 B2 K2 N4 O12 -","- C80 H106 B2 K2 N4 O12 -","- C80 H106 B2 K2 N4 O12 -","1","0.5","","Bresner, Christopher; Haynes, Cally J. E.; Addy, David A.; Broomsgrove, Alexander E. J.; Fitzpatrick, Philip; Vidovic, Dragoslav; Thompson, Amber L.; Fallis, Ian A.; Aldridge, Simon","Comparative structural and thermodynamic studies of fluoride and cyanide binding by PhBMes2 and related triarylborane Lewis acids","New Journal of Chemistry","2010","34","8","1652","","10.1039/c0nj00120a","","","0.71073","MoKα","","0.098","0.0604","","0.1496","0.1342","0.1496","","","","","","0.9399","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053519","10.844","0.002","11.874","0.003","13.349","0.003","115.304","0.002","95.635","0.002","107.048","0.002","1435.1","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H47 N Si5 -","- C23 H47 N Si5 -","- C46 H94 N2 Si10 -","2","1","","Iwamoto, Takeaki; Ohnishi, Nobuyoshi; Gui, Zhenyu; Ishida, Shintaro; Isobe, Hiroyuki; Maeda, Satoshi; Ohno, Koichi; Kira, Mitsuo","Synthesis and structure of stable base-free dialkylsilanimines","New Journal of Chemistry","2010","34","8","1637","","10.1039/c0nj00121j","","","0.71073","MoKα","","0.0486","0.0375","","","0.0908","0.0975","","","","","","1.029","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053520","9.1616","0.0009","20.601","0.002","14.7242","0.0014","90","","93.934","0.001","90","","2772.5","0.5","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H45 N Si5 -","- C22 H45 N Si5 -","- C88 H180 N4 Si20 -","4","1","","Iwamoto, Takeaki; Ohnishi, Nobuyoshi; Gui, Zhenyu; Ishida, Shintaro; Isobe, Hiroyuki; Maeda, Satoshi; Ohno, Koichi; Kira, Mitsuo","Synthesis and structure of stable base-free dialkylsilanimines","New Journal of Chemistry","2010","34","8","1637","","10.1039/c0nj00121j","","","0.71073","MoKα","","0.028","0.025","","","0.0692","0.0719","","","","","","1.049","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053521","9.445","0.003","10.618","0.003","16.947","0.005","95.035","0.003","93.948","0.003","111.147","0.003","1569.7","0.8","120","","120","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H55 N Si5 -","- C26 H55 N Si5 -","- C52 H110 N2 Si10 -","2","1","","Iwamoto, Takeaki; Ohnishi, Nobuyoshi; Gui, Zhenyu; Ishida, Shintaro; Isobe, Hiroyuki; Maeda, Satoshi; Ohno, Koichi; Kira, Mitsuo","Synthesis and structure of stable base-free dialkylsilanimines","New Journal of Chemistry","2010","34","8","1637","","10.1039/c0nj00121j","","","0.71073","MoKα","","0.0442","0.0381","","","0.1012","0.1064","","","","","","1.079","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053522","14.673","0.005","9.188","0.003","21.868","0.008","90","","96.864","0.004","90","","2927","1.7","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H49 N Si6 -","- C19 H49 N Si6 -","- C76 H196 N4 Si24 -","4","1","","Iwamoto, Takeaki; Ohnishi, Nobuyoshi; Gui, Zhenyu; Ishida, Shintaro; Isobe, Hiroyuki; Maeda, Satoshi; Ohno, Koichi; Kira, Mitsuo","Synthesis and structure of stable base-free dialkylsilanimines","New Journal of Chemistry","2010","34","8","1637","","10.1039/c0nj00121j","","","0.71073","MoKα","","0.0495","0.0415","","","0.1064","0.1145","","","","","","1.118","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053523","11.2536","0.0009","25.6","0.003","13.7924","0.0014","90","","98.022","0.003","90","","3934.6","0.7","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C44 H39 Au Cl P -","- C44 H39 Au Cl P -","- C176 H156 Au4 Cl4 P4 -","4","1","","Joly, Damien; Tondelier, Denis; Deborde, Valérie; Geffroy, Bernard; Hissler, Muriel; Réau, Régis","Phosphole-based π-conjugated electroluminescent materials for OLEDs","New Journal of Chemistry","2010","34","8","1603","","10.1039/c0nj00122h","","","0.71073","MoKα","","0.061","0.0461","","","0.1266","0.1328","","","","","","1.036","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053524","15.5626","0.0004","14.6072","0.0005","16.9537","0.0005","90","","110.462","0.002","90","","3610.84","0.19","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C80 H104 B2 Ca O8 -","- C80 H104 B2 Ca O8 -","- C160 H208 B4 Ca2 O16 -","2","0.5","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1396","0.1095","","","0.2809","0.2985","","","","","","1.088","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053525","12.6919","0.0003","15.3774","0.0004","21.9023","0.0005","90","","93.797","0.001","90","","4265.25","0.18","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H60 B Ca I O5 -","- C44 H60 B Ca I O5 -","- C176 H240 B4 Ca4 I4 O20 -","4","1","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1051","0.0502","","","0.1012","0.1203","","","","","","1.009","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053526","17.0743","0.0005","16.2193","0.0004","30.1905","0.0009","90","","95.514","0.003","90","","8322.1","0.4","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C41 H65 Al Li N3 O2 -","- C41 H65 Al Li N3 O2 -","- C328 H520 Al8 Li8 N24 O16 -","8","1","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.178","0.0884","","","0.1945","0.2456","","","","","","1.023","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053527","10.894","0.0004","12.2427","0.0005","34.7637","0.0013","94.365","0.002","91.07","0.002","104.162","0.002","4479.2","0.3","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H59 Al K N2 O2.5 -","- C52 H59 Al K N2 O2.5 -","- C208 H236 Al4 K4 N8 O10 -","4","2","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1397","0.091","","","0.2264","0.2594","","","","","","1.05","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053528","21.4995","0.0004","18.274","0.0003","18.9071","0.0004","90","","90.464","0.001","90","","7428","0.2","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C80 H104 Al2 O8 Sr -","- C80 H104 Al2 O8 Sr -","- C320 H416 Al8 O32 Sr4 -","4","1","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1272","0.0667","","","0.1663","0.2034","","","","","","1.029","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053529","14.6288","0.0002","21.8473","0.0003","37.9734","0.0006","90","","90","","90","","12136.3","0.3","183","2","183","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C55.5 H90 Ca Ga2 N2 O8 -","- C55.5 H90 Ca Ga2 N2 O8 -","- C444 H720 Ca8 Ga16 N16 O64 -","8","1","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1634","0.0824","","","0.2136","0.2589","","","","","","1.039","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053530","16.8019","0.0005","17.3641","0.0007","17.9993","0.0006","90","","95.473","0.002","90","","5227.4","0.3","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H84 Li O5 V -","- C56 H84 Li O5 V -","- C224 H336 Li4 O20 V4 -","4","1","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1503","0.0664","","","0.1592","0.1945","","","","","","1.013","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053531","12.668","0.003","34.081","0.007","15.403","0.003","90","","106.43","0.03","90","","6379","3","183","2","183","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H100 Ca I O7 V -","- C64 H100 Ca I O7 V -","- C256 H400 Ca4 I4 O28 V4 -","4","1","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.094","0.0593","","","0.1602","0.1818","","","","","","1.019","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053532","13.5165","0.0008","13.9755","0.0006","14.965","0.0007","76.564","0.003","71.192","0.003","88.512","0.003","2599","0.2","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","","","- C112 H168 Ca O10 V2 -","- C112 H168 Ca O10 V2 -","- C112 H168 Ca O10 V2 -","1","0.5","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1409","0.0662","","","0.137","0.1668","","","","","","1.011","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053533","13.5257","0.0014","13.9195","0.0012","15.1196","0.0017","76.359","0.006","71.204","0.004","88.437","0.007","2615.1","0.5","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","","","- C112 H168 O10 Sr V2 -","- C112 H168 O10 Sr V2 -","- C112 H168 O10 Sr V2 -","1","0.5","","Langer, Jens; Krieck, Sven; Görls, Helmar; Kreisel, Günter; Seidel, Wolfgang; Westerhausen, Matthias","Organic heterobimetallic complexes of the alkaline earth metals (Ae = Ca, Sr, Ba) with tetrahedral metallate anions of three-valent metals (M = B, Al, Ga, and V)","New Journal of Chemistry","2010","34","8","1667","","10.1039/c0nj00136h","","","0.71073","MoKα","","0.1774","0.0777","","","0.1504","0.1926","","","","","","1.019","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053534","8.856","0.0003","13.738","0.0005","15.95","0.0007","90","","99.9596","0.0018","90","","1911.29","0.13","150","2","150","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C35 H49 D6 Ge N O3 Si3 W -","- C35 H54 Ge N O3 Si3 W -","- C70 H108 Ge2 N2 O6 Si6 W2 -","2","1","","Hashimoto, Hisako; Fukuda, Tetsuya; Tobita, Hiromi","Reactions of a hydrido(hydrogermylene)tungsten complex with some heterocumulenes: hydrogermylation and thermal rearrangement","New Journal of Chemistry","2010","34","8","1723","","10.1039/c0nj00137f","","","0.71069","MoKα","","0.0301","0.0274","","","0.0748","0.0824","","","","","","1.145","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053535","12.824","0.0006","16.7658","0.0005","17.575","0.0006","90","","108.991","0.0009","90","","3573","0.2","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H49 Ge N O2 S Si3 W -","- C29 H48 Ge N O2 S Si3 W -","- C116 H192 Ge4 N4 O8 S4 Si12 W4 -","4","1","","Hashimoto, Hisako; Fukuda, Tetsuya; Tobita, Hiromi","Reactions of a hydrido(hydrogermylene)tungsten complex with some heterocumulenes: hydrogermylation and thermal rearrangement","New Journal of Chemistry","2010","34","8","1723","","10.1039/c0nj00137f","","","0.71069","MoKα","","0.0285","0.024","","","0.0746","0.0801","","","","","","1.267","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053536","8.9678","0.0004","25.2891","0.0006","15.0542","0.0006","90","","94.9373","0.001","90","","3401.4","0.2","150","2","150","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H49 Ge N O2 S Si3 W -","- C29 H49 Ge N O2 S Si3 W -","- C116 H196 Ge4 N4 O8 S4 Si12 W4 -","4","1","","Hashimoto, Hisako; Fukuda, Tetsuya; Tobita, Hiromi","Reactions of a hydrido(hydrogermylene)tungsten complex with some heterocumulenes: hydrogermylation and thermal rearrangement","New Journal of Chemistry","2010","34","8","1723","","10.1039/c0nj00137f","","","0.71069","MoKα","","0.083","0.0646","","","0.1257","0.1358","","","","","","1.326","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053537","7.8576","0.0002","11.0894","0.0004","20.0502","0.0007","103.782","0.002","98.959","0.002","92.247","0.002","1670.78","0.1","100","","100","","","","","","","","Sigma Aldrich","3","P -1","-P 1","2","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C72 H80 O24 -","8","4","","Albrecht, Merwe; Borba, Ana; Le Barbu-Debus, Katia; Dittrich, Birger; Fausto, Rui; Grimme, Stefan; Mahjoub, Ahmed; Nedić, Marija; Schmitt, Ulrich; Schrader, Lena; Suhm, Martin A.; Zehnacker-Rentien, Anne; Zischang, Julia","Chirality influence on the aggregation of methyl mandelate","New Journal of Chemistry","2010","34","7","1266","","10.1039/c0nj00142b","","","1.5418","","","0.0626","0.046","","","","0.0491","","","","","","3.5099","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053538","7.8825","0.0004","20.1054","0.0011","10.7516","0.0005","90","","91.033","0.003","90","","1703.65","0.15","100","","100","","","","","","","","Sigma Aldrich","3","P 1 21 1","P 2yb","4","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C72 H80 O24 -","8","4","","Albrecht, Merwe; Borba, Ana; Le Barbu-Debus, Katia; Dittrich, Birger; Fausto, Rui; Grimme, Stefan; Mahjoub, Ahmed; Nedić, Marija; Schmitt, Ulrich; Schrader, Lena; Suhm, Martin A.; Zehnacker-Rentien, Anne; Zischang, Julia","Chirality influence on the aggregation of methyl mandelate","New Journal of Chemistry","2010","34","7","1266","","10.1039/c0nj00142b","","","1.54188","","","0.0504","0.0412","","","","0.0488","","","","","","2.2645","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053539","11.0955","0.0009","7.8081","0.0005","19.7538","0.0016","90","","104.259","0.005","90","","1658.6","0.2","100","","100","","","","","","","","Sigma Aldrich","3","P 1 21 1","P 2yb","4","","","","- C9 H10 O3 -","- C9 H10 O3 -","- C72 H80 O24 -","8","4","","Albrecht, Merwe; Borba, Ana; Le Barbu-Debus, Katia; Dittrich, Birger; Fausto, Rui; Grimme, Stefan; Mahjoub, Ahmed; Nedić, Marija; Schmitt, Ulrich; Schrader, Lena; Suhm, Martin A.; Zehnacker-Rentien, Anne; Zischang, Julia","Chirality influence on the aggregation of methyl mandelate","New Journal of Chemistry","2010","34","7","1266","","10.1039/c0nj00142b","","","1.5418","","","0.0479","0.0294","","","","0.0264","","","","","","1.9895","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053540","3.6519","0.0005","12.1512","0.0018","15.07","0.002","90","","90.982","0.004","90","","668.63","0.16","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","compound 1","","","- C6 H6 Ag N O3 -","- C6 H6 Ag N O3 -","- C24 H24 Ag4 N4 O12 -","4","1","","Kalf, Irmgard; Mathieu, Patrick; Englert, Ulli","From crystal to crystal: a new polymorph of (4-carboxylatopyridine)silver(i) by topotactic dehydration of its monohydrate","New Journal of Chemistry","2010","34","11","2491","","10.1039/c0nj00144a","","","0.71073","MoKα","","0.1119","0.0749","","","0.1366","0.1526","","","","","","1.1","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053541","3.6484","0.0007","10.844","0.002","14.425","0.003","90","","93.79","0.003","90","","569.45","0.19","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","compound 2alpha","","","- C6 H4 Ag N O2 -","- C6 H4 Ag N O2 -","- C24 H16 Ag4 N4 O8 -","4","1","","Kalf, Irmgard; Mathieu, Patrick; Englert, Ulli","From crystal to crystal: a new polymorph of (4-carboxylatopyridine)silver(i) by topotactic dehydration of its monohydrate","New Journal of Chemistry","2010","34","11","2491","","10.1039/c0nj00144a","","","0.71073","MoKα","","0.0585","0.0434","","","0.0905","0.0929","","","","","","1.032","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053542","9.5035","0.0003","10.958","0.0004","15.4221","0.0007","75.868","0.002","84.937","0.002","65.551","0.002","1417.64","0.1","123","2","123","2","","","","","","","","8","P -1","-P 1","2","(2-Bis(trimethylsilyl)methyl-3,5,-di(2-thienyl)-2H-1,4,2- diazaphosphole-kappaP)pentacarbonyltungsten(0)","[2-Bis(trimethylsilyl)methyl-3,5,-di(2-thienyl)-2H-1,4,2-diazaphosphole- kappaP]pentacarbonyltungsten(0)","","- C22 H25 N2 O5 P S2 Si2 W -","- C22 H25 N2 O5 P S2 Si2 W -","- C44 H50 N4 O10 P2 S4 Si4 W2 -","2","1","","Helten, Holger; Daniels, Jörg; Nieger, Martin; Streubel, Rainer","Extended π conjugation in 2H-1,4,2-diazaphosphole complexes","New Journal of Chemistry","2010","34","8","1593","","10.1039/c0nj00151a","","","0.71073","MoKα","","0.0337","0.0291","","","0.0668","0.0686","","","","","","1.04","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053543","11.8239","0.0002","20.2887","0.0005","11.927","0.0003","90","","104.518","0.001","90","","2769.83","0.11","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","joerg143 H.Helten ''HHE-298F1'' 100K 13.02.08","","","- C20 H28 N3 O5 P S Si2 W -","- C20 H28 N3 O5 P S Si2 W -","- C80 H112 N12 O20 P4 S4 Si8 W4 -","4","1","","Helten, Holger; Daniels, Jörg; Nieger, Martin; Streubel, Rainer","Extended π conjugation in 2H-1,4,2-diazaphosphole complexes","New Journal of Chemistry","2010","34","8","1593","","10.1039/c0nj00151a","","","0.71073","MoKα","","0.0435","0.029","","","0.0511","0.0541","","","","","","0.983","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053544","10.1486","0.0008","16.5262","0.0011","17.1966","0.0014","90","","97.0498","0.0014","90","","2862.4","0.4","95","2","95","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1-mesityl-2,3,4,5-tetraphenyl-1H-phosphole-1-oxide","1-mesityl-2,3,4,5-tetraphenyl-1H-phosphole-1-oxide","","- C37 H31 O P -","- C37 H31 O P -","- C148 H124 O4 P4 -","4","1","","Fukazawa, Aiko; Ichihashi, Yasunori; Yamaguchi, Shigehiro","Intense fluorescence of 1-aryl-2,3,4,5-tetraphenylphosphole oxides in the crystalline state","New Journal of Chemistry","2010","34","8","1537","","10.1039/c0nj00155d","","","0.7107","MoKα","","0.0678","0.058","","","0.111","0.116","","","","","","1.171","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053545","9.153","0.003","10.506","0.004","35.335","0.012","90","","90","","90","","3398","2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2,3,4,5-tetraphenyl-1-(2',4',6'-triisopropylphenyl)-1H- phosphole-1-oxide","2,3,4,5-tetraphenyl-1-(2',4',6'-triisopropylphenyl)-1H-phosphole-1-oxide","","- C43 H43 O P -","- C43 H43 O P -","- C172 H172 O4 P4 -","4","1","","Fukazawa, Aiko; Ichihashi, Yasunori; Yamaguchi, Shigehiro","Intense fluorescence of 1-aryl-2,3,4,5-tetraphenylphosphole oxides in the crystalline state","New Journal of Chemistry","2010","34","8","1537","","10.1039/c0nj00155d","","","0.7107","MoKα","","0.0326","0.0311","","","0.0712","0.0722","","","","","","1.086","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053546","10.234","0.003","10.522","0.002","14.911","0.005","70.376","0.011","89.627","0.014","63.75","0.01","1337.1","0.7","100","2","100","2","","","","","","","","4","P -1","-P 1","2","1-(4'-methoxyphenyl)-2,3,4,5-tetraphenyl-1H-phosphole-1-oxide","1-(4'-methoxyphenyl)-2,3,4,5-tetraphenyl-1H-phosphole-1-oxide","","- C35 H27 O2 P -","- C35 H27 O2 P -","- C70 H54 O4 P2 -","2","1","","Fukazawa, Aiko; Ichihashi, Yasunori; Yamaguchi, Shigehiro","Intense fluorescence of 1-aryl-2,3,4,5-tetraphenylphosphole oxides in the crystalline state","New Journal of Chemistry","2010","34","8","1537","","10.1039/c0nj00155d","","","0.7107","MoKα","","0.0563","0.0415","","","0.1006","0.1096","","","","","","1.075","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053547","6.2429","0.0016","21.249","0.005","20.413","0.005","90","","97.4377","0.0014","90","","2685.1","1.1","84","2","84","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-(4-trifluoromethyl)phenyl-2,3,4,5-tetraphenyl-1H-phosphole- 1-oxide","1-(4-trifluoromethyl)phenyl-2,3,4,5-tetraphenyl-1H-phosphole-1-oxide","","- C35 H24 F3 O P -","- C35 H24 F3 O P -","- C140 H96 F12 O4 P4 -","4","1","","Fukazawa, Aiko; Ichihashi, Yasunori; Yamaguchi, Shigehiro","Intense fluorescence of 1-aryl-2,3,4,5-tetraphenylphosphole oxides in the crystalline state","New Journal of Chemistry","2010","34","8","1537","","10.1039/c0nj00155d","","","0.7107","MoKα","","0.1138","0.0775","","","0.1535","0.1761","","","","","","1.098","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053548","11.6019","0.0013","15.159","0.002","7.5024","0.0009","90","","103.93","0.003","90","","1280.7","0.3","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C52 H60 N4 O24 -","4","1","","Leong, Wei Lee; Vittal, Jagadese J.","Alkali metal ion directed self-assembled Ni(ii) molecular clusters","New Journal of Chemistry","2010","34","10","2145","","10.1039/c0nj00157k","","","0.71073","MoKα","","0.1359","0.0846","","","0.2103","0.2384","","","","","","1.026","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053549","5.3583","0.0005","5.8497","0.0006","10.4352","0.001","88.144","0.002","75.461","0.002","82.331","0.002","313.78","0.05","223","2","223","2","","","","","","","","4","P 1","P 1","1","","","","- C14 H15 N O5 -","- C14 H15 N O5 -","- C14 H15 N O5 -","1","1","","Leong, Wei Lee; Vittal, Jagadese J.","Alkali metal ion directed self-assembled Ni(ii) molecular clusters","New Journal of Chemistry","2010","34","10","2145","","10.1039/c0nj00157k","","","0.71073","MoKα","","0.0398","0.0388","","","0.1007","0.1018","","","","","","1.07","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053550","15.4367","0.0009","15.4367","0.0009","35.721","0.004","90","","90","","120","","7371.6","1","223","2","223","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C78 H96 N6 Na6 Ni7 O49 -","- C78 H72 N6 Na6 Ni7 O49 -","- C234 H216 N18 Na18 Ni21 O147 -","3","0.166667","","Leong, Wei Lee; Vittal, Jagadese J.","Alkali metal ion directed self-assembled Ni(ii) molecular clusters","New Journal of Chemistry","2010","34","10","2145","","10.1039/c0nj00157k","","","0.71073","MoKα","","0.1393","0.0795","","","0.19","0.211","","","","","","1.032","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053551","22.5549","0.0016","12.9601","0.0009","15.0085","0.001","90","","105.823","0.002","90","","4221","0.5","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C67.2 H108.2 K2 N4 Ni4 O42 -","- C67.2 H107.6 K2 N4 Ni4 O42 -","- C134.4 H215.2 K4 N8 Ni8 O84 -","2","0.5","","Leong, Wei Lee; Vittal, Jagadese J.","Alkali metal ion directed self-assembled Ni(ii) molecular clusters","New Journal of Chemistry","2010","34","10","2145","","10.1039/c0nj00157k","","","0.71073","MoKα","","0.0613","0.0487","","","0.1208","0.1273","","","","","","1.038","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053552","13.9467","0.0005","26.2945","0.001","16.361","0.0006","90","","90","","90","","5999.9","0.4","223","2","223","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C39 H59 N3 Ni5 O30.5 -","- C39 H59 N3 Ni5 O30.5 -","- C156 H236 N12 Ni20 O122 -","4","0.5","","Leong, Wei Lee; Vittal, Jagadese J.","Alkali metal ion directed self-assembled Ni(ii) molecular clusters","New Journal of Chemistry","2010","34","10","2145","","10.1039/c0nj00157k","","","0.71073","MoKα","","0.0542","0.0473","","","0.1172","0.1212","","","","","","1.03","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053553","7.2845","0.0005","13.453","0.0008","17.5656","0.0014","90","","92.241","0.009","90","","1720.1","0.2","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 N5 -","- C20 H19 N5 -","- C80 H76 N20 -","4","1","","Kutlescha, Kathrin; Irrgang, Torsten; Kempe, Rhett","An intermolecular C‒C coupling reaction of iridium complexes","New Journal of Chemistry","2010","34","9","1954","","10.1039/c0nj00158a","","","0.71073","MoKα","","0.0758","0.0391","","","0.0789","0.0879","","","","","","0.854","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053554","7.9017","0.0004","8.9335","0.0006","16.893","0.001","88.206","0.007","80.191","0.006","89.069","0.007","1174.39","0.12","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H30 Ir N5 -","- C28 H30 Ir N5 -","- C56 H60 Ir2 N10 -","2","1","","Kutlescha, Kathrin; Irrgang, Torsten; Kempe, Rhett","An intermolecular C‒C coupling reaction of iridium complexes","New Journal of Chemistry","2010","34","9","1954","","10.1039/c0nj00158a","","","0.71073","MoKα","","0.0252","0.02","","","0.0456","0.0487","","","","","","0.965","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053555","15.584","0.0007","22.6799","0.0008","26.552","0.0012","90","","98.245","0.003","90","","9287.6","0.7","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H58 Ir2 N10 -","- C56 H58 Ir2 N10 -","- C448 H464 Ir16 N80 -","8","2","","Kutlescha, Kathrin; Irrgang, Torsten; Kempe, Rhett","An intermolecular C‒C coupling reaction of iridium complexes","New Journal of Chemistry","2010","34","9","1954","","10.1039/c0nj00158a","","","0.71073","MoKα","","0.1036","0.0501","","","0.0823","0.0924","","","","","","0.957","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053556","14.211","0.0006","23.572","0.001","14.606","0.0006","90","","103.436","0.003","90","","4758.8","0.4","133","2","133","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C52 H66 Ir2 N10 -","- C52 H66 Ir2 N10 -","- C208 H264 Ir8 N40 -","4","1","","Kutlescha, Kathrin; Irrgang, Torsten; Kempe, Rhett","An intermolecular C‒C coupling reaction of iridium complexes","New Journal of Chemistry","2010","34","9","1954","","10.1039/c0nj00158a","","","0.71069","MoKα","","0.0562","0.0361","","","0.073","0.0764","","","","","","0.808","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053557","11.0934","0.0008","8.8646","0.0006","16.1716","0.0011","90","","108.143","0.002","90","","1511.23","0.18","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H19 Al Cl3 P -","- C9 H19 Al Cl3 P -","- C36 H76 Al4 Cl12 P4 -","4","1","","Bates, Joshua I.; Patrick, Brian O.; Gates, Derek P.","A Lewis acid-mediated synthesis of P-alkyl-substituted phosphaalkenes","New Journal of Chemistry","2010","34","8","1660","","10.1039/c0nj00188k","","","0.71073","MoKα","","0.0696","0.0484","","","0.1218","0.1324","","","","","","1.154","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053558","11.0971","0.0014","8.8556","0.0012","16.184","0.002","90","","108.247","0.005","90","","1510.5","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H19 Cl3 Ga P -","- C9 H19 Cl3 Ga P -","- C36 H76 Cl12 Ga4 P4 -","4","1","","Bates, Joshua I.; Patrick, Brian O.; Gates, Derek P.","A Lewis acid-mediated synthesis of P-alkyl-substituted phosphaalkenes","New Journal of Chemistry","2010","34","8","1660","","10.1039/c0nj00188k","","","0.71073","MoKα","","0.0572","0.0377","","","0.0816","0.0887","","","","","","1.1","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053559","10.5923","0.0011","15.9466","0.0017","11.3326","0.0013","90","","107.238","0.005","90","","1828.2","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H25 Cl3 Ga P -","- C15 H25 Cl3 Ga P -","- C60 H100 Cl12 Ga4 P4 -","4","1","","Bates, Joshua I.; Patrick, Brian O.; Gates, Derek P.","A Lewis acid-mediated synthesis of P-alkyl-substituted phosphaalkenes","New Journal of Chemistry","2010","34","8","1660","","10.1039/c0nj00188k","","","0.71073","MoKα","","0.0972","0.0572","","","0.1166","0.135","","","","","","1.077","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053560","10.3512","0.0003","10.5145","0.0003","10.8469","0.0004","116.607","0.002","115.147","0.002","94.549","0.002","900.91","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","(E)-5-(4-Methylpyridin-2-yl)-2-phenyl-3-(phenylimino)-1,2,5- oxadiazinan-4-one","(E)-5-(4-Methylpyridin-2-yl)-2-phenyl-3-(phenylimino)-1,2,5-oxadiazinan-4-one","","- C21 H18 N4 O2 -","- C21 H18 N4 O2 -","- C42 H36 N8 O4 -","2","1","","Trzewik, Bartosz; Seidler, Tomasz; Brocławik, Ewa; Stadnicka, Katarzyna","Mechanisms of reactions conducted on α-amido-α-aminonitrones, determined based on the structures of their crystalline products and DFT calculations","New Journal of Chemistry","2010","34","10","2220","","10.1039/c0nj00193g","","","0.71073","MoKα","","0.0705","0.0482","","","0.1195","0.1351","","","","","","1.002","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053561","26.1851","0.0008","9.1055","0.0003","13.7491","0.0006","90","","98.881","0.001","90","","3238.9","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","(Z)-2-(phenylamino)-2-(phenylimino)-N-(pyridin-2-yl)ethanamide","(Z)-2-(phenylamino)-2-(phenylimino)-N-(pyridin-2-yl)ethanamide","","- C19 H16 N4 O -","- C19 H16 N4 O -","- C152 H128 N32 O8 -","8","1","","Trzewik, Bartosz; Seidler, Tomasz; Brocławik, Ewa; Stadnicka, Katarzyna","Mechanisms of reactions conducted on α-amido-α-aminonitrones, determined based on the structures of their crystalline products and DFT calculations","New Journal of Chemistry","2010","34","10","2220","","10.1039/c0nj00193g","","","0.71073","MoKα","","0.0635","0.0451","","","0.1039","0.1145","","","","","","1.039","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053562","13.5564","0.0003","10.157","0.0003","13.3227","0.0004","90","","109.473","0.001","90","","1729.5","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(Z)-N-(4-methylpyridin-2-yl)-2-(phenylamino)-2- (phenylimino)ethanamide","(Z)-N-(4-methylpyridin-2-yl)-2-(phenylamino)-2-(phenylimino)ethanamide","","- C20 H18 N4 O -","- C20 H18 N4 O -","- C80 H72 N16 O4 -","4","1","","Trzewik, Bartosz; Seidler, Tomasz; Brocławik, Ewa; Stadnicka, Katarzyna","Mechanisms of reactions conducted on α-amido-α-aminonitrones, determined based on the structures of their crystalline products and DFT calculations","New Journal of Chemistry","2010","34","10","2220","","10.1039/c0nj00193g","","","0.71073","MoKα","","0.1014","0.0537","","","0.1054","0.1251","","","","","","0.99","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053563","10.3641","0.0002","11.7961","0.0003","14.4961","0.0004","89.766","0.001","69.834","0.001","70.166","0.001","1552.07","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","N-Pyridin-2-yl-5H-dibenzo(d,f)(1,3)diazepine-6-carboxamide","N-Pyridin-2-yl-5H-dibenzo[d,f][1,3]diazepine-6-carboxamide","","- C19 H14 N4 O -","- C19 H14 N4 O -","- C76 H56 N16 O4 -","4","2","","Trzewik, Bartosz; Seidler, Tomasz; Brocławik, Ewa; Stadnicka, Katarzyna","Mechanisms of reactions conducted on α-amido-α-aminonitrones, determined based on the structures of their crystalline products and DFT calculations","New Journal of Chemistry","2010","34","10","2220","","10.1039/c0nj00193g","","","0.71073","MoKα","","0.1077","0.0609","","","0.1118","0.1289","","","","","","1.048","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053564","33.1453","0.0016","9.5959","0.0004","18.495","0.0008","90","","90.467","0.001","90","","5882.3","0.5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H41 N3 O18 Zn3 -","- C39 H35 N3 O18 Zn3 -","- C156 H140 N12 O72 Zn12 -","4","0.5","","Sapchenko, Sergey A.; Dybtsev, Danil N.; Samsonenko, Denis G.; Fedin, Vladimir P.","Synthesis, crystal structures, luminescent and thermal properties of two new metal‒organic coordination polymers based on zinc(ii) carboxylates","New Journal of Chemistry","2010","34","11","2445","","10.1039/c0nj00196a","","x-ray","0.71073","MoKα","","0.1093","0.0782","","","0.2438","0.255","","","","","","1.077","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053565","24.6744","0.0005","14.5575","0.0005","22.4021","0.0006","90","","90","","90","","8046.8","0.4","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C75 H83 N7 O21 Zn3 -","- C75 H83 N7 O21 Zn3 -","- C300 H332 N28 O84 Zn12 -","4","1","","Sapchenko, Sergey A.; Dybtsev, Danil N.; Samsonenko, Denis G.; Fedin, Vladimir P.","Synthesis, crystal structures, luminescent and thermal properties of two new metal‒organic coordination polymers based on zinc(ii) carboxylates","New Journal of Chemistry","2010","34","11","2445","","10.1039/c0nj00196a","","x-ray","0.71073","MoKα","","0.0501","0.0377","","","0.106","0.1127","","","","","","1.059","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053566","10.6958","0.0008","11.0822","0.0006","15.5505","0.0014","90","","107.187","0.007","90","","1760.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C9 H18 N3 O9 P3 -","- C9 H18 N3 O9 P3 -","- C36 H72 N12 O36 P12 -","4","1","","Maxim, Catalin; Matni, Adil; Geoffroy, Michel; Andruh, Marius; Hearns, Nigel G. R.; Clérac, Rodolphe; Avarvari, Narcis","C3 symmetric tris(phosphonate)-1,3,5-triazine ligand: homopolymetallic complexes and its radical anion","New Journal of Chemistry","2010","34","10","2319","","10.1039/c0nj00204f","","","0.71073","MoKα","","0.088","0.0493","","","0.108","0.1273","","","","","","1.044","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053567","11.5334","0.0011","12.8817","0.0017","23.9","0.003","76.767","0.014","77.375","0.012","78.485","0.014","3330.9","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H24 Cu3 F36 N3 O21 P3 -","- C39 H24 Cu3 F36 N3 O21 P3 -","- C78 H48 Cu6 F72 N6 O42 P6 -","2","1","","Maxim, Catalin; Matni, Adil; Geoffroy, Michel; Andruh, Marius; Hearns, Nigel G. R.; Clérac, Rodolphe; Avarvari, Narcis","C3 symmetric tris(phosphonate)-1,3,5-triazine ligand: homopolymetallic complexes and its radical anion","New Journal of Chemistry","2010","34","10","2319","","10.1039/c0nj00204f","","","0.71073","MoKα","","0.1803","0.0512","","","0.0953","0.1244","","","","","","0.724","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053568","10.7033","0.0011","14.7008","0.0017","15.6481","0.0017","112.26","0.013","98.811","0.013","106.294","0.013","2091.8","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H42 Co3 F36 N6 O30 P6 -","- C48 H42 Co3 F36 N6 O30 P6 -","- C48 H42 Co3 F36 N6 O30 P6 -","1","0.5","","Maxim, Catalin; Matni, Adil; Geoffroy, Michel; Andruh, Marius; Hearns, Nigel G. R.; Clérac, Rodolphe; Avarvari, Narcis","C3 symmetric tris(phosphonate)-1,3,5-triazine ligand: homopolymetallic complexes and its radical anion","New Journal of Chemistry","2010","34","10","2319","","10.1039/c0nj00204f","","","0.71073","MoKα","","0.0776","0.043","","","0.1037","0.1176","","","","","","0.839","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053569","10.7403","0.0005","14.6581","0.0004","15.8125","0.0007","112.201","0.006","97.921","0.007","107.18","0.005","2112.7","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H42 F36 Mn3 N6 O30 P6 -","- C48 H42 F36 Mn3 N6 O30 P6 -","- C48 H42 F36 Mn3 N6 O30 P6 -","1","0.5","","Maxim, Catalin; Matni, Adil; Geoffroy, Michel; Andruh, Marius; Hearns, Nigel G. R.; Clérac, Rodolphe; Avarvari, Narcis","C3 symmetric tris(phosphonate)-1,3,5-triazine ligand: homopolymetallic complexes and its radical anion","New Journal of Chemistry","2010","34","10","2319","","10.1039/c0nj00204f","","","0.71073","MoKα","","0.1301","0.0646","","","0.167","0.2111","","","","","","0.952","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053570","16.1598","0.0004","16.1598","0.0004","19.3303","0.0011","90","","90","","90","","5047.9","0.3","223","2","223","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C28 H18 N2 O4 Zn -","- C28 H18 N2 O4 Zn -","- C224 H144 N16 O32 Zn8 -","8","0.5","","Kole, Goutam Kumar; Cairns, Amy J.; Eddaoudi, Mohamed; Vittal, Jagadese J.","Solvent-free porous framework resulted from 3D entanglement of 1D zigzag coordination polymer","New Journal of Chemistry","2010","34","11","2392","","10.1039/c0nj00217h","","","0.71073","MoKα","","0.1201","0.0784","","","0.2385","0.2733","","","","","","1.047","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053571","12.3804","0.0002","24.7338","0.0004","29.2318","0.0005","90","","91.996","0.001","90","","8945.8","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","resorcin[4]arene cavitand","","","- C98 H90 Cl6 N8 O12 -","- C98 H90 Cl6 N8 O12 -","- C392 H360 Cl24 N32 O48 -","4","1","","Kvasnica, Miroslav; Purse, Byron W.","Specific tetramethylammonium recognition drives general anion positioning in tandem sites of a deep cavitand","New Journal of Chemistry","2010","34","6","1097","","10.1039/c0nj00224k","","","0.71073","MoKα","","0.09","0.0669","","","0.1856","0.2111","","","","","","0.89","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053572","17.3295","0.0004","11.5394","0.0003","18.6004","0.0004","90","","114.031","0.001","90","","3397.17","0.14","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H54 Ca O6 -","- C32 H54 Ca O6 -","- C128 H216 Ca4 O24 -","4","1","","Deacon, Glen B.; Junk, Peter C.; Moxey, Graeme J.","Synthesis and structural characterisation of the heavier alkaline earth 2,6-di-iso-propylphenolate complexes","New Journal of Chemistry","2010","34","8","1731","","10.1039/c0nj00225a","","","0.71073","MoKα","","0.0583","0.0566","","","0.1185","0.1198","","","","","","1.257","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053573","20.0029","0.0003","20.0434","0.0003","22.7191","0.0004","64.454","0.001","72.609","0.001","61.087","0.001","7146.6","0.2","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C132 H226 O26 Sr4 -","- C132 H226 O26 Sr4 -","- C264 H452 O52 Sr8 -","2","1","","Deacon, Glen B.; Junk, Peter C.; Moxey, Graeme J.","Synthesis and structural characterisation of the heavier alkaline earth 2,6-di-iso-propylphenolate complexes","New Journal of Chemistry","2010","34","8","1731","","10.1039/c0nj00225a","","","0.71073","MoKα","","0.0552","0.0351","","","0.0823","0.0901","","","","","","1.018","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053574","10.8104","0.0002","12.7872","0.0002","15.1158","0.0003","86.878","0.001","75.068","0.001","82.643","0.001","2001.85","0.06","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H64 Ba O8 -","- C36 H64 Ba O8 -","- C72 H128 Ba2 O16 -","2","1","","Deacon, Glen B.; Junk, Peter C.; Moxey, Graeme J.","Synthesis and structural characterisation of the heavier alkaline earth 2,6-di-iso-propylphenolate complexes","New Journal of Chemistry","2010","34","8","1731","","10.1039/c0nj00225a","","","0.71073","MoKα","","0.0216","0.0196","","","0.0482","0.0494","","","","","","1.06","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053575","16.505","0.003","11.562","0.003","18.948","0.004","90","","90","","90","","3615.9","1.4","123","2","123","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C30 H68 Al K N4 -","- C30 H68 Al K N4 -","- C120 H272 Al4 K4 N16 -","4","1","","Conway, Ben; García-Álvarez, Pablo; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.; Robertson, Stuart D.","Structural insights into mono-amido tris-alkyl potassium aluminates","New Journal of Chemistry","2010","34","8","1707","","10.1039/c0nj00226g","","","1.5418","CuKα","","0.1589","0.0783","","","0.1992","0.2606","","","","","","0.943","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053576","11.3887","0.0005","18.1965","0.0008","16.9006","0.0008","90","","105.222","0.005","90","","3379.5","0.3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H64 Al K N4 -","- C28 H64 Al K N4 -","- C112 H256 Al4 K4 N16 -","4","1","","Conway, Ben; García-Álvarez, Pablo; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.; Robertson, Stuart D.","Structural insights into mono-amido tris-alkyl potassium aluminates","New Journal of Chemistry","2010","34","8","1707","","10.1039/c0nj00226g","","","0.71073","MoKα","","0.0615","0.0513","","","0.1234","0.1268","","","","","","0.985","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053577","11.5276","0.0006","18.4028","0.0008","17.3602","0.0009","90","","93.669","0.005","90","","3675.2","0.3","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H68 Al K N4 Si2 -","- C27 H68 Al K N4 Si2 -","- C108 H272 Al4 K4 N16 Si8 -","4","1","","Conway, Ben; García-Álvarez, Pablo; Kennedy, Alan R.; Klett, Jan; Mulvey, Robert E.; Robertson, Stuart D.","Structural insights into mono-amido tris-alkyl potassium aluminates","New Journal of Chemistry","2010","34","8","1707","","10.1039/c0nj00226g","","","0.71073","MoKα","","0.0843","0.0414","","","0.0887","0.0984","","","","","","0.796","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053578","10.4572","0.0002","21.0844","0.0005","15.7584","0.0004","90","","106.719","0.0004","90","","3327.6","0.13","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H53 I In N3 O -","- C32 H53 I In N3 O -","- C128 H212 I4 In4 N12 O4 -","4","1","","Piskunov, Alexandr V.; Mescheryakova, Irina N.; Fukin, Georgy K.; Cherkasov, Vladimir K.; Abakumov, Gleb A.","Indium(iii) complexes with o-iminobenzoquinone in different redox states","New Journal of Chemistry","2010","34","8","1746","","10.1039/c0nj00229a","","","0.71073","MoKα","","0.0491","0.0292","","","0.0628","0.0676","","","","","","0.999","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053579","11.3746","0.0003","11.6291","0.0003","21.8535","0.0006","85.005","0.001","82.521","0.001","68.264","0.001","2659.96","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H84 In2 N2 O2 -","- C56 H84 In2 N2 O2 -","- C112 H168 In4 N4 O4 -","2","1","","Piskunov, Alexandr V.; Mescheryakova, Irina N.; Fukin, Georgy K.; Cherkasov, Vladimir K.; Abakumov, Gleb A.","Indium(iii) complexes with o-iminobenzoquinone in different redox states","New Journal of Chemistry","2010","34","8","1746","","10.1039/c0nj00229a","","","0.71073","MoKα","","0.0299","0.0249","","","0.0621","0.0644","","","","","","1.076","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053580","11.0845","0.0005","12.522","0.0005","30.1245","0.0013","90","","90","","90","","4181.3","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H63 I2 In N3 O2 -","- C36 H63 I2 In N3 O2 -","- C144 H252 I8 In4 N12 O8 -","4","1","","Piskunov, Alexandr V.; Mescheryakova, Irina N.; Fukin, Georgy K.; Cherkasov, Vladimir K.; Abakumov, Gleb A.","Indium(iii) complexes with o-iminobenzoquinone in different redox states","New Journal of Chemistry","2010","34","8","1746","","10.1039/c0nj00229a","","","0.71073","MoKα","","0.0207","0.0193","","","0.0445","0.0451","","","","","","1.082","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053581","8.5076","0.0015","11.19","0.002","11.3624","0.0018","82.947","0.013","83.93","0.013","84.633","0.014","1063.9","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H20 Co Cu N4 O10 -","- C19 H20 Co Cu N4 O10 -","- C38 H40 Co2 Cu2 N8 O20 -","2","1","","Branzea, Diana G.; Madalan, Augustin M.; Ciattini, Samuele; Avarvari, Narcis; Caneschi, Andrea; Andruh, Marius","New heterometallic coordination polymers constructed from 3d‒3d′ binuclear nodes","New Journal of Chemistry","2010","34","11","2479","","10.1039/c0nj00238k","","","0.71073","MoKα","","0.1211","0.0621","","","0.1428","0.1733","","","","","","1.013","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053582","8.6001","0.001","11.2045","0.0015","11.3972","0.0013","83.875","0.01","84.626","0.009","84.262","0.01","1082.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H20 Cu Mn N4 O10 -","- C19 H20 Cu Mn N4 O10 -","- C38 H40 Cu2 Mn2 N8 O20 -","2","1","","Branzea, Diana G.; Madalan, Augustin M.; Ciattini, Samuele; Avarvari, Narcis; Caneschi, Andrea; Andruh, Marius","New heterometallic coordination polymers constructed from 3d‒3d′ binuclear nodes","New Journal of Chemistry","2010","34","11","2479","","10.1039/c0nj00238k","","","0.71073","MoKα","","0.09","0.0565","","","0.1066","0.1174","","","","","","1.083","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053583","10.5871","0.0016","20.8938","0.0011","16.6956","0.0016","90","","107.58","0.01","90","","3520.7","0.7","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H39 Co Cu N3 O11 -","- C37 H39 Co Cu N3 O11 -","- C148 H156 Co4 Cu4 N12 O44 -","4","1","","Branzea, Diana G.; Madalan, Augustin M.; Ciattini, Samuele; Avarvari, Narcis; Caneschi, Andrea; Andruh, Marius","New heterometallic coordination polymers constructed from 3d‒3d′ binuclear nodes","New Journal of Chemistry","2010","34","11","2479","","10.1039/c0nj00238k","","","0.71073","MoKα","","0.0977","0.0538","","","0.132","0.156","","","","","","1.031","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053584","9.7256","0.0006","10.382","0.0006","16.792","0.001","73.999","0.004","73.386","0.005","89.498","0.005","1557.26","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H32 Cu Mn N2 O11 -","- C33 H32 Cu Mn N2 O11 -","- C66 H64 Cu2 Mn2 N4 O22 -","2","1","","Branzea, Diana G.; Madalan, Augustin M.; Ciattini, Samuele; Avarvari, Narcis; Caneschi, Andrea; Andruh, Marius","New heterometallic coordination polymers constructed from 3d‒3d′ binuclear nodes","New Journal of Chemistry","2010","34","11","2479","","10.1039/c0nj00238k","","","0.71073","MoKα","","0.0646","0.0442","","","0.0952","0.1026","","","","","","1.026","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053585","9.8331","0.0015","11.3315","0.0016","13.8667","0.0019","99.618","0.011","96.924","0.012","93.266","0.012","1507.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H29 Co Cu N3 O11 -","- C29 H24 Co Cu N3 O11 -","- C58 H48 Co2 Cu2 N6 O22 -","2","1","","Branzea, Diana G.; Madalan, Augustin M.; Ciattini, Samuele; Avarvari, Narcis; Caneschi, Andrea; Andruh, Marius","New heterometallic coordination polymers constructed from 3d‒3d′ binuclear nodes","New Journal of Chemistry","2010","34","11","2479","","10.1039/c0nj00238k","","","0.71073","MoKα","","0.1067","0.0594","","","0.1316","0.1529","","","","","","1.02","","","","has coordinates,has disorder","180089","2020-10-21","18:00:00",""
"7053586","15.236","0.005","10.124","0.005","15.653","0.005","90","","93.066","0.005","90","","2411","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H28 Cu Mn N2 O12 -","- C21 H20 Cu Mn N2 O12 -","- C84 H80 Cu4 Mn4 N8 O48 -","4","1","","Branzea, Diana G.; Madalan, Augustin M.; Ciattini, Samuele; Avarvari, Narcis; Caneschi, Andrea; Andruh, Marius","New heterometallic coordination polymers constructed from 3d‒3d′ binuclear nodes","New Journal of Chemistry","2010","34","11","2479","","10.1039/c0nj00238k","","","0.71069","MoKα","","0.0649","0.0505","","","0.1391","0.1548","","","","","","1.117","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053587","18.373","0.002","4.7525","0.0004","29.191","0.003","90","","107.101","0.003","90","","2436.2","0.4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 Mn N2 O7 P2 -","- C26 H24 Mn N2 O7 P2 -","- C104 H96 Mn4 N8 O28 P8 -","4","1","","Buchaca, Ester; Man, Siud Pui; Motevalli, Majid; Wilson, John; Sullivan, Alice","N-Carbazolylmethylphosphonic acid—synthesis, metal coordination, emissive aggregate formation and spectroscopic features","New Journal of Chemistry","2010","34","11","2592","","10.1039/c0nj00260g","","","0.71073","MoKα","","0.1167","0.0861","","","0.1498","0.161","","","","","","1.137","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053588","6.3683","0.0004","30.029","0.002","7.2921","0.0005","90","","95.933","0.002","90","","1387.03","0.16","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","trans-2,3,4,5,6-pentafluoro-4'-dimethylamino-stilbene","trans-2,3,4,5,6-pentafluoro-4'-dimethylamino-stilbene","","- C16 H12 F5 N -","- C16 H12 F5 N -","- C64 H48 F20 N4 -","4","1","","Papagni, Antonio; Buttero, Paola Del; Bertarelli, Chiara; Miozzo, Luciano; Moret, Massimo; Pryce, Mary T.; Rizzato, Silvia","Novel fluorinated amino-stilbenes and their solid-state photodimerization","New Journal of Chemistry","2010","34","11","2612","","10.1039/c0nj00264j","","","0.71073","MoKα","","0.0882","0.0553","","","0.1331","0.1493","","","","","","0.818","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053589","11.9653","0.0003","28.8024","0.0006","23.1787","0.0005","90","","94.9064","0.0009","90","","7958.8","0.3","103.1","","103.1","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H134 Co3 N18 O49 P9 -","- C27 H125 Co3 N18 O49 P9 -","- C108 H500 Co12 N72 O196 P36 -","4","1","","Sunatsuki, Yukinari; Miyahara, Sho; Suzuki, Takayoshi; Kojima, Masaaki; Nakashima, Toshio; Matsumoto, Naohide; Galsbøl, Frode","Homochiral column structure of rac- and Λ-[MIII(tn)3]P3O9 (M = Co, Cr; tn = 1,3-diaminopropane; P3O9 = cyclotriphosphate(3−)) produced by multiple hydrogen bonds","New Journal of Chemistry","2010","34","12","2777","","10.1039/c0nj00270d","","","0.71075","MoKα","","","0.0666","","","","0.2057","","","","","","1.058","","","","has coordinates","275251","2022-05-09","02:09:31",""
"7053590","10.5938","0.0003","17.1108","0.0005","17.6112","0.0004","116.994","0.001","99.0448","0.0009","96.3816","0.0014","2748.12","0.13","103.1","","103.1","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H90 Cr2 N12 O33 P6 -","- C18 H88 Cr2 N12 O33 P6 -","- C36 H176 Cr4 N24 O66 P12 -","2","1","","Sunatsuki, Yukinari; Miyahara, Sho; Suzuki, Takayoshi; Kojima, Masaaki; Nakashima, Toshio; Matsumoto, Naohide; Galsbøl, Frode","Homochiral column structure of rac- and Λ-[MIII(tn)3]P3O9 (M = Co, Cr; tn = 1,3-diaminopropane; P3O9 = cyclotriphosphate(3−)) produced by multiple hydrogen bonds","New Journal of Chemistry","2010","34","12","2777","","10.1039/c0nj00270d","","","0.71075","MoKα","","","0.0411","","","","0.1378","","","","","","1.078","","","","has coordinates","275251","2022-05-09","02:09:31",""
"7053591","10.4652","0.0003","14.9511","0.0004","28.3327","0.0006","90","","90","","90","","4433.1","0.2","93.1","","93.1","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H35 Co N6 O11.5 P3 -","- C9 H35 Co N6 O11.5 P3 -","- C72 H280 Co8 N48 O92 P24 -","8","2","","Sunatsuki, Yukinari; Miyahara, Sho; Suzuki, Takayoshi; Kojima, Masaaki; Nakashima, Toshio; Matsumoto, Naohide; Galsbøl, Frode","Homochiral column structure of rac- and Λ-[MIII(tn)3]P3O9 (M = Co, Cr; tn = 1,3-diaminopropane; P3O9 = cyclotriphosphate(3−)) produced by multiple hydrogen bonds","New Journal of Chemistry","2010","34","12","2777","","10.1039/c0nj00270d","","","0.71075","MoKα","","","0.0283","","","","0.0417","","","","","","1.024","","","","has coordinates","275251","2022-05-09","02:09:31",""
"7053592","10.4697","0.0003","14.984","0.0003","28.6381","0.0006","90","","90","","90","","4492.69","0.18","103.1","","103.1","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H35 Cr N6 O11.5 P3 -","- C9 H35 Cr N6 O11.5 P3 -","- C72 H280 Cr8 N48 O92 P24 -","8","2","","Sunatsuki, Yukinari; Miyahara, Sho; Suzuki, Takayoshi; Kojima, Masaaki; Nakashima, Toshio; Matsumoto, Naohide; Galsbøl, Frode","Homochiral column structure of rac- and Λ-[MIII(tn)3]P3O9 (M = Co, Cr; tn = 1,3-diaminopropane; P3O9 = cyclotriphosphate(3−)) produced by multiple hydrogen bonds","New Journal of Chemistry","2010","34","12","2777","","10.1039/c0nj00270d","","","0.71075","MoKα","","","0.0273","","","","0.0511","","","","","","1.004","","","","has coordinates","275251","2022-05-09","02:09:31",""
"7053593","36.13","0.007","27.033","0.005","34.291","0.007","90","","108.81","0.03","90","","31703","12","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C126 H92 N14 O43 Zn8 -","- C124 H72 N13 O43 Zn8 -","- C496 H288 N52 O172 Zn32 -","4","1","","Song, Xiaokai; Zou, Yang; Liu, Xinfang; Oh, Minhak; Lah, Myoung Soo","A two-fold interpenetrated (3,6)-connected metal‒organic framework with rutile topology showing a large solvent cavity","New Journal of Chemistry","2010","34","11","2396","","10.1039/c0nj00272k","","","0.75","synchrotron","","0.1247","0.0846","","","0.2347","0.2602","","","","","","0.917","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053594","18.538","0.001","35.874","0.001","12.751","0.001","90","","90","","90","","8479.8","0.8","150","0.1","150","0.1","","","","","","","","3","A b a 2","A 2 -2ab","41","","","","- C28 H24 Si -","- C28 H24 Si -","- C448 H384 Si16 -","16","","","Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien","Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation","New Journal of Chemistry","2010","34","10","2290","","10.1039/c0nj00274g","","","0.71069","MoKα","","0.0683","0.0404","","","0.0884","0.1191","","","","","","1.062","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053595","17.026","0.001","9.952","0.001","13.23","0.001","90","","90","","90","","2241.7","0.3","150","0.1","150","0.1","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C30 H28 Si -","- C30 H28 Si -","- C120 H112 Si4 -","4","0.5","","Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien","Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation","New Journal of Chemistry","2010","34","10","2290","","10.1039/c0nj00274g","","","0.71069","MoKα","","0.1067","0.0892","","","0.236","0.2523","","","","","","1.064","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053596","8.74","0.001","9.839","0.001","13.604","0.001","104.023","0.001","105.022","0.001","102.433","0.001","1046.81","0.18","150","0.1","150","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C29 H24 Si -","- C29 H24 Si -","- C58 H48 Si2 -","2","1","","Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien","Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation","New Journal of Chemistry","2010","34","10","2290","","10.1039/c0nj00274g","","","0.71069","MoKα","","0.0848","0.0485","","","0.1168","0.1304","","","","","","1.035","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053597","9.389","0.001","10.038","0.001","12.922","0.001","92.983","0.001","90.812","0.001","99.215","0.001","1200.2","0.2","150","0.1","150","0.1","","","","","","","","3","P -1","-P 1","2","","","","- C33 H26 Si -","- C33 H26 Si -","- C66 H52 Si2 -","2","1","","Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien","Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation","New Journal of Chemistry","2010","34","10","2290","","10.1039/c0nj00274g","","","0.71069","MoKα","","0.0572","0.0423","","","0.1101","0.1176","","","","","","1.07","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053598","9.4","0.001","11.887","0.001","24.07","0.001","90","","90","","90","","2689.5","0.4","150","0.1","150","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H34 B Nd O Si -","- C32 H34 B Nd O Si -","- C128 H136 B4 Nd4 O4 Si4 -","4","1","","Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien","Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation","New Journal of Chemistry","2010","34","10","2290","","10.1039/c0nj00274g","","","0.71069","MoKα","","0.0548","0.038","","","0.0913","0.1367","","","","","","1.084","","","","has coordinates","180089","2020-10-21","18:00:00",""
"7053599","9.198","0.001","11.563","0.001","15.325","0.001","97.919","0.001","93.629","0.001","93.853","0.001","1606.4","0.2","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C37.5 H42 B Nd O Si -","- C37.5 H42 B Nd O Si -","- C75 H84 B2 Nd2 O2 Si2 -","2","1","","Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien","Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation","New Journal of Chemistry","2010","34","10","2290","","10.1039/c0nj00274g","","","0.71069","MoKα","","0.032","0.0275","","","0.0729","0.0792","","","","","","1.033","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053600","8.747","0.001","34.629","0.001","9.214","0.001","90","","92.708","0.001","90","","2787.8","0.4","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H34 B Nd O Si -","- C33 H34 B Nd O Si -","- C132 H136 B4 Nd4 O4 Si4 -","4","1","","Cortial, Guillaume; Le Goff, Xavier-Frederic; Bousquié, Magali; Boisson, Christophe; Le Floch, Pascal; Nief, François; Thuilliez, Julien","Neutral ansa-bis(fluorenyl)silane neodymium borohydrides: synthesis, structural study and behaviour as catalysts in butadiene‒ethylene copolymerisation","New Journal of Chemistry","2010","34","10","2290","","10.1039/c0nj00274g","","","0.71069","MoKα","","0.0583","0.0529","","","0.1495","0.1543","","","","","","1.202","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053601","7.4582","0.0011","9.4917","0.0014","9.6997","0.0014","113.399","0.004","106.638","0.004","98.603","0.004","576.1","0.15","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H28 Cu N8 O14 -","- C14 H28 Cu N8 O14 -","- C14 H28 Cu N8 O14 -","1","0.5","","Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.","Metal-induced gelation in dipyridyl ureas","New Journal of Chemistry","2010","34","10","2261","","10.1039/c0nj00278j","","","0.71073","MoKα","","0.0676","0.0449","","","0.1043","0.1132","","","","","","1.024","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053602","5.5449","0.0016","13.819","0.004","15.927","0.005","85.794","0.008","84.557","0.008","87.26","0.007","1210.6","0.6","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H40 Ag2 Cl6 N16 O10 -","- C34 H40 Ag2 Cl6 N16 O10 -","- C34 H40 Ag2 Cl6 N16 O10 -","1","0.5","","Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.","Metal-induced gelation in dipyridyl ureas","New Journal of Chemistry","2010","34","10","2261","","10.1039/c0nj00278j","","","0.71073","MoKα","","0.0812","0.0515","","","0.1132","0.1246","","","","","","1.038","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053603","6.8864","0.0005","12.043","0.001","13.2699","0.001","78.535","0.003","77.905","0.003","78.335","0.003","1039.71","0.14","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H27 Ag N6 O8 -","- C16 H27 Ag N6 O8 -","- C32 H54 Ag2 N12 O16 -","2","1","","Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.","Metal-induced gelation in dipyridyl ureas","New Journal of Chemistry","2010","34","10","2261","","10.1039/c0nj00278j","","","0.71073","MoKα","","0.0619","0.0407","","","0.0775","0.0829","","","","","","0.928","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053604","9.026","0.0008","16.3903","0.0017","14.0277","0.0014","90","","97.969","0.003","90","","2055.2","0.3","120","2","120","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","srv354m","","","- C17 H23 Ag F3 N7 O3 Si0.5 -","- C17 H23 Ag F3 N7 O3 Si0.5 -","- C68 H92 Ag4 F12 N28 O12 Si2 -","4","1","","Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.","Metal-induced gelation in dipyridyl ureas","New Journal of Chemistry","2010","34","10","2261","","10.1039/c0nj00278j","","","0.71073","MoKα","","0.0796","0.0406","","","0.0666","0.0741","","","","","","0.833","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053605","9.1412","0.0013","9.2472","0.0012","11.3257","0.0015","84.346","0.004","84.501","0.004","87.385","0.004","947.7","0.2","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H20 Ag B F4 N6 O3 -","- C15 H20 Ag B F4 N6 O3 -","- C30 H40 Ag2 B2 F8 N12 O6 -","2","1","","Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.","Metal-induced gelation in dipyridyl ureas","New Journal of Chemistry","2010","34","10","2261","","10.1039/c0nj00278j","","","0.71073","MoKα","","0.0507","0.0324","","","0.0589","0.0625","","","","","","0.916","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053606","24.723","0.003","17.1669","0.0019","17.388","0.002","90","","90","","90","","7379.8","1.5","173","2","173","2","","","","","","","","5","P m c 21","P 2c -2","26","thf macrocycle","","","- C74 H92 Ag2 N14 O16 -","- C74 H92 Ag2.2 N14 O16 -","- C296 H368 Ag8.8 N56 O64 -","4","1","","Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.","Metal-induced gelation in dipyridyl ureas","New Journal of Chemistry","2010","34","10","2261","","10.1039/c0nj00278j","","","0.71073","MoKα","","0.0901","0.0617","","","0.1551","0.1711","","","","","","0.955","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053607","24.965","0.003","8.6312","0.0009","21.09","0.003","90","","105.509","0.003","90","","4379","0.9","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H25 Ag N7 O6.5 -","- C18 H25 Ag N7 O6.5 -","- C144 H200 Ag8 N56 O52 -","8","1","","Byrne, Peter; Lloyd, Gareth O.; Applegarth, Lucas; Anderson, Kirsty M.; Clarke, Nigel; Steed, Jonathan W.","Metal-induced gelation in dipyridyl ureas","New Journal of Chemistry","2010","34","10","2261","","10.1039/c0nj00278j","","","0.71073","MoKα","","0.0603","0.0374","","","0.0797","0.0861","","","","","","0.945","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053608","17.365","0.004","5.9559","0.0012","35.48","0.007","90","","90","","90","","3669.5","1.3","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H29 B Fe N2 -","- C18 H29 B Fe N2 -","- C144 H232 B8 Fe8 N16 -","8","2","","Corrente, Andrea M.; Chivers, Tristram","Syntheses and structures of new alkali-metal boraamidinates and ferrocenyl aminoboranes","New Journal of Chemistry","2010","34","8","1751","","10.1039/c0nj00279h","","","0.71073","MoKα","","0.057","0.0428","","","0.0981","0.1121","","","","","","1.126","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053609","21.451","0.004","10.016","0.002","28.699","0.006","90","","99.88","0.03","90","","6075","2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H45 B Fe N2 -","- C34 H45 B Fe N2 -","- C272 H360 B8 Fe8 N16 -","8","1","","Corrente, Andrea M.; Chivers, Tristram","Syntheses and structures of new alkali-metal boraamidinates and ferrocenyl aminoboranes","New Journal of Chemistry","2010","34","8","1751","","10.1039/c0nj00279h","","","0.71073","MoKα","","0.1062","0.0525","","","0.1189","0.138","","","","","","1.081","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053610","10.265","0.002","12.189","0.002","13.101","0.003","109.7","0.03","102.12","0.03","103.19","0.03","1427.1","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H48 B2 Fe N4 -","- C26 H48 B2 Fe N4 -","- C52 H96 B4 Fe2 N8 -","2","1","","Corrente, Andrea M.; Chivers, Tristram","Syntheses and structures of new alkali-metal boraamidinates and ferrocenyl aminoboranes","New Journal of Chemistry","2010","34","8","1751","","10.1039/c0nj00279h","","","0.71073","MoKα","","0.0462","0.0366","","","0.0907","0.0966","","","","","","1.043","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053611","10.003","0.002","14.712","0.003","19.859","0.004","90","","91.29","0.03","90","","2921.8","1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H88 B2 Li4 N4 O6 -","- C46 H88 B2 Li4 N4 O6 -","- C92 H176 B4 Li8 N8 O12 -","2","0.5","","Corrente, Andrea M.; Chivers, Tristram","Syntheses and structures of new alkali-metal boraamidinates and ferrocenyl aminoboranes","New Journal of Chemistry","2010","34","8","1751","","10.1039/c0nj00279h","","","0.71073","MoKα","","0.0877","0.0679","","","0.207","0.2254","","","","","","1.074","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053612","14.028","0.003","16.356","0.003","16.606","0.003","90","","103.66","0.03","90","","3702.3","1.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H56 B Li N2 O2 -","- C38 H56 B Li N2 O2 -","- C152 H224 B4 Li4 N8 O8 -","4","1","","Corrente, Andrea M.; Chivers, Tristram","Syntheses and structures of new alkali-metal boraamidinates and ferrocenyl aminoboranes","New Journal of Chemistry","2010","34","8","1751","","10.1039/c0nj00279h","","","0.71073","MoKα","","0.1165","0.074","","","0.1684","0.1958","","","","","","1.059","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053613","10.456","0.002","15.323","0.003","27.854","0.006","90","","90.91","0.03","90","","4462.1","1.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H63 B K2 N2 O3 -","- C42 H63 B K2 N2 O3 -","- C168 H252 B4 K8 N8 O12 -","4","1","","Corrente, Andrea M.; Chivers, Tristram","Syntheses and structures of new alkali-metal boraamidinates and ferrocenyl aminoboranes","New Journal of Chemistry","2010","34","8","1751","","10.1039/c0nj00279h","","","0.71073","MoKα","","0.1202","0.0859","","","0.1908","0.2078","","","","","","1.093","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053614","12.3777","0.0004","27.7038","0.0011","19.9823","0.0007","90","","100.12","0.002","90","","6745.5","0.4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C61.5 H81.5 Cl Fe2 N8 O15.25 -","- C61.5 H81.5 Cl Fe2 N8 O15.25 -","- C246 H326 Cl4 Fe8 N32 O61 -","4","1","","Jarenmark, Martin; Turitsyna, Elena A.; Haukka, Matti; Shteinman, Albert A.; Nordlander, Ebbe","A monocarboxylate-bridged diiron(iii) μ-oxido complex that catalyzes alkane oxidation by hydrogen peroxide","New Journal of Chemistry","2010","34","10","2118","","10.1039/c0nj00293c","","","0.71073","MoKα","","0.1448","0.0663","","","0.1526","0.1878","","","","","","1.024","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053615","11.715","0.001","21.218","0.001","23.598","0.001","90","","91.563","0.001","90","","5863.5","0.6","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H56 Cl9 N2 P4 Rh -","- C55 H54 Cl7 N2 P4 Rh -","- C220 H216 Cl28 N8 P16 Rh4 -","4","1","","Buchard, Antoine; Payet, Elina; Auffrant, Audrey; Goff, Xavier Le; Floch, Pascal Le","Iminophosphorane-based [P2N2] rhodium complexes: synthesis, reactivity, and application in catalysed transfer hydrogenation of polar bonds","New Journal of Chemistry","2010","34","12","2943","","10.1039/c0nj00299b","","","0.71069","MoKα","","0.0485","0.0376","","","0.0953","0.0993","","","","","","1.053","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053616","12.299","0.001","19.674","0.001","22.075","0.001","90","","90","","90","","5341.5","0.6","150","0.1","150","0.1","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C54 H52 B Cl4 F4 N2 P4 Rh -","- C54 H52 B Cl4 F4 N2 P4 Rh -","- C216 H208 B4 Cl16 F16 N8 P16 Rh4 -","4","1","","Buchard, Antoine; Payet, Elina; Auffrant, Audrey; Goff, Xavier Le; Floch, Pascal Le","Iminophosphorane-based [P2N2] rhodium complexes: synthesis, reactivity, and application in catalysed transfer hydrogenation of polar bonds","New Journal of Chemistry","2010","34","12","2943","","10.1039/c0nj00299b","","","0.71069","MoKα","","0.0509","0.0354","","","0.0724","0.0777","","","","","","0.993","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053617","10.806","0.001","35.589","0.001","16.434","0.001","90","","100.108","0.001","90","","6222","0.7","150","0.1","150","0.1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C55 H51 B Cl11 F4 N2 P4 Rh -","- C55 H51 B Cl11 F4 N2 P4 Rh -","- C220 H204 B4 Cl44 F16 N8 P16 Rh4 -","4","1","","Buchard, Antoine; Payet, Elina; Auffrant, Audrey; Goff, Xavier Le; Floch, Pascal Le","Iminophosphorane-based [P2N2] rhodium complexes: synthesis, reactivity, and application in catalysed transfer hydrogenation of polar bonds","New Journal of Chemistry","2010","34","12","2943","","10.1039/c0nj00299b","","","0.71069","MoKα","","0.0804","0.0476","","","0.1242","0.1444","","","","","","1.032","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053618","19.416","0.001","24.922","0.001","10.803","0.001","90","","90","","90","","5227.4","0.6","150","0.1","150","0.1","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C58 H57 Cl6 N2 P4 Rh -","- C52 H48 Cl3 N2 P4 Rh -","- C208 H192 Cl12 N8 P16 Rh4 -","4","1","","Buchard, Antoine; Payet, Elina; Auffrant, Audrey; Goff, Xavier Le; Floch, Pascal Le","Iminophosphorane-based [P2N2] rhodium complexes: synthesis, reactivity, and application in catalysed transfer hydrogenation of polar bonds","New Journal of Chemistry","2010","34","12","2943","","10.1039/c0nj00299b","","","0.71069","MoKα","","0.1201","0.061","","","0.1254","0.1394","","","","","","0.931","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053619","5.4103","0.0011","9.7287","0.0019","21.814","0.004","90","","94.84","0.03","90","","1144.1","0.4","293","2","293","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C32 H26 -","- C32 H26 -","- C64 H52 -","2","0.5","","Xu, Bin; Fang, Honghua; Dong, Yujie; Chen, Feipeng; Chen, Qidai; Sun, Hongbo; Tian, Wenjing","Solid state emission enhancement of 9,10-distyrylanthracene derivatives and amplified spontaneous emission from a large single crystal","New Journal of Chemistry","2010","34","9","1838","","10.1039/c0nj00300j","","","0.71073","MoKα","","0.2362","0.099","","","0.1602","0.2074","","","","","","1.022","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053620","13.571","0.003","16.443","0.005","8.265","0.004","90","","90","","90","","1844.3","1.1","100","2","100","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C20 H14 Cd N4 O4 -","- C20 H14 Cd N4 O4 -","- C80 H56 Cd4 N16 O16 -","4","0.5","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0385","0.0328","","","0.0767","0.0833","","","","","","1.061","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053621","18.29","0.002","16.292","0.005","13.675","0.004","90","","120.33","0.004","90","","3517.2","1.5","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H40 Cd N6 O10 -","- C34 H40 Cd N6 O10 -","- C136 H160 Cd4 N24 O40 -","4","0.5","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0392","0.0346","","","0.0831","0.0931","","","","","","1.086","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053622","23.494","0.005","23.494","0.005","10.003","0.003","90","","90","","120","","4782","2","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C20 H14 Cu N4 O4 -","- C20 H14 Cu N4 O4 -","- C180 H126 Cu9 N36 O36 -","9","0.5","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0763","0.0549","","","0.1779","0.2118","","","","","","1.122","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053623","13.71","0.005","8.481","0.003","19.343","0.005","90","","101.405","0.005","90","","2204.7","1.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H18 Cd2 N4 O9 -","- C22 H18 Cd2 N4 O9 -","- C88 H72 Cd8 N16 O36 -","4","1","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0378","0.0314","","","0.077","0.0901","","","","","","1.095","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053624","9.147","0.005","9.219","0.002","14.604","0.003","97.973","0.005","104.956","0.004","104.565","0.005","1123.9","0.7","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C40 H33 Cd2 N8 O11 -","- C40 H33 Cd2 N8 O11 -","- C40 H33 Cd2 N8 O11 -","1","1","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.057","0.0514","","","0.1375","0.1462","","","","","","1.094","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053625","18.725","0.003","8.1","0.005","16.297","0.004","90","","103.873","0.005","90","","2399.7","1.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H10 Cd N2 O4 -","- C12 H10 Cd N2 O4 -","- C96 H80 Cd8 N16 O32 -","8","1","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.039","0.0303","","","0.0821","0.1084","","","","","","1.125","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053626","14.865","0.005","14.865","0.005","13.139","0.004","90","","90","","90","","2903.3","1.6","100","2","100","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C50 H48 Cd2 N10 O13 -","- C50 H38 Cd2 N10 O13 -","- C100 H76 Cd4 N20 O26 -","2","0.25","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0751","0.0692","","","0.2208","0.2269","","","","","","1.223","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053627","25.391","0.004","19.896","0.005","7.556","0.004","90","","90","","90","","3817","2","100","2","100","2","","","","","","","","5","A b a 2","A 2 -2ab","41","","","","- C20 H14 N4 O4 Zn -","- C20 H14 N4 O4 Zn -","- C160 H112 N32 O32 Zn8 -","8","","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0435","0.0347","","","0.0758","0.0821","","","","","","0.996","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053628","19.37","0.005","10.292","0.003","20.59","0.004","90","","114.102","0.005","90","","3746.9","1.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H30 Cd2 N8 O9 -","- C40 H30 Cd2 N8 O9 -","- C160 H120 Cd8 N32 O36 -","4","1","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0422","0.0364","","","0.0902","0.0942","","","","","","1.122","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053629","11.063","0.004","18.938","0.005","29.918","0.002","90","","99.625","0.003","90","","6180","3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C64 H56 Cd3 N12 O15 -","- C64 H55 Cd3 N12 O15 -","- C256 H220 Cd12 N48 O60 -","4","1","","Aijaz, Arshad; Lama, Prem; Sañudo, E. Carolina; Mishra, Rupali; Bharadwaj, Parimal K.","Coordination polymers of various architectures built with mixed imidazole/benzimidazole and carboxylate donor ligands and different metal ions: syntheses, structural features and magnetic properties","New Journal of Chemistry","2010","34","11","2502","","10.1039/c0nj00302f","","","0.71073","MoKα","","0.0782","0.058","","","0.1465","0.1638","","","","","","1.038","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053630","14.448","0.007","15.407","0.007","25.575","0.011","90","","91.1","0.008","90","","5692","5","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C37 H80 Cu3 N6 O8 P3 S6 -","- C37 H80 Cu3 N6 O8 P3 S6 -","- C148 H320 Cu12 N24 O32 P12 S24 -","4","1","","Luckay, Robert C.; Sheng, Xia; Strasser, Christoph E.; Raubenheimer, Helgard G.; Safin, Damir A.; Babashkina, Maria G.; Klein, Axel","Aerial oxidation of tetrahydrofuran to 2-hydroxotetrahydrofuran in the presence of a trimeric CuI complex [Cu3L3] (HL = tBuNHC(S)NHP(S)(OiPr)2) and trapping of the unstable product at recrystallization","New Journal of Chemistry","2010","34","12","2835","","10.1039/c0nj00314j","","","0.71073","MoKα","","0.09","0.0696","","","0.1465","0.155","","","","","","1.13","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053631","9.0709","0.0007","17.7102","0.0013","21.708","0.0016","90","","100.621","0.001","90","","3427.6","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H76 N6 O18 S4 Tm2 -","- C64 H76 N6 O18 S4 Tm2 -","- C128 H152 N12 O36 S8 Tm4 -","2","0.5","","Dai, Fangna; Gong, Shuwen; Cui, Peipei; Zhang, Guoqing; Qiu, Xiaoliang; Ye, Fei; Sun, Daofeng; Pang, Zhijian; Zhang, Lei; Dong, Guilin; Zhang, Changqiao","The effect of the conformation of flexible carboxylate ligands on the structures of metal‒organic supramolecules","New Journal of Chemistry","2010","34","11","2496","","10.1039/c0nj00328j","","","0.71073","MoKα","","0.0663","0.0339","","","0.073","0.0853","","","","","","1.009","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053632","7.8023","0.0006","31.614","0.002","15.269","0.0012","90","","103.204","0.002","90","","3666.7","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H28 N2 O6 S2 Zn -","- C34 H24 N2 O6 S2 Zn -","- C136 H96 N8 O24 S8 Zn4 -","4","1","","Dai, Fangna; Gong, Shuwen; Cui, Peipei; Zhang, Guoqing; Qiu, Xiaoliang; Ye, Fei; Sun, Daofeng; Pang, Zhijian; Zhang, Lei; Dong, Guilin; Zhang, Changqiao","The effect of the conformation of flexible carboxylate ligands on the structures of metal‒organic supramolecules","New Journal of Chemistry","2010","34","11","2496","","10.1039/c0nj00328j","","","0.71073","MoKα","","0.1088","0.0758","","","0.2053","0.2316","","","","","","1.031","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053633","12.2854","0.0019","13.199","0.002","14.514","0.002","66.739","0.002","65.433","0.003","63.684","0.002","1853.5","0.5","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H41 O12 Zn2 -","- C39 H41 O12 Zn2 -","- C78 H82 O24 Zn4 -","2","1","","Dai, Fangna; Gong, Shuwen; Cui, Peipei; Zhang, Guoqing; Qiu, Xiaoliang; Ye, Fei; Sun, Daofeng; Pang, Zhijian; Zhang, Lei; Dong, Guilin; Zhang, Changqiao","The effect of the conformation of flexible carboxylate ligands on the structures of metal‒organic supramolecules","New Journal of Chemistry","2010","34","11","2496","","10.1039/c0nj00328j","","","0.71073","MoKα","","0.118","0.0548","","","0.1036","0.1293","","","","","","0.978","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053634","10.6231","0.0015","18.888","0.003","24.412","0.003","72.853","0.003","86.22","0.003","76.854","0.003","4557.9","1.1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C80 H72 F52 O12 -","- C80 H72 F52 O12 -","- C160 H144 F104 O24 -","2","1","","Chu, Qianli; O'Neal, Kristi; Osipov, Maksim; Ngwendson, Julius N.; Geib, Steven J.; Weber, Stephen G.; Curran, Dennis P.","Synthesis, characterization, and applications of fluorous resorcin[4]arenes","New Journal of Chemistry","2010","34","12","2732","","10.1039/c0nj00344a","","","0.71073","MoKα","","0.214","0.1203","","","0.3165","0.3683","","","","","","1.032","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053635","9.6229","0.0013","11.6668","0.0015","14.386","0.002","69.834","0.005","83.695","0.007","67.156","0.006","1396.6","0.3","163.1","","163","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H76 Cl2 N4 O4 Pd -","- C60 H76 Cl2 N4 O4 Pd -","- C60 H76 Cl2 N4 O4 Pd -","1","0.5","","Han, Mina; Hirade, Tomohiro; Hara, Masahiko","A reversibly photoswitchable mononuclear palladium(ii) complex with ortho-diethylated azobenzene ligands","New Journal of Chemistry","2010","34","12","2887","","10.1039/c0nj00345j","","","0.7107","MoKα","","0.0543","0.0415","","","0.0997","0.1089","","","","","","1.016","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053636","11.591","0.004","10.437","0.004","8.892","0.003","90","","105.27","0.02","90","","1037.7","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(2-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","(2-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","","- C9 H9 N5 O3 -","- C9 H9 N5 O3 -","- C36 H36 N20 O12 -","4","1","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.1246","0.0689","","","0.1275","0.145","","","","","","1.188","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053637","12.316","0.004","10.616","0.003","7.863","0.003","90","","92.39","0.03","90","","1027.2","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","(3-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","(3-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","","- C9 H9 N5 O3 -","- C9 H9 N5 O3 -","- C36 H36 N20 O12 -","4","1","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.0692","0.0482","","","0.1149","0.1232","","","","","","1.099","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053638","6.948","0.003","20.546","0.006","7.362","0.003","90","","93.56","0.03","90","","1048.9","0.7","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","(4-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","(4-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","","- C9 H9 N5 O3 -","- C9 H9 N5 O3 -","- C36 H36 N20 O12 -","4","1","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.0361","0.0328","","","0.0851","0.087","","","","","","1.058","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053639","14.202","0.004","14.267","0.004","11.223","0.003","90","","90","","90","","2274","1.1","100","2","100","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","(2,4-dinitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","(2,4-dinitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","","- C9 H8 N6 O5 -","- C9 H8 N6 O5 -","- C72 H64 N48 O40 -","8","1","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.0732","0.0481","","","0.1054","0.1141","","","","","","1.161","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053640","12.882","0.004","8.44","0.003","21.129","0.007","90","","100.04","0.03","90","","2262.1","1.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(2-chloro-6-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","(2-chloro-6-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","","- C9 H8 Cl N5 O3 -","- C9 H8 Cl N5 O3 -","- C72 H64 Cl8 N40 O24 -","8","2","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.1898","0.0789","","","0.1421","0.166","","","","","","1.052","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053641","7.143","0.002","21.329","0.006","7.429","0.002","90","","94.31","0.03","90","","1128.6","0.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(4-chloro-3-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","(4-chloro-3-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","","- C9 H8 Cl N5 O3 -","- C9 H8 Cl N5 O3 -","- C36 H32 Cl4 N20 O12 -","4","1","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.0409","0.035","","","0.0928","0.0954","","","","","","1.103","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053642","12.386","0.004","10.764","0.003","8.407","0.003","90","","93.08","0.02","90","","1119.2","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(4-chloro-3-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","(4-chloro-3-nitrophenyl)(4H-1,2,4-triazole-4-ylamino)methanol","","- C9 H8 Cl N5 O3 -","- C9 H8 Cl N5 O3 -","- C36 H32 Cl4 N20 O12 -","4","1","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.0355","0.0286","","","0.0717","0.0755","","","","","","1.052","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053643","16.286","0.005","7.007","0.002","19.746","0.006","90","","91.24","0.03","90","","2252.8","1.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(2,4-dinitrobenzylidene)-4H-1,2,4-triazole-4-amine","N-(2,4-dinitrobenzylidene)-4H-1,2,4-triazole-4-amine","","- C9 H6 N6 O4 -","- C9 H6 N6 O4 -","- C72 H48 N48 O32 -","8","2","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.1489","0.0487","","","0.0973","0.1307","","","","","","0.952","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053644","3.87","0.002","10.917","0.004","23.019","0.007","90","","94.18","0.03","90","","969.9","0.7","230","2","230","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(3-nitrobenzylidene)-4H-1,2,4-triazole-4-amine","N-(3-nitrobenzylidene)-4H-1,2,4-triazole-4-amine","","- C9 H7 N5 O2 -","- C9 H7 N5 O2 -","- C36 H28 N20 O8 -","4","1","","Barys, Maciej; Ciunik, Zbigniew; Drabent, Krzysztof; Kwiecień, Anna","Stable hemiaminals containing a triazole ring","New Journal of Chemistry","2010","34","11","2605","","10.1039/c0nj00346h","","","0.71073","MoKα","","0.0807","0.0422","","","0.0964","0.1053","","","","","","0.966","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053645","13.47","0.003","11.61","0.003","15.371","0.003","90","","99.904","0.004","90","","2368","0.9","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","work","","","- C17 H22 Cd I2 N4 O S2 -","- C17 H22 Cd I2 N4 O S2 -","- C68 H88 Cd4 I8 N16 O4 S8 -","4","1","","Potts, Storm V.; Barbour, Leonard J.","Solvent-mediated conformational similarities within a series of 1D coordination polymers constructed from a new flexible ditopic bis-imidazole ligand","New Journal of Chemistry","2010","34","11","2451","","10.1039/c0nj00357c","","","0.71073","MoKα","","0.0462","0.0378","","","0.0827","0.0865","","","","","","1.076","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053646","31.625","0.003","11.0517","0.001","16.3433","0.0015","90","","119.084","0.001","90","","4991.9","0.8","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","work","","","- C18 H24 Cd I2 N4 O S2 -","- C18 H24 Cd I2 N4 O S2 -","- C144 H192 Cd8 I16 N32 O8 S16 -","8","1","","Potts, Storm V.; Barbour, Leonard J.","Solvent-mediated conformational similarities within a series of 1D coordination polymers constructed from a new flexible ditopic bis-imidazole ligand","New Journal of Chemistry","2010","34","11","2451","","10.1039/c0nj00357c","","","0.71073","MoKα","","0.049","0.0396","","","0.0885","0.0923","","","","","","1.06","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053647","9.6481","0.0009","11.2186","0.001","14.1622","0.0013","112.023","0.001","91.681","0.002","101.926","0.002","1380.7","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","work","","","- C21 H26 Cd I2 N6 S2 -","- C21 H26 Cd I2 N6 S2 -","- C42 H52 Cd2 I4 N12 S4 -","2","1","","Potts, Storm V.; Barbour, Leonard J.","Solvent-mediated conformational similarities within a series of 1D coordination polymers constructed from a new flexible ditopic bis-imidazole ligand","New Journal of Chemistry","2010","34","11","2451","","10.1039/c0nj00357c","","","0.71073","MoKα","","0.0568","0.0472","","","0.1118","0.1171","","","","","","1.078","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053648","32.585","0.004","10.2983","0.0014","19.944","0.003","90","","125.829","0.002","90","","5426.2","1.3","100","2","100","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","4","","","- C19 H28 Cd I2 N4 O2 S2 -","- C19 H28 Cd I2 N4 O2 S2 -","- C152 H224 Cd8 I16 N32 O16 S16 -","8","1","","Potts, Storm V.; Barbour, Leonard J.","Solvent-mediated conformational similarities within a series of 1D coordination polymers constructed from a new flexible ditopic bis-imidazole ligand","New Journal of Chemistry","2010","34","11","2451","","10.1039/c0nj00357c","","","0.71073","MoKα","","0.0803","0.0567","","","0.108","0.1166","","","","","","1.068","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053649","11.866","0.005","12.25","0.005","15.775","0.007","100.107","0.004","100.94","0.004","104.311","0.005","2121","1.6","103.15","","103","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H29 B F2 N2 O -","- C23 H29 B F2 N2 O -","- C92 H116 B4 F8 N8 O4 -","4","2","","Yamashita, Makoto; Aramaki, Yoshitaka; Nozaki, Kyoko","Reduction of base-stabilized difluoroboranes to induce rearrangement reactions","New Journal of Chemistry","2010","34","8","1774","","10.1039/c0nj00363h","","","0.7107","MoKα","","0.1021","0.0797","","","0.1969","0.2153","","","","","","1.104","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053650","13.975","0.006","11.39","0.005","14.556","0.007","90","","114.763","0.0019","90","","2103.9","1.6","103.15","","103","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C23 H31 B F2 N2 -","- C23 H31 B F2 N2 -","- C92 H124 B4 F8 N8 -","4","1","","Yamashita, Makoto; Aramaki, Yoshitaka; Nozaki, Kyoko","Reduction of base-stabilized difluoroboranes to induce rearrangement reactions","New Journal of Chemistry","2010","34","8","1774","","10.1039/c0nj00363h","","","0.7107","MoKα","","0.0697","0.0585","","","0.1406","0.1493","","","","","","1.124","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053651","10.937","0.0013","11.0234","0.001","20.18","0.002","90","","101.403","0.0018","90","","2384.9","0.4","163.15","","163","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H37 B F2 N2 -","- C25 H37 B F2 N2 -","- C100 H148 B4 F8 N8 -","4","1","","Yamashita, Makoto; Aramaki, Yoshitaka; Nozaki, Kyoko","Reduction of base-stabilized difluoroboranes to induce rearrangement reactions","New Journal of Chemistry","2010","34","8","1774","","10.1039/c0nj00363h","","","0.7107","MoKα","","0.0495","0.0449","","","0.1024","0.1053","","","","","","1.117","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053652","10.393","0.008","17.539","0.013","11.564","0.009","90","","99.422","0.005","90","","2079","3","103.15","","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H58 B2 F2 N4 O2 -","- C46 H58 B2 F2 N4 O2 -","- C92 H116 B4 F4 N8 O4 -","2","0.5","","Yamashita, Makoto; Aramaki, Yoshitaka; Nozaki, Kyoko","Reduction of base-stabilized difluoroboranes to induce rearrangement reactions","New Journal of Chemistry","2010","34","8","1774","","10.1039/c0nj00363h","","","0.7107","MoKα","","0.1656","0.1355","","","0.3076","0.3278","","","","","","1.268","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053653","9.44","0.005","10.504","0.005","10.892","0.005","89.733","0.003","107.726","0.006","103.128","0.007","999.4","0.8","103.15","","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H31 B N2 -","- C23 H31 B N2 -","- C46 H62 B2 N4 -","2","1","","Yamashita, Makoto; Aramaki, Yoshitaka; Nozaki, Kyoko","Reduction of base-stabilized difluoroboranes to induce rearrangement reactions","New Journal of Chemistry","2010","34","8","1774","","10.1039/c0nj00363h","","","0.7107","MoKα","","0.0471","0.0401","","","0.0923","0.0968","","","","","","1.069","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053654","9.969","0.004","10.684","0.005","11.315","0.005","85.714","0.013","77.331","0.012","83.324","0.013","1166.3","0.9","103.15","","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H37 B N2 -","- C25 H37 B N2 -","- C50 H74 B2 N4 -","2","1","","Yamashita, Makoto; Aramaki, Yoshitaka; Nozaki, Kyoko","Reduction of base-stabilized difluoroboranes to induce rearrangement reactions","New Journal of Chemistry","2010","34","8","1774","","10.1039/c0nj00363h","","","0.7107","MoKα","","0.052","0.043","","","0.1006","0.1066","","","","","","1.081","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053655","13.0139","0.0013","27.361","0.003","17.7274","0.0018","90","","90.687","0.005","90","","6311.8","1.1","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H69 N13 O21 Zn2 -","- C54 H53 N13 O21 Zn2 -","- C216 H212 N52 O84 Zn8 -","4","1","","Hamilton, Tamara D.; Bučar, Dejan-Krešimir; MacGillivray, Leonard R.","A metal‒organic framework with three cavities based on three-coloured square tiling derived from a cyclobutane constructed in the solid state","New Journal of Chemistry","2010","34","11","2400","","10.1039/c0nj00367k","","","0.71069","MoKα","","0.1438","0.0901","","","0.2344","0.2624","","","","","","1.079","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053656","8.327","0.0014","9.7525","0.0017","9.9181","0.0017","101.562","0.002","108.428","0.001","100.982","0.002","720.2","0.2","183","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H20 Eu2 N4 O18 -","- C26 H20 Eu2 N4 O18 -","- C26 H20 Eu2 N4 O18 -","1","0.5","","Zhang, Lijuan; Xu, Donghua; Zhou, Yunshan; Jiang, Fei","Design of 3-D europium(iii)‒organic frameworks based on pyridine carboxylate N-oxide and acyclic binary carboxylate: syntheses, structures, and luminescence properties","New Journal of Chemistry","2010","34","11","2470","","10.1039/c0nj00373e","","","0.71073","MoKα","","0.0242","0.0209","","","0.0431","0.044","","","","","","1.003","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053657","19.77","0.004","7.7544","0.0012","13.932","0.003","90","","120.527","0.002","90","","1839.8","0.6","93","2","93","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 Eu2 O15 -","- C12 H16 Eu2 O15 -","- C48 H64 Eu8 O60 -","4","0.5","","Zhang, Lijuan; Xu, Donghua; Zhou, Yunshan; Jiang, Fei","Design of 3-D europium(iii)‒organic frameworks based on pyridine carboxylate N-oxide and acyclic binary carboxylate: syntheses, structures, and luminescence properties","New Journal of Chemistry","2010","34","11","2470","","10.1039/c0nj00373e","","","0.71073","MoKα","","0.0263","0.0223","","","0.045","0.0464","","","","","","1.085","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053658","7.97","0.002","9.419","0.003","10.391","0.003","95.79","0.02","112.084","0.014","110.002","0.015","655.2","0.4","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H21.98 Eu2 N2 O16.99 -","- C20 H16 Eu2 N2 O16.988 -","- C20 H16 Eu2 N2 O16.988 -","1","0.5","","Zhang, Lijuan; Xu, Donghua; Zhou, Yunshan; Jiang, Fei","Design of 3-D europium(iii)‒organic frameworks based on pyridine carboxylate N-oxide and acyclic binary carboxylate: syntheses, structures, and luminescence properties","New Journal of Chemistry","2010","34","11","2470","","10.1039/c0nj00373e","","","0.71073","MoKα","","0.031","0.026","","","0.0598","0.0615","","","","","","1.007","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053659","8.275","0.002","8.484","0.002","9.092","0.003","111.475","0.002","112.789","0.003","90.191","0.002","539.7","0.3","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H12 Eu2 N2 O16 -","- C16 H12 Eu2 N2 O16 -","- C16 H12 Eu2 N2 O16 -","1","0.5","","Zhang, Lijuan; Xu, Donghua; Zhou, Yunshan; Jiang, Fei","Design of 3-D europium(iii)‒organic frameworks based on pyridine carboxylate N-oxide and acyclic binary carboxylate: syntheses, structures, and luminescence properties","New Journal of Chemistry","2010","34","11","2470","","10.1039/c0nj00373e","","","0.71073","MoKα","","0.0203","0.0185","","","0.0427","0.0433","","","","","","0.989","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053660","19.5278","0.0006","22.6384","0.0007","23.5862","0.0007","69.145","0.002","69.485","0.002","71.748","0.002","8911.8","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C345.28 H450.21 N4 O74.72 -","- C349.85 H452.61 N4 O75.46 -","- C349.85 H452.61 N4 O75.46 -","1","0.5","","Whetstine, Jena L.; Kline, Katrina K.; Fowler, Drew A.; Ragan, Cheryl M.; Barnes, Charles L.; Atwood, Jerry L.; Tucker, Sheryl A.","Spectroscopic investigations of pyrene butanol encapsulated in C-hexylpyrogallol[4]arene nanocapsules","New Journal of Chemistry","2010","34","11","2587","","10.1039/c0nj00398k","","","0.71073","MoKα","","0.2532","0.181","","","0.4634","0.5175","","","","","","1.815","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053661","29.2486","0.0004","10.1996","0.0001","11.8137","0.0001","90","","103.164","0.0009","90","","3431.7","0.07","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H23 Fe N O5 -","- C17 H23 Fe N O5 -","- C136 H184 Fe8 N8 O40 -","8","1","","Schulz, Jiří; Gyepes, Róbert; Císařová, Ivana; Štěpnička, Petr","Synthesis, structural characterisation and bonding in an anionic hexavanadate bearing redox-active ferrocenyl groups at the periphery","New Journal of Chemistry","2010","34","12","2749","","10.1039/c0nj00421a","","","0.71073","MoKα","","0.033","0.0302","","","0.0772","0.0791","","","","","","1.032","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7053662","12.648","0.0002","15.8602","0.0002","20.3923","0.0003","84.8847","0.0008","79.9909","0.0007","78.0411","0.0008","3935","0.1","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H118 Fe2 N6 O23 V6 -","- C68 H118 Fe2 N6 O23 V6 -","- C136 H236 Fe4 N12 O46 V12 -","2","1","","Schulz, Jiří; Gyepes, Róbert; Císařová, Ivana; Štěpnička, Petr","Synthesis, structural characterisation and bonding in an anionic hexavanadate bearing redox-active ferrocenyl groups at the periphery","New Journal of Chemistry","2010","34","12","2749","","10.1039/c0nj00421a","","","0.71073","MoKα","","0.062","0.0425","","","0.1028","0.1128","","","","","","1.063","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7053663","7.3642","0.0003","19.6916","0.0008","7.3274","0.0003","90","","88.25","0.003","90","","1062.07","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 Cl0.1 Fe N O4.9 -","- C9 H8 Cl0.101 Fe N O4.899 -","- C36 H32 Cl0.404 Fe4 N4 O19.596 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.0497","0.0354","","","0.0751","0.0805","","","","","","1.101","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053664","7.4673","0.0003","19.4547","0.0009","7.4182","0.0004","90","","88.188","0.005","90","","1077.13","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Mn N O5 -","- C9 H10 Mn N O5 -","- C36 H40 Mn4 N4 O20 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.0434","0.0344","","","0.081","0.0847","","","","","","1.092","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053665","7.3177","0.0004","19.8049","0.0009","7.2184","0.0004","90","","88.296","0.004","90","","1045.67","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Co N O5 -","- C9 H10 Co N O5 -","- C36 H40 Co4 N4 O20 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.027","0.024","","","0.0578","0.0591","","","","","","1.103","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053666","7.3271","0.0004","19.7336","0.0012","7.2498","0.0005","90","","88.286","0.005","90","","1047.78","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 N O5 Zn -","- C9 H10 N O5 Zn -","- C36 H40 N4 O20 Zn4 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.0447","0.0305","","","0.0612","0.0656","","","","","","1.047","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053667","15.814","0.002","15.9037","0.001","18.4974","0.0016","90","","90","","90","","4652.1","0.8","293","2","293","2","","","","","","","","5","P c 21 n","P -2n -2ac","33","","","","- C44 H45 Cu2 N10 O14.5 -","- C44 H36 Cu2 N10 O14.5 -","- C176 H144 Cu8 N40 O58 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.1117","0.0597","","","0.125","0.147","","","","","","1.054","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053668","7.4191","0.0003","27.4874","0.0013","11.5347","0.0011","90","","91.609","0.006","90","","2351.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 Cu N4 O6 -","- C24 H20 Cu N4 O6 -","- C96 H80 Cu4 N16 O24 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.1345","0.0723","","","0.1522","0.1764","","","","","","1.058","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053669","7.3274","0.0003","19.6916","0.0008","7.3642","0.0003","90","","91.75","0.003","90","","1062.07","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H8.9 Cl0.1 Fe N O4.9 -","- C9 H8.9 Cl0.1 Fe N O4.9 -","- C36 H35.6 Cl0.4 Fe4 N4 O19.6 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.0494","0.0351","","","0.0776","0.083","","","","","","1.118","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053670","7.4182","0.0004","19.4547","0.0009","7.4673","0.0003","90","","91.812","0.005","90","","1077.13","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Mn N O5 -","- C9 H10 Mn N O5 -","- C36 H40 Mn4 N4 O20 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.0434","0.0344","","","0.081","0.0847","","","","","","1.09","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053671","7.2184","0.0004","19.8049","0.0009","7.3177","0.0004","90","","91.704","0.004","90","","1045.67","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Co N O5 -","- C9 H10 Co N O5 -","- C36 H40 Co4 N4 O20 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.0255","0.0225","","","0.0557","0.0568","","","","","","1.114","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053672","7.2498","0.0005","19.7336","0.0012","7.3271","0.0004","90","","91.714","0.005","90","","1047.78","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 N O5 Zn -","- C9 H10 N O5 Zn -","- C36 H40 N4 O20 Zn4 -","4","1","","Déniz, Mariadel; Pasán, Jorge; Fabelo, Oscar; Cañadillas-Delgado, Laura; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina","Metal-organic coordination frameworks based on mixed methylmalonate and 4,4′-bipiridine ligands: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2010","34","11","2515","","10.1039/c0nj00436g","","x-ray","0.71073","MoKα","","0.0439","0.0297","","","0.0593","0.0633","","","","","","1.062","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053673","12.321","0.003","25.157","0.005","9.3501","0.0019","90","","90","","90","","2898.2","1.1","293","2","293","2","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C25 H35 Br Cl4 Cr N O -","- C25 H35 Br Cl4 Cr N O -","- C100 H140 Br4 Cl16 Cr4 N4 O4 -","4","1","","Sun, Mingtai; Mu, Ying; Wu, Qiaolin; Gao, Wei; Ye, Ling","Synthesis, structures and ethylene polymerization behavior of half-metallocene chromium(iii) catalysts bearing salicylaldiminato ligands","New Journal of Chemistry","2010","34","12","2979","","10.1039/c0nj00439a","","","0.71073","MoKα","","0.0645","0.0414","","","0.088","0.0966","","","","","","1.023","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053674","9.839","0.002","11.779","0.002","25.013","0.005","90","","99.29","0.03","90","","2860.8","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H36 Cl3 Cr N2 O3 -","- C25 H36 Cl3 Cr N2 O3 -","- C100 H144 Cl12 Cr4 N8 O12 -","4","1","","Sun, Mingtai; Mu, Ying; Wu, Qiaolin; Gao, Wei; Ye, Ling","Synthesis, structures and ethylene polymerization behavior of half-metallocene chromium(iii) catalysts bearing salicylaldiminato ligands","New Journal of Chemistry","2010","34","12","2979","","10.1039/c0nj00439a","","","0.71073","MoKα","","0.1974","0.1015","","","0.1957","0.2358","","","","","","1.062","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053675","9.0986","0.0018","12.398","0.003","26.249","0.005","90","","94.29","0.03","90","","2952.7","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 Cl3 Cr N2 O3 -","- C28 H34 Cl3 Cr N2 O3 -","- C112 H136 Cl12 Cr4 N8 O12 -","4","1","","Sun, Mingtai; Mu, Ying; Wu, Qiaolin; Gao, Wei; Ye, Ling","Synthesis, structures and ethylene polymerization behavior of half-metallocene chromium(iii) catalysts bearing salicylaldiminato ligands","New Journal of Chemistry","2010","34","12","2979","","10.1039/c0nj00439a","","","0.71073","MoKα","","0.2201","0.1","","","0.2035","0.2617","","","","","","1.022","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053676","12.378","0.003","16.829","0.003","17.805","0.004","90","","90","","90","","3708.9","1.4","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C21 H21 Cl Cr N O -","- C21 H21 Cl Cr N O -","- C168 H168 Cl8 Cr8 N8 O8 -","8","1","","Sun, Mingtai; Mu, Ying; Wu, Qiaolin; Gao, Wei; Ye, Ling","Synthesis, structures and ethylene polymerization behavior of half-metallocene chromium(iii) catalysts bearing salicylaldiminato ligands","New Journal of Chemistry","2010","34","12","2979","","10.1039/c0nj00439a","","","0.71073","MoKα","","0.0409","0.0319","","","0.0831","0.0872","","","","","","1.077","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053677","7.7239","0.0015","16.784","0.003","20.079","0.004","80.09","0.03","80.03","0.03","85.18","0.03","2521.5","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H33 Cl Cr N O -","- C27 H33 Cl Cr N O -","- C108 H132 Cl4 Cr4 N4 O4 -","4","2","","Sun, Mingtai; Mu, Ying; Wu, Qiaolin; Gao, Wei; Ye, Ling","Synthesis, structures and ethylene polymerization behavior of half-metallocene chromium(iii) catalysts bearing salicylaldiminato ligands","New Journal of Chemistry","2010","34","12","2979","","10.1039/c0nj00439a","","","0.71073","MoKα","","0.2172","0.0951","","","0.1901","0.25","","","","","","1.011","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053678","11.365","0.002","18.149","0.004","12.445","0.003","90","","110.76","0.03","90","","2400.3","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Cl3 Cr N2 O3 -","- C22 H22 Cl3 Cr N2 O3 -","- C88 H88 Cl12 Cr4 N8 O12 -","4","1","","Sun, Mingtai; Mu, Ying; Wu, Qiaolin; Gao, Wei; Ye, Ling","Synthesis, structures and ethylene polymerization behavior of half-metallocene chromium(iii) catalysts bearing salicylaldiminato ligands","New Journal of Chemistry","2010","34","12","2979","","10.1039/c0nj00439a","","","0.71073","MoKα","","0.1221","0.0741","","","0.1953","0.2262","","","","","","1.037","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053679","13.6296","0.0001","13.6296","0.0001","18.9768","0.0002","90","","90","","90","","3525.24","0.05","200","2","200","2","","","","","","","","4","I -4","I -4","82","Silane (1)","Silane (1)","","- C24 H16 Br4 Si -","- C24 H16 Br4 Si -","- C144 H96 Br24 Si6 -","6","0.75","","Beele, Björn; Guenther, Johannes; Perera, Melanie; Stach, Michaela; Oeser, Thomas; Blümel, Janet","New linker systems for superior immobilized catalysts","New Journal of Chemistry","2010","34","12","2729","","10.1039/c0nj00482k","","","0.71073","MoKα","","0.0444","0.0365","","","0.09","0.0948","","","","","","1.025","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053680","9.7752","0.0006","11.2894","0.0006","11.8628","0.0007","70.695","0.001","74.85","0.001","79.261","0.002","1185.38","0.12","200","2","200","2","","","","","","","","4","P -1","-P 1","2","Stannane (2)","Stannane (2)","","- C24 H16 Br4 Sn -","- C24 H16 Br4 Sn -","- C48 H32 Br8 Sn2 -","2","1","","Beele, Björn; Guenther, Johannes; Perera, Melanie; Stach, Michaela; Oeser, Thomas; Blümel, Janet","New linker systems for superior immobilized catalysts","New Journal of Chemistry","2010","34","12","2729","","10.1039/c0nj00482k","","","0.71073","MoKα","","0.063","0.043","","","0.1012","0.1104","","","","","","1.01","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053681","8.719","0.0006","8.719","0.0006","9.5219","0.0009","90","","90","","120","","626.88","0.09","200","","200","","","","","","","","","3","P -3 c 1","-P 3 2""c","165","","","","- F18 In Sb3 -","- F18 In Sb3 -","- F36 In2 Sb6 -","2","0.166667","","Mazej, Zoran; Goreshnik, Evgeny","Fluoride ion donor properties of group 13 trifluorides (MF3, M = Al, Ga, In, Tl) and crystal structures of InF3·3SbF5, TlF3·3SbF5 and TlF3·AsF5·2HF","New Journal of Chemistry","2010","34","12","2806","","10.1039/c0nj00514b","","","0.71069","MoKα","","","0.0398","","","","0.0913","","","","","","1.269","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053682","9.408","0.016","9.408","0.016","8.597","0.014","90","","90","","120","","659","1.9","200","2","200","","","","","","","","","3","P -3","-P 3","147","","","","- F18 Sb3 Tl -","- F18 Sb3 Tl -","- F36 Sb6 Tl2 -","2","0.333333","","Mazej, Zoran; Goreshnik, Evgeny","Fluoride ion donor properties of group 13 trifluorides (MF3, M = Al, Ga, In, Tl) and crystal structures of InF3·3SbF5, TlF3·3SbF5 and TlF3·AsF5·2HF","New Journal of Chemistry","2010","34","12","2806","","10.1039/c0nj00514b","","","0.7107","MoKα","","0.045","0.0407","","","0.0938","0.0972","","","","","","1.137","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053683","5.5533","0.0004","5.7652","0.0005","21.9287","0.0019","90","","93.279","0.004","90","","700.92","0.1","200","","200","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- As F10 H2 Tl -","- As F10 H2 Tl -","- As4 F40 H8 Tl4 -","4","1","","Mazej, Zoran; Goreshnik, Evgeny","Fluoride ion donor properties of group 13 trifluorides (MF3, M = Al, Ga, In, Tl) and crystal structures of InF3·3SbF5, TlF3·3SbF5 and TlF3·AsF5·2HF","New Journal of Chemistry","2010","34","12","2806","","10.1039/c0nj00514b","","","0.71069","MoKα","","0.0693","0.0593","","","0.1177","0.1258","","","","","","1.216","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053684","10.5908","0.0002","11.52","0.0003","13.0613","0.0005","102.14","0.002","101.609","0.002","109.62","0.001","1402.07","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H70 F12 N2 O14 P2 -","- C50 H70 F12 N2 O14 P2 -","- C50 H70 F12 N2 O14 P2 -","1","0.5","","Fernando, Isurika R.; Bairu, Semere G.; Ramakrishna, Guda; Mezei, Gellert","Single-color pseudorotaxane-based temperature sensing","New Journal of Chemistry","2010","34","10","2097","","10.1039/c0nj00541j","","","0.71073","MoKα","","0.0531","0.0435","","","0.1537","0.164","","","","","","1.271","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053685","12.7649","0.0002","14.3247","0.0002","15.5038","0.0002","90","","90","","90","","2834.92","0.07","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H30 F12 N2 O4 P2 -","- C22 H30 F12 N2 O4 P2 -","- C88 H120 F48 N8 O16 P8 -","4","0.5","","Fernando, Isurika R.; Bairu, Semere G.; Ramakrishna, Guda; Mezei, Gellert","Single-color pseudorotaxane-based temperature sensing","New Journal of Chemistry","2010","34","10","2097","","10.1039/c0nj00541j","","","0.71073","MoKα","","0.1419","0.0871","","","0.2767","0.3066","","","","","","1.742","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053686","7.4523","0.0003","8.838","0.0003","10.7212","0.0005","84.569","0.002","77.234","0.002","83.613","0.002","682.61","0.05","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H36 O8 -","- C32 H36 O8 -","- C32 H36 O8 -","1","0.5","","Fernando, Isurika R.; Bairu, Semere G.; Ramakrishna, Guda; Mezei, Gellert","Single-color pseudorotaxane-based temperature sensing","New Journal of Chemistry","2010","34","10","2097","","10.1039/c0nj00541j","","","0.71073","MoKα","","0.0579","0.0429","","","0.1458","0.1617","","","","","","1.153","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053687","11.3439","0.0008","11.723","0.0008","14.6618","0.001","86.754","0.001","85.828","0.001","83.068","0.001","1928.2","0.2","138","2","138","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H52 Fe N4 Si5 -","- C31 H52 Fe N4 Si5 -","- C62 H104 Fe2 N8 Si10 -","2","1","","Yang, Jian; Fasulo, Meg; Tilley, T. Don","(MeQn2SiH)Fe[N(SiMe3)2]2 (Qn = 8-quinolyl): an unusual δ-agostic iron complex containing an η1-SiH interaction","New Journal of Chemistry","2010","34","11","2528","","10.1039/c0nj00554a","","","0.71073","MoKα","","0.0409","0.0329","","","0.0912","0.0953","","","","","","1.447","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053688","14.86","0.01","13.641","0.002","15.399","0.007","90","","103.81","0.02","90","","3031","3","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C30 H26 Mo N2 O7 P -","- C30 H26 Mo N2 O7 P -","- C120 H104 Mo4 N8 O28 P4 -","4","1","","Rancurel, Corinne; Sutter, Jean-Pascal; Le Hoerff, Thierry; Ouahab, Lahcène; Kahn, Olivier","First example of a metal(0) carbonyl complex with a paramagnetic nitronyl nitroxide-substituted triphenylphosphine ligand","New Journal of Chemistry","1998","22","12","1333","","10.1039/a808113a","","","0.71073","MoKα","","0.1332","0.0455","","","0.0938","0.118","","","","","","1.016","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053689","21.7465","0.001","21.7465","0.001","16.8412","0.0015","90","","90","","120","","6897.4","0.8","295","2","295","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C30 H24 O3 -","- C30 H24 O3 -","- C360 H288 O36 -","12","0.666667","","Kumar, V. S. Senthil; Pigge, F. Christopher; Rath, Nigam P.","Interpenetration of distinct 2D and 3D organic networks in the crystal structure of 1,3,5-tris(4-methylbenzoyl)benzene","New Journal of Chemistry","2004","28","10","1192","","10.1039/b408481k","","","0.71073","MoKα","","0.0945","0.0544","","","0.1394","0.1591","","","","","","1.038","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053690","7.8542","0.0001","11.982","0.0002","14.1992","0.0003","90.439","0.001","92.745","0.001","101.822","0.001","1306.22","0.04","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C20.5 H18 Cl N O2 S9 -","- C20.5 H18 Cl N O2 S9 -","- C41 H36 Cl2 N2 O4 S18 -","2","1","","Wang, Qiang; Day, Peter; Griffiths, Jon-Paul; Nie, Hui; Wallis, John D.","Synthetic strategies for preparing BEDT-TTF derivatives functionalised with metal ion binding groups","New Journal of Chemistry","2006","30","12","1790","","10.1039/b606715h","","","0.71073","MoKα","","0.0473","0.0377","","","0.0844","0.0884","","","","","","1.024","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053691","6.249","0.0001","11.0486","0.0003","16.4757","0.0004","82.167","0.002","82.328","0.002","87.627","0.002","1116.51","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","Tosyloxymethyl-ET","","- C18 H16 O3 S9 -","- C18 H15.351 O3 S9 -","- C36 H30.702 O6 S18 -","2","1","","Wang, Qiang; Day, Peter; Griffiths, Jon-Paul; Nie, Hui; Wallis, John D.","Synthetic strategies for preparing BEDT-TTF derivatives functionalised with metal ion binding groups","New Journal of Chemistry","2006","30","12","1790","","10.1039/b606715h","","","0.71073","MoKα","","0.0467","0.0393","","","0.1073","0.112","","","","","","1.054","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053692","7.4575","0.0012","11.6882","0.0012","12.8664","0.0015","114.651","0.01","94.767","0.011","101.729","0.01","980.1","0.2","150","","150","","","","","","","","see text","4","P -1","-P 1","2","","","","- C8 H11 N5 O3 -","- C8 H11 N5 O3 -","- C32 H44 N20 O12 -","4","2","","Corral, Eva; Kooijman, Huub; Spek, Anthony L.; Reedijk, Jan","Nucleic acids in two dimensions: layers of base pairs linked by carboxylate","New Journal of Chemistry","2007","31","1","21","","10.1039/b613845d","","x-ray","0.71073","MoKα","","0.0673","0.0515","","","0.1417","0.154","","","","","","1.085","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053693","9.7867","0.001","28.1721","0.0026","15.7764","0.0016","90","","94.616","0.004","90","","4335.6","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","cis- and trans-bis(benzoylacetonato)pyridinecopper(ii)","cis- and trans-bis(benzoylacetonato)pyridinecopper(II)","","- C25 H23 Cu N O4 -","- C25 H23 Cu N O4 -","- C200 H184 Cu8 N8 O32 -","8","2","","Lennartson, Anders; Håkansson, Mikael; Jagner, Susan","cis- and trans-Bis(benzoylacetonato)pyridinecopper(ii): co-crystallisation of isomers and reversible pyridine loss with retention of crystallinity","New Journal of Chemistry","2007","31","3","344","347","10.1039/b615579k","","","0.71073","MoKα","","0.0332","0.03","","","0.072","0.0739","","","","","","0.855","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053694","16.449","0.002","28.272","0.004","29.144","0.004","90","","90.614","0.003","90","","13553","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C145 H147.5 N13.5 O26.5 Zn8 -","- C149.25 H135.5 N8.5 O26.5 Zn8 -","- C597 H542 N34 O106 Zn32 -","4","1","","Power, Nicholas P.; Dalgarno, Scott J.; Atwood, Jerry L.","Robust and stable pyrogallol[4]arene molecular capsules facilitated via an octanuclear zinc coordination belt","New Journal of Chemistry","2007","31","1","17","","10.1039/b615947h","","","0.71073","MoKα","","0.0932","0.0566","","","0.1555","0.1868","","","","","","1.02","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053695","9.2003","0.0004","16.578","0.0008","20.418","0.001","90","","101.307","0.001","90","","3053.8","0.2","150","1","150","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 F3 N2 O18 Re3 S4 -","- C18 F3 N2 O18 Re3 S4 -","- C72 F12 N8 O72 Re12 S16 -","4","1","","Tzeng, Biing-Chiau; Wu, Ya-Ling; Lee, Gene-Hsiang; Peng, Shie-Ming","A novel trinuclear Re(i) complex containing 1,3,4-thiadiazole-2,5-dithiolate: structural and spectroscopic properties","New Journal of Chemistry","2007","31","2","199","","10.1039/b616122g","","","0.71073","MoKα","","0.0509","0.0383","","","0.0692","0.0728","","","","","","1.053","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053696","9.1246","0.001","20.319","0.002","47.951","0.005","90","","90","","90","","8890.2","1.6","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H36 N8 O5.08 S2 -","- C27 H36 N8 O5.08333 S2 -","- C324 H432 N96 O61 S24 -","12","3","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.105","0.0752","","","0.1644","0.1787","","","","","","1.091","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053697","10.857","0.0015","12.4706","0.0016","12.9263","0.0016","98.088","0.003","112.786","0.003","107.966","0.003","1465.8","0.3","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C28 H38 N8 O5 S2 -","- C28 H38 N8 O5 S2 -","- C56 H76 N16 O10 S4 -","2","2","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.0863","0.0812","","","0.2163","0.2213","","","","","","1.026","","","","has coordinates","180090","2020-10-21","18:00:00",""
"7053698","12.8416","0.001","8.7033","0.0007","13.7476","0.0011","90","","96.649","0.002","90","","1526.2","0.2","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H40 N8 O5 S2 -","- C29 H40 N8 O5 S2 -","- C58 H80 N16 O10 S4 -","2","1","","Blondeau, Pascal; Benet-Buchholz, Jordi; de Mendoza, Javier","Enthalpy driven nitrate complexation by guanidinium-based macrocycles","New Journal of Chemistry","2007","31","5","736","","10.1039/b616409a","","","0.71073","MoKα","","0.0346","0.0329","","","0.0881","0.0897","","","","","","1.032","","","","has coordinates,has disorder","180090","2020-10-21","18:00:00",""
"7053699","10.7122","0.0009","11.9131","0.001","12.4072","0.001","105.252","0.002","93.448","0.002","113.481","0.002","1376.5","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H46 Er2 N4 O12 -","- C66 H46 Er2 N4 O12 -","- C66 H46 Er2 N4 O12 -","1","0.5","","Song, Limei; Wang, Qi; Tang, Daihua; Liu, Xinhou; Zhen, Zhen","Crystal structure and near-infrared luminescence properties of novel binuclear erbium and erbium?ytterbium cocrystalline complexes","New Journal of Chemistry","2007","31","4","506","","10.1039/b616422f","","","0.71073","MoKα","","0.0281","0.0253","","","0.065","0.0666","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053700","10.1714","0.0003","10.1756","0.0003","13.1069","0.0004","107.535","0.002","92.714","0.002","91.38","0.002","1291.03","0.07","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H37.8 N4 O1.9 -","- C29 H37.8 N4 O1.9 -","- C58 H75.6 N8 O3.8 -","2","1","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.1112","0.0693","","","0.1779","0.2009","","","","","","0.967","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053701","19.7663","0.0015","11.8837","0.0008","15.7559","0.0014","90","","106.807","0.004","90","","3542.9","0.5","120","2","120","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C42 H41.5 N6.5 O -","- C42 H41.5 N6.5 O -","- C168 H166 N26 O4 -","4","1","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.2209","0.0907","","","0.2159","0.2756","","","","","","1.011","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053702","10.146","0.0002","26.3142","0.0009","26.8959","0.0009","90","","98.04","0.002","90","","7110.2","0.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H48 N4 O5 S -","- C37 H48 N4 O5 S -","- C296 H384 N32 O40 S8 -","8","2","","Dehaen, Wim; Gale, Philip A.; García-Garrido, Sergio E.; Kostermans, Maarten; Light, Mark E.","Anion recognition by N-confused calix[4]pyrrole-α-carbaldehyde and its Knoevenagel reaction derivatives","New Journal of Chemistry","2007","31","5","691","","10.1039/b616467f","","","0.71073","MoKα","","0.195","0.1076","","","0.2649","0.3182","","","","","","0.905","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053703","10.3228","0.0004","11.9213","0.0004","15.8916","0.0006","71.948","0.002","88.95","0.002","74.63","0.002","1788.52","0.12","100","2","100","2","","","","","","","","3","P -1","-P 1","2","para-butylcalix(4)arene","","","- C44 H56 O4 -","- C44 H56 O4 -","- C88 H112 O8 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1102","0.0696","","","0.1891","0.2191","","","","","","1.069","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053704","11.0862","0.0015","14.413","0.002","14.802","0.002","78.182","0.002","74.463","0.002","88.892","0.002","2228.8","0.5","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-n-hexylcalix(4)arene","","","- C52 H72 O4 -","- C52 H72 O4 -","- C104 H144 O8 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.0628","0.0465","","","0.1263","0.141","","","","","","1.031","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053705","11.611","0.003","17.372","0.004","33.165","0.007","88.536","0.003","88.251","0.004","87.077","0.004","6676","3","125","2","125","2","","","","","","","","3","P -1","-P 1","2","para-hexanoylcalix(4)arene","","","- C52 H64 O8 -","- C52 H64 O8 -","- C312 H384 O48 -","6","3","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1089","0.0685","","","0.1869","0.2156","","","","","","0.989","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053706","12.053","0.003","12.441","0.003","16.015","0.003","91.504","0.003","99.841","0.003","95.036","0.003","2354.9","0.9","398","2","125","2","","","","","","","","3","P -1","-P 1","2","para-hexanoylcalix(4)arene","","","- C54 H70 O9 -","- C54 H70 O9 -","- C108 H140 O18 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1063","0.0742","","","0.2076","0.226","","","","","","1.058","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053707","9.0322","0.0007","13.6639","0.0011","15.2661","0.0012","86.472","0.001","76.962","0.001","86.25","0.001","1829.4","0.3","125","2","125","2","","","","","","","","3","P -1","-P 1","2","parabutanoylcalix(4)arene","","","- C44 H48 O8 -","- C44 H48 O8 -","- C88 H96 O16 -","2","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.0493","0.0436","","","0.1211","0.1273","","","","","","1.038","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053708","11.63","0.002","15.163","0.003","33.741","0.006","90","","99.117","0.003","90","","5874.9","1.9","125","2","125","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","para-decanoylcalix(4)arene","","","- C68 H96 O8 -","- C68 H96 O8 -","- C272 H384 O32 -","4","1","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1637","0.1234","","","0.278","0.29","","","","","","1.126","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053709","21.7615","0.0012","15.6647","0.0008","32.8323","0.0016","90","","107.905","0.003","90","","10650.1","1","100","2","100","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","para-octanoylcalix(4)arene","","","- C60 H80 O8 -","- C60 H80 O8 -","- C480 H640 O64 -","8","2","","Pojarova, Michaela; Ananchenko, Gennady S.; Udachin, Konstantin A.; Perret, Florent; Coleman, Anthony W.; Ripmeester, John A.","?-C?O provides access to the cavity in acyl calix[4]arenes: A comparative study of crystal structures","New Journal of Chemistry","2007","31","6","871","","10.1039/b700308k","","","0.7107","MoKα","","0.1881","0.0839","","","0.2006","0.2921","","","","","","1.027","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053710","11.2883","0.0004","13.0045","0.0004","14.3048","0.0006","84.252","0.002","82.162","0.002","88.661","0.002","2069.75","0.13","120","2","120","2","","","","","","","","5","P -1","-P 1","2","bis(ethylenediamine)diaquacopper(ii) catena- bis(ethylenediamine) (aqua)copper(ii)(mu- aqua)bis((triaqua)tetrakis(malonomonohydroxate) pentacopper(ii)) hydrate","bis(ethylenediamine)diaquacopper(II) catena-bis(ethylenediamine) (aqua)copper(II)(mu-aqua)bis((triaqua)tetrakis(malonomonohydroxate) pentacopper(II)) hydrate","","- C16 H54 Cu6 N8 O31 -","- C16 H54 Cu6 N8 O31 -","- C32 H108 Cu12 N16 O62 -","2","1","","Gumienna-Kontecka, Elzbieta; Golenya, Irina A.; Dudarenko, Nikolay M.; Dobosz, Agnieszka; Haukka, Matti; Fritsky, Igor O.; Swiatek-Kozlowska, Jolanta","A new Cu(ii) [12]metallocrown-4 pentanuclear complex based on a Cu(ii)-malonomonohydroxamic acid unit","New Journal of Chemistry","2007","31","10","1798","","10.1039/b701600j","","","0.71073","MoKα","","0.0811","0.0434","","","0.0933","0.1063","","","","","","1.027","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053711","23.2509","0.0016","23.2509","0.0016","11.492","0.0016","90","","90","","90","","6212.6","1.1","130","2","130","2","","","","","","","","7","P -4 21 c","P -4 2n","114","","","","- C22 H53 N3 O2.5 Os P2 Si2 -","- C22 H53 N3 O2.5 Os P2 Si2 -","- C176 H424 N24 O20 Os8 P16 Si16 -","8","1","","Lee, Joo-Ho; Fan, Hongjun; Pink, Maren; Caulton, Kenneth G.","Reactivity of ?NO with an osmium polyhydride: Reductive elimination and reductive nitrosylation on the path from odd- to even-electron molecules","New Journal of Chemistry","2007","31","6","838","","10.1039/b702078c","","","0.71073","MoKα","","0.0331","0.0252","","","0.0593","0.0631","","","","","","1.066","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053712","12.434","0.001","14.692","0.001","20.783","0.001","100.088","0.003","93.337","0.003","103.419","0.004","3616.5","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C104.5 H30 F30 O4 -","- C104.5 H26 F30 O4 -","- C209 H52 F60 O8 -","2","1","","Ovchinnikova, Nataliya S.; Ignat’eva, Daria V.; Tamm, Nadezhda B.; Avdoshenko, Stanislav M.; Goryunkov, Alexey A.; Ioffe, Ilya N.; Markov, Vitaliy Yu.; Troyanov, Sergey I.; Sidorov, Lev N.; Yurovskaya, Marina A.; Kemnitz, Erhard","Regioselective synthesis and crystal structure of C70(CF3)10[C(CO2Et)2]","New Journal of Chemistry","2008","32","1","89","","10.1039/b704924b","","","0.91","synchrotron","","0.1443","0.1201","","","0.3154","0.3231","","","","","","1.081","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053713","12.921","0.002","8.1511","0.0015","16.069","0.003","90","","96.767","0.003","90","","1680.6","0.5","294","2","294","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N5 -","- C20 H19 N5 -","- C80 H76 N20 -","4","1","","Chen, Yong; Fu, Wen-Fu; Li, Jun-Li; Zhao, Xi-Juan; Ou, Xue-Mei","Conformation impact on spectral properties of bis(5,7-dimethyl-1,8-naphthyridin-2-yl)amine and its ZnII complex","New Journal of Chemistry","2007","31","10","1785","","10.1039/b705149b","","","0.71073","MoKα","","0.0672","0.0431","","","0.1102","0.1291","","","","","","1.01","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053714","12.609","0.003","15.421","0.003","14.505","0.003","90","","110.09","0.03","90","","2648.8","1.1","113","2","113","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Cl2 N5 O4 Zn -","- C25 H27 Cl2 N5 O4 Zn -","- C100 H108 Cl8 N20 O16 Zn4 -","4","1","","Chen, Yong; Fu, Wen-Fu; Li, Jun-Li; Zhao, Xi-Juan; Ou, Xue-Mei","Conformation impact on spectral properties of bis(5,7-dimethyl-1,8-naphthyridin-2-yl)amine and its ZnII complex","New Journal of Chemistry","2007","31","10","1785","","10.1039/b705149b","","","0.71073","MoKα","","0.0814","0.0627","","","0.1211","0.1278","","","","","","1.142","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053715","12.0233","0.0011","13.974","0.0014","14.7666","0.0015","64.168","0.002","85.56","0.003","89.213","0.002","2225.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H32 Cl Ir N2 -","- C21 H32 Cl Ir N2 -","- C84 H128 Cl4 Ir4 N8 -","4","2","","Zanardi, Alessandro; Peris, Eduardo; Mata, Jose A.","Alkenyl-functionalized NHC iridium-based catalysts for hydrosilylation","New Journal of Chemistry","2008","32","1","120","","10.1039/b707280e","","","0.71073","MoK\α","","0.0897","0.0467","","","0.1019","0.1205","","","","","","1.004","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053716","8.1277","0.0004","36.568","0.002","12.0502","0.0006","90","","99.535","0.001","90","","3532","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H24 B F4 Ir N2 -","- C17 H24 B F4 Ir N2 -","- C136 H192 B8 F32 Ir8 N16 -","8","2","","Zanardi, Alessandro; Peris, Eduardo; Mata, Jose A.","Alkenyl-functionalized NHC iridium-based catalysts for hydrosilylation","New Journal of Chemistry","2008","32","1","120","","10.1039/b707280e","","x-ray","0.71073","MoK\α","","0.0953","0.0448","","","0.0778","0.0942","","","","","","1.047","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053717","15.29","0.0011","10.7009","0.0008","12.7347","0.001","90","","96.789","0.002","90","","2069","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 Cl2 F6 Ir N2 P -","- C17 H22 Cl2 F6 Ir N2 P -","- C68 H88 Cl8 F24 Ir4 N8 P4 -","4","1","","Zanardi, Alessandro; Peris, Eduardo; Mata, Jose A.","Alkenyl-functionalized NHC iridium-based catalysts for hydrosilylation","New Journal of Chemistry","2008","32","1","120","","10.1039/b707280e","","x-ray","0.71073","MoK\α","","0.075","0.0525","","","0.1315","0.1743","","","","","","1.117","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053718","15.004","0.002","14.696","0.002","20.069","0.003","90","","106.691","0.003","90","","4238.7","1","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H49 N4 O9.5 S2.5 Zn2 -","- C40 H49 N4 O9.5 S2.5 Zn2 -","- C160 H196 N16 O38 S10 Zn8 -","4","1","","Fondo, Matilde; García-Deibe, Ana M.; Ocampo, Noelia; Sanmartín, Jesús; Bermejo, Manuel R.; Oliveira, Elisabete; Lodeiro, Carlos","From dinuclear to tetranuclear zinc complexes through carboxylate donors: structural and luminescence studies","New Journal of Chemistry","2008","32","2","247","","10.1039/b710660b","","","0.71073","MoKα","","0.0802","0.046","","","0.1128","0.1351","","","","","","1.06","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7053719","10.184","0.002","11.268","0.003","19.979","0.005","92.722","0.004","104.558","0.004","111.284","0.004","2043.1","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C75 H103 N8 O19.5 Zn4 -","- C75 H103 N8 O19.5 Zn4 -","- C75 H103 N8 O19.5 Zn4 -","1","0.5","","Fondo, Matilde; García-Deibe, Ana M.; Ocampo, Noelia; Sanmartín, Jesús; Bermejo, Manuel R.; Oliveira, Elisabete; Lodeiro, Carlos","From dinuclear to tetranuclear zinc complexes through carboxylate donors: structural and luminescence studies","New Journal of Chemistry","2008","32","2","247","","10.1039/b710660b","","","0.71073","MoKα","","0.0594","0.0465","","","0.1411","0.1502","","","","","","1.1","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7053720","16.69","0.001","18.584","0.001","23.409","0.001","90","","97.59","0.01","90","","7197.1","0.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C59.75 H68 N8.5 O15 Zn4 -","- C59.75 H68 N8.5 O15 Zn4 -","- C239 H272 N34 O60 Zn16 -","4","1","","Fondo, Matilde; García-Deibe, Ana M.; Ocampo, Noelia; Sanmartín, Jesús; Bermejo, Manuel R.; Oliveira, Elisabete; Lodeiro, Carlos","From dinuclear to tetranuclear zinc complexes through carboxylate donors: structural and luminescence studies","New Journal of Chemistry","2008","32","2","247","","10.1039/b710660b","","","0.71073","MoKα","","0.1154","0.077","","","0.23","0.2555","","","","","","1.035","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053721","19.312","0.001","22.964","0.001","17.884","0.001","90","","106.233","0.002","90","","7615","0.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58.25 H61.5 Br6 N8 O17.25 Zn4 -","- C58.25 H61.5 Br6 N8 O17.25 Zn4 -","- C233 H246 Br24 N32 O69 Zn16 -","4","1","","Fondo, Matilde; García-Deibe, Ana M.; Ocampo, Noelia; Sanmartín, Jesús; Bermejo, Manuel R.; Oliveira, Elisabete; Lodeiro, Carlos","From dinuclear to tetranuclear zinc complexes through carboxylate donors: structural and luminescence studies","New Journal of Chemistry","2008","32","2","247","","10.1039/b710660b","","","0.71073","MoKα","","0.1147","0.059","","","0.1432","0.1622","","","","","","0.984","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053722","4.2896","0.0005","5.4645","0.0006","17.528","0.002","90","","91.449","0.002","90","","410.73","0.08","293","2","293","2","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C6 H5 Cl N6 -","- C6 H5 Cl N6 -","- C12 H10 Cl2 N12 -","2","1","","Casarin, Maurizio; Garau, Federica; Monari, Magda; Pandolfo, Luciano; Pettinari, Claudio; Venzo, Alfonso","An experimental and theoretical investigation of the molecular and electronic structure of 2-amino-4-chloro-6-pyrazolyl-[1,3,5]triazine, forming supramolecular linear tapes in the solid state","New Journal of Chemistry","2008","32","2","358","","10.1039/b711136c","","","0.71073","MoKα","","0.027","0.0261","","","0.0696","0.07","","","","","","1.094","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053723","8.7388","0.0015","14.988","0.002","25.469","0.004","90","","94.227","0.002","90","","3326.8","0.9","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H37 N4 O2 P Pt -","- C35 H35 N4 O2 P Pt -","- C140 H140 N16 O8 P4 Pt4 -","4","1","","Fuentes, José A.; Clarke, Matthew L.; Z. Slawin, Alexandra M.","A supramolecular approach to chiral ligand modification: coordination chemistry of a multifunctionalised tridentate amine-phosphine ligand","New Journal of Chemistry","2008","32","4","689","","10.1039/b712612c","","","0.71073","MoKα","","0.0479","0.044","","","0.1068","0.1095","","","","","","1.062","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053724","28.9049","0.0014","28.9049","0.0014","21.444","0.002","90","","90","","120","","15516","1.8","150","2","150","2","","","","","","","","4","P 6/m c c","-P 6 2c","192","","","","- C18.5 H14.5 N0.5 O12 -","- C10 H7 O3.5 -","- C240 H168 O84 -","24","1","","Dalgarno, Scott J.; Warren, John E.; Antesberger, Jochen; Glass, Timothy E.; Atwood, Jerry L.","Large diameter non-covalent nanotubes based on the self-assembly of para-carboxylatocalix[4]arene","New Journal of Chemistry","2007","31","","1891","1894","10.1039/B712800B","","x-ray","0.671","synchrotron","","0.3731","0.3692","","","0.75","0.7561","","","","","","8.178","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053725","28.9049","0.0014","28.9049","0.0014","21.444","0.002","90","","90","","120","","15516","1.8","296","2","150","2","","","","","","","","4","P 6/m c c","-P 6 2c","192","","","","- C18.5 H14.5 N0.5 O12 -","- C17.25 O5 -","- C414 O120 -","24","1","","Dalgarno, Scott J.; Warren, John E.; Antesberger, Jochen; Glass, Timothy E.; Atwood, Jerry L.","Large diameter non-covalent nanotubes based on the self-assembly of para-carboxylatocalix[4]arene","New Journal of Chemistry","2007","31","","1891","1894","10.1039/B712800B","","x-ray","0.671","synchrotron","","0.2663","0.2609","","","0.6108","0.6184","","","","","","5.895","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053726","15.073","0.0004","7.7163","0.0002","12.8686","0.0002","90","","104.784","0.002","90","","1447.17","0.06","233","2","233","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Fe N2 -","- C19 H16 Fe N2 -","- C76 H64 Fe4 N8 -","4","1","","Horvath, Ulrike E. I.; Bentivoglio, Gino; Hummel, Michael; Schottenberger, Herwig; Wurst, Klaus; Nell, Margo J.; van Rensburg, Constance E. J.; Cronje, Stephanie; Raubenheimer, Helgard G.","A cytotoxic bis(carbene)gold(i) complex of ferrocenyl complexes: synthesis and structural characterisation","New Journal of Chemistry","2008","32","3","533","","10.1039/b713917a","","","0.71073","MoKα","","0.0263","0.0234","","","0.0627","0.0646","","","","","","1.033","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053727","9.891","0.0015","18.733","0.003","11.4611","0.0019","90","","99.699","0.003","90","","2093.3","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","UH123","","","- C23 H23 B F4 Fe N2 -","- C23 H23 B F4 Fe N2 -","- C92 H92 B4 F16 Fe4 N8 -","4","1","","Horvath, Ulrike E. I.; Bentivoglio, Gino; Hummel, Michael; Schottenberger, Herwig; Wurst, Klaus; Nell, Margo J.; van Rensburg, Constance E. J.; Cronje, Stephanie; Raubenheimer, Helgard G.","A cytotoxic bis(carbene)gold(i) complex of ferrocenyl complexes: synthesis and structural characterisation","New Journal of Chemistry","2008","32","3","533","","10.1039/b713917a","","","0.71073","MoKα","","0.079","0.0493","","","0.1093","0.1217","","","","","","1.02","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053728","22.0699","0.0016","22.0699","0.0016","25.746","0.004","90","","90","","120","","10860","2","100","2","100","2","","","","","","","","8","R -3 :H","-R 3","148","UH124","","","- C48 H48 Au B Cl4 F4 Fe2 N4 -","- C48 H48 Au B Cl4 F4 Fe2 N4 -","- C432 H432 Au9 B9 Cl36 F36 Fe18 N36 -","9","0.5","","Horvath, Ulrike E. I.; Bentivoglio, Gino; Hummel, Michael; Schottenberger, Herwig; Wurst, Klaus; Nell, Margo J.; van Rensburg, Constance E. J.; Cronje, Stephanie; Raubenheimer, Helgard G.","A cytotoxic bis(carbene)gold(i) complex of ferrocenyl complexes: synthesis and structural characterisation","New Journal of Chemistry","2008","32","3","533","","10.1039/b713917a","","","0.71073","MoKα","","0.0929","0.0521","","","0.1261","0.1411","","","","","","0.922","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053729","15.3994","0.0006","9.3582","0.0004","14.7688","0.0006","90","","110.351","0.002","90","","1995.49","0.14","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H21 Fe N3 O2 -","- C24 H21 Fe N3 O2 -","- C96 H84 Fe4 N12 O8 -","4","1","","Arroyo, Marta; Birkin, Peter R.; Gale, Philip A.; García-Garrido, Sergio E.; Light, Mark E.","Anion-triggered electrodeposition in ferrocene-functionalised ortho-phenylenediamine-based receptors","New Journal of Chemistry","2008","32","7","1221","","10.1039/b715125j","","","0.71073","MoKα","","0.0965","0.0719","","","0.1321","0.1431","","","","","","1.121","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053730","12.555","0.0016","30.99","0.003","18.6914","0.0019","90","","108.095","0.01","90","","6912.8","1.4","180","","180","","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H61 Cu2 Gd2 N10 O28.5 -","- C62 H56 Cu2 Gd2 N10 O28.5 -","- C248 H224 Cu8 Gd8 N40 O114 -","4","1","","Novitchi, Ghenadie; Costes, Jean-Pierre; Tuchagues, Jean-Pierre; Vendier, Laure; Wernsdorfer, Wolfgang","A single molecule magnet (SMM) with a helicate structure","New Journal of Chemistry","2008","32","2","197","","10.1039/b716283a","","","","MoKα","","0.1116","0.0871","","","0.2323","0.2672","","","","","","1.111","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053731","27.132","0.005","9.4203","0.0016","30.586","0.005","90","","103.68","0.006","90","","7596","2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C62 H73 F36 N7 P6 -","- C60 H70 F36 N6 P6 -","- C240 H280 F144 N24 P24 -","4","1","","Dickson, Sara Jane; Wallace, Emma V. B.; Swinburne, Adam N.; Paterson, Martin J.; Lloyd, Gareth O.; Beeby, Andrew; Belcher, Warwick J.; Steed, Jonathan W.","Intramolecular binding site competition as a means of tuning the response of a colourimetric anion sensor","New Journal of Chemistry","2008","32","5","786","","10.1039/b800094h","","","0.71073","MoKα","","0.2144","0.1146","","","0.2889","0.3316","","","","","","0.974","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053732","23.061","0.002","13.5958","0.0014","20.094","0.002","90","","90","","90","","6300.1","1.1","190","1","190","1","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C27 H36 Cl3 N4 O5 Pr -","- C26 H30 Cl3 N4 O3 Pr -","- C208 H240 Cl24 N32 O24 Pr8 -","8","1","","Bučar, Dejan-Krešimir; Papaefstathiou, Giannis S.; Hamilton, Tamara D.; MacGillivray, Leonard R.","A lanthanide-based helicate coordination polymer derived from a rigid monodentate organic bridge synthesized in the solid state","New Journal of Chemistry","2008","32","5","797","","10.1039/b800878g","","","0.71073","MoKα","","0.0489","0.0246","","","0.0441","0.046","","","","","","0.85","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053733","23.02","0.003","16.8687","0.0018","13.8344","0.0015","90","","96.593","0.005","90","","5336.6","1.1","200","1","200","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C49.59 H52.85 N11 O13.84 Pr -","- C49.586 H50.3452 N11 O13.828 Pr -","- C198.344 H201.381 N44 O55.312 Pr4 -","4","0.5","","Bučar, Dejan-Krešimir; Papaefstathiou, Giannis S.; Hamilton, Tamara D.; MacGillivray, Leonard R.","A lanthanide-based helicate coordination polymer derived from a rigid monodentate organic bridge synthesized in the solid state","New Journal of Chemistry","2008","32","5","797","","10.1039/b800878g","","","0.71073","MoKα","","0.0425","0.0332","","","0.0696","0.072","","","","","","1.049","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053734","12.305","0.001","12.911","0.001","19.409","0.002","90","","105.578","0.002","90","","2970.2","0.5","163.2","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C70 H79 N O4 -","- C70 H69 N O4 -","- C140 H138 N2 O8 -","2","1","","Solovyov, Andrew; Notestein, Justin M.; Durkin, Kathleen A.; Katz, Alexander","Graftable chiral ligands for surface organometallic materials: calixarenes bearing asymmetric centers directly attached to the lower rim","New Journal of Chemistry","2008","32","8","1314","","10.1039/b801434p","","","0.7107","MoKα","","0.101","0.0816","","0.0865","","0.0847","","","","","","3.182","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053735","13.17","0.001","19.498","0.002","14.88","0.002","90","","107.687","0.002","90","","3640.4","0.7","180.2","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C78 H110 N2 O12 -","- C78 H104 N2 O12 -","- C156 H208 N4 O24 -","2","1","","Solovyov, Andrew; Notestein, Justin M.; Durkin, Kathleen A.; Katz, Alexander","Graftable chiral ligands for surface organometallic materials: calixarenes bearing asymmetric centers directly attached to the lower rim","New Journal of Chemistry","2008","32","8","1314","","10.1039/b801434p","","","0.7107","MoKα","","0.0896","0.0582","","0.0634","","0.0587","","","","","","1.674","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053736","11.039","0.007","11.132","0.007","20.671","0.013","90","","102.729","0.011","90","","2478","3","299","2","299","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H18 N3 O3 Re -","- C28 H18 N3 O3 Re -","- C112 H72 N12 O12 Re4 -","4","1","","Cuesta, Luciano; Morales, Dolores; Pérez, Julio; Miguel, Daniel","A new route for the synthesis of an alkylideneamido complex","New Journal of Chemistry","2008","32","6","917","","10.1039/b801799a","","","0.71073","MoKα","","0.072","0.0401","","","0.0766","0.0836","","","","","","1.035","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053737","13.7391","0.0004","11.559","0.0004","14.6082","0.0005","90","","100.743","0.002","90","","2279.27","0.13","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","chloromethylpyridylrheniumbipytricarbonyPF6","3-chloromethylpyridylbipyridylrheniumtricarbonylhexafluorophosphate","","- C19 H14 Cl F6 N3 O3 P Re -","- C19 H14 Cl F6 N3 O3 P Re -","- C76 H56 Cl4 F24 N12 O12 P4 Re4 -","4","1","","Amoroso, Angelo J.; Arthur, Richard J.; Coogan, Michael P.; Court, Jonathan B.; Fernández-Moreira, Vanesa; Hayes, Anthony J.; Lloyd, David; Millet, Coralie; Pope, Simon J. A.","3-Chloromethylpyridyl bipyridine fac-tricarbonyl rhenium: a thiol-reactive luminophore for fluorescence microscopy accumulates in mitochondria","New Journal of Chemistry","2008","32","7","1097","","10.1039/b802215a","","","0.71073","MoKα","","0.0798","0.0503","","","0.1094","0.1219","","","","","","1.023","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053738","19.4965","0.0015","8.5428","0.0007","6.2274","0.0005","90","","90","","90","","1037.2","0.14","193","2","193","2","","","","","","","","5","P n a 21","P 2c -2n","33","1-Methyl-4-cyanopyridinium methylsulfate","1-Methyl-4-cyanopyridinium methylsulfate","","- C8 H10 N2 O4 S -","- C8 H10 N2 O4 S -","- C32 H40 N8 O16 S4 -","4","1","","Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.","Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts","New Journal of Chemistry","2008","32","11","1953","","10.1039/b805063e","","","0.7749","synchrotronradiation","","0.0422","0.0352","","","0.1016","0.1177","","","","","","1.15","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053739","10.8446","0.0015","12.866","0.002","13.2369","0.0019","90.366","0.005","90.689","0.004","114.836","0.003","1675.8","0.4","193","2","193","2","","","","","","","","6","P -1","-P 1","2","1-Ethyl-3-(trifluoromethyl)pyridinium bis((trifluoromethyl)sulfonyl)amide","1-Ethyl-3-(trifluoromethyl)pyridinium bis{(trifluoromethyl)sulfonyl}amide","","- C10 H9 F9 N2 O4 S2 -","- C9.752 H9 F8.256 N2 O4 S2 -","- C39.008 H36 F33.024 N8 O16 S8 -","4","2","","Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.","Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts","New Journal of Chemistry","2008","32","11","1953","","10.1039/b805063e","","","0.7749","synchrotronradiation","","0.1033","0.0792","","","0.2184","0.2397","","","","","","0.992","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053740","11.4431","0.0011","11.8766","0.0011","12.1955","0.0011","90","","114.779","0.002","90","","1504.8","0.2","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-Methyl-4-cyanopyridinium bis{(trifluoromethyl)sulfonyl}amide","","- C9 H7 F6 N3 O4 S2 -","- C9 H7 F6 N3 O4 S2 -","- C36 H28 F24 N12 O16 S8 -","4","1","","Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.","Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts","New Journal of Chemistry","2008","32","11","1953","","10.1039/b805063e","","","0.7749","synchrotronradiation","","0.1064","0.099","","","0.3419","0.3582","","","","","","1.782","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053741","9.7224","0.0012","10.7874","0.0014","16.19","0.002","90","","103.573","0.002","90","","1650.6","0.4","193","2","193","2","","","","","","","","6","C 1 c 1","C -2yc","9","","1-Ethyl-4-cyanopyridinium bis{(trifluoromethyl)sulfonyl}amide","","- C10 H10 F6 N3 O4 S2 -","- C10 H9 F6 N3 O4 S2 -","- C40 H36 F24 N12 O16 S8 -","4","1","","Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.","Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts","New Journal of Chemistry","2008","32","11","1953","","10.1039/b805063e","","","0.7749","synchrotronradiation","","0.1203","0.1118","","","0.3035","0.3166","","","","","","1.275","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053742","7.462","0.0006","26.715","0.002","7.8762","0.0007","90","","113.876","0.002","90","","1435.7","0.2","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-Methyl-3-cyanopyridinium bis{(trifluoromethyl)sulfonyl}amide","","- C9 H7 F6 N3 O4 S2 -","- C9 H7 F6 N3 O4 S2 -","- C36 H28 F24 N12 O16 S8 -","4","1","","Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.","Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts","New Journal of Chemistry","2008","32","11","1953","","10.1039/b805063e","","","0.7749","synchrotronradiation","","0.053","0.0449","","","0.1349","0.1504","","","","","","1.154","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053743","8.226","0.008","15.886","0.015","12.553","0.012","90","","91.871","0.018","90","","1640","3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","1-Ethyl-3-cyanopyridinium bis{(trifluoromethyl)sulfonyl}amide","","- C10 H9 F6 N3 O4 S2 -","- C10 H9 F6 N3 O4 S2 -","- C40 H36 F24 N12 O16 S8 -","4","1","","Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.","Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts","New Journal of Chemistry","2008","32","11","1953","","10.1039/b805063e","","","0.71073","MoKα","","0.1343","0.0909","","","0.2428","0.2954","","","","","","1.042","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053744","12.29","0.016","13.837","0.02","19.51","0.03","90","","90","","90","","3318","8","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","1-Ethyl-2-cyanopyridinium bis{(trifluoromethyl)sulfonyl}amide","","- C10 H9 F6 N3 O4 S2 -","- C10 H9 F6 N3 O4 S2 -","- C80 H72 F48 N24 O32 S16 -","8","2","","Hardacre, Christopher; Holbrey, John D.; Mullan, Claire L.; Nieuwenhuyzen, Mark; Reichert, W. Matthew; Seddon, Kenneth R.; Teat, Simon J.","Ionic liquid characteristics of 1-alkyl-n-cyanopyridinium and 1-alkyl-n-(trifluoromethyl)pyridinium salts","New Journal of Chemistry","2008","32","11","1953","","10.1039/b805063e","","","0.71073","MoKα","","0.1624","0.0775","","","0.1819","0.2581","","","","","","1.014","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053745","8.71","0.005","28.868","0.007","31.206","0.006","90","","90","","90","","7846","5","293","2","293","2","","","","","","","","6","F 2 d d","F -2d 2","43","","","","- C12 H31.5 N O11 P0.5 S0.5 -","- C12 H24 N O11 P0.5 S0.5 -","- C192 H384 N16 O176 P8 S8 -","16","1","","Braga, Dario; Modena, Enrico; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Crystal forms of highly “dynamic” 18-crown[6] complexes with M[HSO4] and M[H2PO4] (M+ = NH4+, Rb+, Cs+): thermal behaviour and solid-state preparation","New Journal of Chemistry","2008","32","10","1718","","10.1039/b805203d","","","0.71073","MoKα","","0.0912","0.0598","","","0.1613","0.1875","","","","","","1.044","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053746","19.802","0.004","8.447","0.004","25.777","0.007","90","","101","0.02","90","","4232","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H31.5 O13 P0.5 Rb S0.5 -","- C12 H24 O13 P0.5 Rb S0.5 -","- C96 H192 O104 P4 Rb8 S4 -","8","1","","Braga, Dario; Modena, Enrico; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Crystal forms of highly “dynamic” 18-crown[6] complexes with M[HSO4] and M[H2PO4] (M+ = NH4+, Rb+, Cs+): thermal behaviour and solid-state preparation","New Journal of Chemistry","2008","32","10","1718","","10.1039/b805203d","","","0.71073","MoKα","","0.0744","0.039","","","0.1008","0.1124","","","","","","0.998","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053747","19.84","0.007","8.46","0.004","26.19","0.018","90","","101.14","0.06","90","","4313","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H31.5 Cs O13 P0.5 S0.5 -","- C12 H24 Cs O13 P0.5 S0.5 -","- C96 H192 Cs8 O104 P4 S4 -","8","1","","Braga, Dario; Modena, Enrico; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Crystal forms of highly “dynamic” 18-crown[6] complexes with M[HSO4] and M[H2PO4] (M+ = NH4+, Rb+, Cs+): thermal behaviour and solid-state preparation","New Journal of Chemistry","2008","32","10","1718","","10.1039/b805203d","","","0.71073","MoKα","","0.0765","0.0661","","","0.2049","0.2168","","","","","","1.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053748","11.064","0.004","8.655","0.003","22.644","0.008","90","","100.907","0.006","90","","2129.2","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H58 Cs2 O24 S2 -","- C24 H48 Cs2 O24 S2 -","- C48 H96 Cs4 O48 S4 -","2","0.5","","Braga, Dario; Modena, Enrico; Polito, Marco; Rubini, Katia; Grepioni, Fabrizia","Crystal forms of highly “dynamic” 18-crown[6] complexes with M[HSO4] and M[H2PO4] (M+ = NH4+, Rb+, Cs+): thermal behaviour and solid-state preparation","New Journal of Chemistry","2008","32","10","1718","","10.1039/b805203d","","","0.71073","MoKα","","0.0524","0.0333","","","0.0762","0.0835","","","","","","0.871","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053749","11.3081","0.0002","13.0763","0.0003","21.1935","0.0004","78.42","0.001","84.284","0.001","88.925","0.001","3054.79","0.11","173","2","173","2","","","","","","","","5","P 1","P 1","1","","","","- C129.5 H126 N8 O29.5 U4 -","- C129.5 H126 N8 O29.5 U4 -","- C129.5 H126 N8 O29.5 U4 -","1","1","","Cametti, Massimo; Dalla Cort, Antonella; Mandolini, Luigi; Nissinen, Maija; Rissanen, Kari","Specific recognition of fluoride anion using a metallamacrocycle incorporating a uranyl-salen unit","New Journal of Chemistry","2008","32","7","1113","","10.1039/b806149a","","","0.71069","MoKα","","0.0486","0.0442","","","0.1121","0.1186","","","","","","1.058","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053750","17.6804","0.0002","18.0029","0.0004","10.2337","0.0004","90","","90","","90","","3257.37","0.15","150","2","150","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C39 H38 N3 O4.5 -","- C39 H37 N3 O4.5 -","- C156 H148 N12 O18 -","4","1","","Suwinska, Kinga; Shkurenko, Oleksandr; Mbemba, Cyrille; Leydier, Antoine; Jebors, Said; Coleman, Anthony W.; Matar, Rima; Falson, Pierre","Trianionic calix[4]arene monoalkoxy derivatives: synthesis, solid-state structures and self-assembly properties","New Journal of Chemistry","2008","32","11","1988","","10.1039/b806342g","","","0.71073","MoKα","","0.12","0.085","","","0.21","0.231","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053751","17.6752","0.0005","17.6984","0.0007","10.6227","0.0004","90","0.002","90","0.002","90","0.002","3323","0.2","100","2","100","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C40 H39 N3 O4 -","- C40 H39 N3 O4 -","- C160 H156 N12 O16 -","4","1","","Suwinska, Kinga; Shkurenko, Oleksandr; Mbemba, Cyrille; Leydier, Antoine; Jebors, Said; Coleman, Anthony W.; Matar, Rima; Falson, Pierre","Trianionic calix[4]arene monoalkoxy derivatives: synthesis, solid-state structures and self-assembly properties","New Journal of Chemistry","2008","32","11","1988","","10.1039/b806342g","","","0.71073","MoKα","","0.136","0.093","","","0.222","0.245","","","","","","1.074","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053752","11.3123","0.0004","11.9398","0.0005","12.7159","0.0004","72.295","0.002","83.791","0.002","74.991","0.002","1579.52","0.1","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H34 N4 O4 -","- C38 H34 N4 O4 -","- C76 H68 N8 O8 -","2","1","","Suwinska, Kinga; Shkurenko, Oleksandr; Mbemba, Cyrille; Leydier, Antoine; Jebors, Said; Coleman, Anthony W.; Matar, Rima; Falson, Pierre","Trianionic calix[4]arene monoalkoxy derivatives: synthesis, solid-state structures and self-assembly properties","New Journal of Chemistry","2008","32","11","1988","","10.1039/b806342g","","","0.71073","MoKα","","0.0702","0.0501","","","0.1094","0.1177","","","","","","1.029","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053753","9.6286","0.0003","19.9708","0.0007","15.8164","0.0004","90","","92.258","0.002","90","","3038.99","0.16","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H35 N3 O4 -","- C38 H35 N3 O4 -","- C152 H140 N12 O16 -","4","1","","Suwinska, Kinga; Shkurenko, Oleksandr; Mbemba, Cyrille; Leydier, Antoine; Jebors, Said; Coleman, Anthony W.; Matar, Rima; Falson, Pierre","Trianionic calix[4]arene monoalkoxy derivatives: synthesis, solid-state structures and self-assembly properties","New Journal of Chemistry","2008","32","11","1988","","10.1039/b806342g","","","0.71073","MoKα","","0.1347","0.0795","","","0.1504","0.17","","","","","","1.036","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053754","16.2996","0.0018","24.9","0.003","5.747","0.0007","90","","90","","90","","2332.5","0.5","100","2","100","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C30 H29 N2 O2.5 -","- C30 H29 N2 O2.5 -","- C120 H116 N8 O10 -","4","1","","Imai, Yoshitane; Kawano, Kenta; Nakano, Yoko; Kawaguchi, Kakuhiro; Harada, Takunori; Sato, Tomohiro; Fujiki, Michiya; Kuroda, Reiko; Matsubara, Yoshio","Control of circularly polarized luminescence (CPL) properties by supramolecular complexation","New Journal of Chemistry","2008","32","7","1110","","10.1039/b806586c","","","0.71073","MoKα","","0.1043","0.0639","","","0.0927","0.1029","","","","","","1.056","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053755","6.541","0.0004","19.219","0.0005","12.07","0.0006","90","","97.601","0.007","90","","1504.01","0.13","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","GBPL_BenzoicAcid_cocrystal","","","- C16 H21 N O3 -","- C16 H21 N O3 -","- C64 H84 N4 O12 -","4","1","","Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Rubini, Katia; Polito, Marco; Brescello, Roberto; Cotarca, Livius; Duarte, M. Teresa; André, Vânia; Piedade, M. Fátima M.","Polymorphic gabapentin: thermal behaviour, reactivity and interconversion of forms in solution and solid-state","New Journal of Chemistry","2008","32","10","1788","","10.1039/b809662g","","","0.71069","MoKα","","0.0977","0.0449","","","0.0915","0.1031","","","","","","0.954","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053756","14.7361","0.0017","6.6656","0.0012","9.89","0.002","90","","106.09","0.006","90","","933.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Gabapentin","","","- C9 H17 N O2 -","- C9 H17 N O2 -","- C36 H68 N4 O8 -","4","1","","Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Rubini, Katia; Polito, Marco; Brescello, Roberto; Cotarca, Livius; Duarte, M. Teresa; André, Vânia; Piedade, M. Fátima M.","Polymorphic gabapentin: thermal behaviour, reactivity and interconversion of forms in solution and solid-state","New Journal of Chemistry","2008","32","10","1788","","10.1039/b809662g","","","0.71073","MoKα","","0.143","0.0654","","","0.153","0.1923","","","","","","0.806","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053757","30.582","0.009","5.932","0.003","10.915","0.003","90","","108.31","0.02","90","","1879.9","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Gabapentin","","","- C9 H17 N O2 -","- C9 H17 N O2 -","- C72 H136 N8 O16 -","8","1","","Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Rubini, Katia; Polito, Marco; Brescello, Roberto; Cotarca, Livius; Duarte, M. Teresa; André, Vânia; Piedade, M. Fátima M.","Polymorphic gabapentin: thermal behaviour, reactivity and interconversion of forms in solution and solid-state","New Journal of Chemistry","2008","32","10","1788","","10.1039/b809662g","","","0.71073","MoKα","","0.064","0.0476","","","0.1248","0.1362","","","","","","1.083","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053758","8.2394","0.001","14.0198","0.0017","16.306","0.002","90","","101.06","0.003","90","","1848.6","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 N2 O4 -","- C21 H20 N2 O4 -","- C84 H80 N8 O16 -","4","1","","Cornago, Pilar; Cabildo, Pilar; Claramunt, Rosa M.; Bouissane, Latifa; Pinilla, Elena; Torres, M. Rosario; Elguero, José","The annular tautomerism of the curcuminoid NH-pyrazoles","New Journal of Chemistry","2009","33","1","125","","10.1039/b812018h","","","0.71073","MoKα","","0.1461","0.0539","","","0.1279","0.1808","","","","","","0.912","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053759","13.2563","0.0015","7.6962","0.0009","22.855","0.003","90","","90","","90","","2331.7","0.5","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H14 N2 O2 -","- C13 H14 N2 O2 -","- C104 H112 N16 O16 -","8","1","","Cornago, Pilar; Cabildo, Pilar; Claramunt, Rosa M.; Bouissane, Latifa; Pinilla, Elena; Torres, M. Rosario; Elguero, José","The annular tautomerism of the curcuminoid NH-pyrazoles","New Journal of Chemistry","2009","33","1","125","","10.1039/b812018h","","","0.71073","MoKα","","0.1252","0.0508","","","0.132","0.1768","","","","","","1.034","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053760","8.519","0.002","12.964","0.004","34.615","0.01","90","","94.607","0.007","90","","3810.5","1.8","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C168 H192 N24 O24 -","12","3","","Cornago, Pilar; Cabildo, Pilar; Claramunt, Rosa M.; Bouissane, Latifa; Pinilla, Elena; Torres, M. Rosario; Elguero, José","The annular tautomerism of the curcuminoid NH-pyrazoles","New Journal of Chemistry","2009","33","1","125","","10.1039/b812018h","","","0.71073","MoKα","","0.171","0.0769","","","0.196","0.2486","","","","","","0.984","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053761","13.2363","0.0013","8.2769","0.0008","30.673","0.003","90","","90","","90","","3360.4","0.6","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H20 N2 O2 -","- C20 H20 N2 O2 -","- C160 H160 N16 O16 -","8","1","","Cornago, Pilar; Cabildo, Pilar; Claramunt, Rosa M.; Bouissane, Latifa; Pinilla, Elena; Torres, M. Rosario; Elguero, José","The annular tautomerism of the curcuminoid NH-pyrazoles","New Journal of Chemistry","2009","33","1","125","","10.1039/b812018h","","","0.71073","MoKα","","0.1168","0.0507","","","0.1267","0.1848","","","","","","1.074","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053762","9.3817","0.0019","9.3988","0.0019","9.776","0.002","82.84","0.03","62.55","0.03","76.32","0.03","743.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H19 Co N O13 P2 -","- C4 H19 Co N O13 P2 -","- C8 H38 Co2 N2 O26 P4 -","2","1","","Ma, Kuirong; Xu, Jianing; Zhang, Lirong; Shi, Jing; Zhang, Daojun; Zhu, Yulan; Fan, Yong; Song, Tianyong","Solvothermal syntheses, characterizations and properties of three transition metal (Ni(ii), Co(ii)) imino-carboxylate-diphosphonates","New Journal of Chemistry","2009","33","4","886","","10.1039/b814080d","","","0.71073","MoKα","","0.0342","0.0315","","","0.0877","0.0897","","","","","","1.045","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053763","11.568","0.002","10.689","0.002","15.816","0.003","90","","109.17","0.03","90","","1847.2","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H27 N Ni O17 P2 -","- C4 H27 N Ni O17 P2 -","- C16 H108 N4 Ni4 O68 P8 -","4","1","","Ma, Kuirong; Xu, Jianing; Zhang, Lirong; Shi, Jing; Zhang, Daojun; Zhu, Yulan; Fan, Yong; Song, Tianyong","Solvothermal syntheses, characterizations and properties of three transition metal (Ni(ii), Co(ii)) imino-carboxylate-diphosphonates","New Journal of Chemistry","2009","33","4","886","","10.1039/b814080d","","","0.71073","MoKα","","0.0444","0.0376","","","0.0925","0.0959","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053764","11.315","0.002","19.282","0.004","14.432","0.003","90","","103.01","0.03","90","","3067.9","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H44 N8 Ni2 O18 P4 -","- C11 H44 N8 Ni2 O18 P4 -","- C44 H176 N32 Ni8 O72 P16 -","4","0.5","","Ma, Kuirong; Xu, Jianing; Zhang, Lirong; Shi, Jing; Zhang, Daojun; Zhu, Yulan; Fan, Yong; Song, Tianyong","Solvothermal syntheses, characterizations and properties of three transition metal (Ni(ii), Co(ii)) imino-carboxylate-diphosphonates","New Journal of Chemistry","2009","33","4","886","","10.1039/b814080d","","","0.71073","MoKα","","0.0361","0.0302","","","0.0682","0.071","","","","","","1.094","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053765","10.102","0.0019","6.318","0.0012","16.512","0.006","90","0.02","92.07","0.02","90","0.016","1053.2","0.5","336","2","336","2","","","","","","","","5","C 1 2 1","C 2y","5","Ampheatmine sulphate","","","- C18 H28 N2 O4 S -","- C18 H28 N2 O4 S -","- C36 H56 N4 O8 S2 -","2","0.5","","Pogorzelec-Glaser, Katarzyna; Kaszyńska, Joanna; Rachocki, Adam; Tritt-Goc, Jadwiga; Piślewski, Narcyz; Pietraszko, Adam","The crystal structure and evidence of the phase transition in d-amphetamine sulfate, as studied by X-ray crystallography, DSC and NMR spectroscopy","New Journal of Chemistry","2009","33","9","1894","","10.1039/b815325f","","","0.71073","MoKα","","0.1358","0.0512","","","0.0856","0.0982","","","","","","1.023","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053766","10.609","0.0012","6.382","0.0006","30.133","0.004","90","0.009","94.37","0.01","90","0.009","2034.3","0.4","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","Amphetamine sulphate","","","- C18 H28 N2 O4 S -","- C18 H28 N2 O4 S -","- C72 H112 N8 O16 S4 -","4","2","","Pogorzelec-Glaser, Katarzyna; Kaszyńska, Joanna; Rachocki, Adam; Tritt-Goc, Jadwiga; Piślewski, Narcyz; Pietraszko, Adam","The crystal structure and evidence of the phase transition in d-amphetamine sulfate, as studied by X-ray crystallography, DSC and NMR spectroscopy","New Journal of Chemistry","2009","33","9","1894","","10.1039/b815325f","","","0.71073","MoKα","","0.0671","0.0491","","","0.0886","0.0917","","","","","","1.19","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053767","12.1987","0.0009","20.8765","0.0016","24.7757","0.0019","70.119","0.001","79.842","0.001","73.692","0.001","5671.9","0.7","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C109 H140 Cl2 N12 O16 -","- C109 H139.519 Cl2 N12 O16 -","- C218 H279.038 Cl4 N24 O32 -","2","1","","Zhan, Junyan; Tian, Demei; Li, Haibing","Synthesis of calix[4]crowns containing soft and hard ion binding sites via click chemistry","New Journal of Chemistry","2009","33","4","725","","10.1039/b816467c","","","0.71073","MoKα","","0.1439","0.1061","","","0.3073","0.3297","","","","","","1.106","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053768","19.839","0.004","14.322","0.003","19.416","0.004","90","","99.75","0.03","90","","5437","2","291","2","291","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C104 H100 Cl10 Fe6 N6 O8 Pd6 -","- C104 H100 Cl10 Fe6 N6 O8 Pd6 -","- C208 H200 Cl20 Fe12 N12 O16 Pd12 -","2","0.5","","Qian, Hengyu; Cui, Xiuling; Tang, Mingsheng; Liu, Chunhui; Liu, Cheng; Wu, Yangjie","Synthesis and structure of heteroannular cyclopalladated chiral ferrocenylimines: theoretical interpretation of the cyclopalladated complexes based on density functional calculations","New Journal of Chemistry","2009","33","3","668","","10.1039/b816826a","","","0.71073","MoKα","","0.065","0.0544","","","0.1087","0.1104","","","","","","1.089","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053769","11.55","0.002","13.138","0.003","20.046","0.004","90","","90","","90","","3041.9","1.1","291","2","291","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C35 H31 Cl Fe N O P Pd -","- C35 H31 Cl Fe N O P Pd -","- C140 H124 Cl4 Fe4 N4 O4 P4 Pd4 -","4","1","","Qian, Hengyu; Cui, Xiuling; Tang, Mingsheng; Liu, Chunhui; Liu, Cheng; Wu, Yangjie","Synthesis and structure of heteroannular cyclopalladated chiral ferrocenylimines: theoretical interpretation of the cyclopalladated complexes based on density functional calculations","New Journal of Chemistry","2009","33","3","668","","10.1039/b816826a","","","0.71073","MoKα","","0.0443","0.0301","","","0.0482","0.0501","","","","","","0.929","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053770","16.4766","0.0011","27.872","0.002","36.378","0.003","90","","90","","90","","16706","2","153","2","153","2","","","","","","","","7","C 2 2 21","C 2c 2","20","","","","- C89 H93.5 Ag2 F12 N10.5 O P2 -","- C89 H93.5 Ag2 F12 N10.5 O P2 -","- C712 H748 Ag16 F96 N84 O8 P16 -","8","1","","Perret-Aebi, Laure-Emmanuelle; von Zelewsky, Alexander; Neels, Antonia","Diastereoselective preparation of Cu(i) and Ag(i) double helices by the use of chiral bis-bipyridine ligands","New Journal of Chemistry","2009","33","3","462","","10.1039/b817610h","","","0.71073","MoKα","","0.1541","0.1196","","","0.3141","0.3372","","","","","","1.125","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053771","19.12","0.004","8.8777","0.0016","28.301","0.005","90","","90","","90","","4803.9","1.6","294","2","294","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H22 O5 S4 -","- C22 H22 O5 S4 -","- C176 H176 O40 S32 -","8","1","","Zhao, Yao-Peng; Wang, Xiao-Jun; Wang, Jing-Jing; Si, Gang; Liu, Yan; Tung, Chen-Ho; Wu, Li-Zhu","Tetrathiafulvalene derivatives bearing a crown ether with intramolecular charge transfer properties: synthesis and cation binding studies","New Journal of Chemistry","2009","33","4","813","","10.1039/b817892e","","","0.71073","MoKα","","0.1069","0.0422","","","0.0874","0.1086","","","","","","1.074","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053772","11.814","0.003","11.411","0.003","13.428","0.003","90","","99.29","0.006","90","","1786.5","0.8","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H9 N9 S3 -","- C15 H9 N9 S3 -","- C60 H36 N36 S12 -","4","1","","Wan, Chong-Qing; Han, Jie; Mak, Thomas C. W.","Intermolecular S⋯π interactions in crystalline sulfanyl-triazine derivatives","New Journal of Chemistry","2009","33","4","707","","10.1039/b818344a","","","0.71073","MoKα","","0.1294","0.0567","","","0.1159","0.1443","","","","","","0.98","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7053773","8.5497","0.0011","11.0612","0.0015","11.5176","0.0016","70.183","0.002","78.748","0.003","81.825","0.003","1001.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H15 N9 S3 -","- C18 H15 N9 S3 -","- C36 H30 N18 S6 -","2","1","","Wan, Chong-Qing; Han, Jie; Mak, Thomas C. W.","Intermolecular S⋯π interactions in crystalline sulfanyl-triazine derivatives","New Journal of Chemistry","2009","33","4","707","","10.1039/b818344a","","","0.71073","MoKα","","0.0531","0.0392","","","0.1011","0.1096","","","","","","1.057","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053774","18.2659","0.0001","14.8059","0.0001","20.5792","0.0002","90","","92.9257","0.0005","90","","5558.25","0.07","173","","173","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H53 F12 Fe N7 O8 P2 -","- C54 H53 F12 Fe N7 O8 P2 -","- C216 H212 F48 Fe4 N28 O32 P8 -","4","1","","Chow, Hoi Shan; Constable, Edwin C.; Frantz, Richard; Housecroft, Catherine E.; Lacour, Jérôme; Neuburger, Markus; Rappoport, Dmitrij; Schaffner, Silvia","Conformationally-locked metallomacrocycles—prototypes for a novel type of axial chirality","New Journal of Chemistry","2009","33","2","376","","10.1039/b819588a","","","0.71073","MoKα","","0.069","0.0425","","0.066","0.0574","0.0574","","","","","","1.1195","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053775","15.701","0.002","13.1938","0.0016","16.31","0.002","90","","90","","90","","3378.7","0.7","123","2","123","2","","","","","","","dichloromethane-hexane","5","P b c n","-P 2n 2ab","60","[AgCl(IDitop)]","","","- C43 H36 Ag Cl N2 -","- C43 H36 Ag Cl N2 -","- C172 H144 Ag4 Cl4 N8 -","4","0.5","","Alexander, Sean G.; Cole, Marcus L.; Morris, Jonathan C.","Preparation of a super bulky silver N-heterocyclic carbene complex","New Journal of Chemistry","2009","33","4","720","","10.1039/b821368b","","x-ray","0.71073","MoKα","","0.1148","0.0989","","","0.158","0.1637","","","","","","1.227","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053776","9.4785","0.0019","10.348","0.002","14.088","0.003","69.73","0.03","76.14","0.03","82.22","0.03","1256.4","0.5","123","2","123","2","","","","","","","dichloromethane-hexane","5","P -1","-P 1","2","[AgCl(IBp)].CH2Cl2","","","- C28 H22 Ag Cl3 N2 -","- C28 H22 Ag Cl3 N2 -","- C56 H44 Ag2 Cl6 N4 -","2","1","","Alexander, Sean G.; Cole, Marcus L.; Morris, Jonathan C.","Preparation of a super bulky silver N-heterocyclic carbene complex","New Journal of Chemistry","2009","33","4","720","","10.1039/b821368b","","x-ray","0.71073","MoKα","","0.0343","0.031","","","0.0772","0.0791","","","","","","1.038","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7053777","14.414","0.0008","16.8693","0.001","6.3926","0.0003","90","","90.377","0.003","90","","1554.35","0.15","123","2","123","2","","","","","","","ethanol","3","P 1 21/c 1","-P 2ybc","14","DitopDAB","","","- C42 H36 N2 -","- C42 H36 N2 -","- C84 H72 N4 -","2","0.5","","Alexander, Sean G.; Cole, Marcus L.; Morris, Jonathan C.","Preparation of a super bulky silver N-heterocyclic carbene complex","New Journal of Chemistry","2009","33","4","720","","10.1039/b821368b","","x-ray","0.71073","MoKα","","0.2219","0.0796","","","0.124","0.166","","","","","","0.996","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7053778","8.959","0.016","10.52","0.02","17.69","0.03","97.56","0.09","97.02","0.08","107.21","0.08","1556","5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","1,2-Bis(2-trimethylsilyl-5-phenyl-3-thienyl)perfluorocyclopentene","","- C31 H30 F6 S2 Si2 -","- C31 H30 F6 S2 Si2 -","- C62 H60 F12 S4 Si4 -","2","1","","Kobatake, Seiya; Imagawa, Hiroyuki; Nakatani, Hidenori; Nakashima, Seiichiro","The irreversible thermo-bleaching function of a photochromic diarylethene having trimethylsilyl groups","New Journal of Chemistry","2009","33","6","1362","","10.1039/b822372f","","","0.71075","MoKα","","0.0676","0.0628","","","0.1664","0.1682","","","","","","1.217","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053779","13.994","0.012","16.162","0.015","23.68","0.02","90","","94.73","0.04","90","","5337","8","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(6,6,7,7,8,8-Hexafluoro-2-phenyl-4-trimethylsilanyl- 7,8-dihydro-6H-3-thia-as-indacen-5-yl)-1-phenyl- ethenethiol","","- C28 H22 F6 S2 Si -","- C28 H22 F6 S2 Si -","- C224 H176 F48 S16 Si8 -","8","1","","Kobatake, Seiya; Imagawa, Hiroyuki; Nakatani, Hidenori; Nakashima, Seiichiro","The irreversible thermo-bleaching function of a photochromic diarylethene having trimethylsilyl groups","New Journal of Chemistry","2009","33","6","1362","","10.1039/b822372f","","","0.71075","MoKα","","0.2809","0.1241","","","0.3047","0.3798","","","","","","0.922","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053780","19.245","0.01","24.97","0.011","3.9399","0.0019","90","","90","","90","","1893.3","1.6","123","2","123","2","","","","","","","","4","P b a 2","P 2 -2ab","32","","4,4,5,6-Tetrafluoro-2,8-diphenyl-4H-1,9-dithia-trindene (1d)","","- C25 H12 F4 S2 -","- C25 H12 F4 S2 -","- C100 H48 F16 S8 -","4","1","","Kobatake, Seiya; Imagawa, Hiroyuki; Nakatani, Hidenori; Nakashima, Seiichiro","The irreversible thermo-bleaching function of a photochromic diarylethene having trimethylsilyl groups","New Journal of Chemistry","2009","33","6","1362","","10.1039/b822372f","","","0.71075","MoKα","","0.1303","0.0589","","","0.1006","0.1149","","","","","","0.803","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053781","7.925","0.0016","11.338","0.002","23.147","0.005","90","","98.14","0.03","90","","2058.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H23 I N2 O -","- C23 H23 I N2 O -","- C92 H92 I4 N8 O4 -","4","1","","Morgunov, Roman B.; Mushenok, Fedor B.; Aldoshin, Sergey M.; Sanina, Natalia A.; Yur’eva, Elena A.; Shilov, Gennadiy V.; Tkachev, Valeriy V.","Thermally-induced paramagnetism of spiropyrane iodides","New Journal of Chemistry","2009","33","6","1374","","10.1039/b822567b","","","0.71073","MoKα","","0.1204","0.0458","","","0.1201","0.1347","","","","","","0.978","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053782","12.862","0.003","11.025","0.002","16.019","0.003","90","","112","0.03","90","","2106.1","0.9","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H27 I N2 O -","- C22 H27 I N2 O -","- C88 H108 I4 N8 O4 -","4","1","","Morgunov, Roman B.; Mushenok, Fedor B.; Aldoshin, Sergey M.; Sanina, Natalia A.; Yur’eva, Elena A.; Shilov, Gennadiy V.; Tkachev, Valeriy V.","Thermally-induced paramagnetism of spiropyrane iodides","New Journal of Chemistry","2009","33","6","1374","","10.1039/b822567b","","","0.71073","MoKα","","0.2179","0.076","","","0.2317","0.252","","","","","","1.088","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053783","10.4582","0.0005","19.8097","0.0009","14.9154","0.0007","90","","100.277","0.004","90","","3040.5","0.2","100","1","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C64 H58 F12 N4 S4 Si2 -","- C64 H58 F12 N4 S4 Si2 -","- C128 H116 F24 N8 S8 Si4 -","2","0.5","","Aubert, Vincent; Ishow, Elena; Ibersiene, Fatima; Boucekkine, Abdou; Williams, J. A. Gareth; Toupet, Loic; Métivier, Rémi; Nakatani, Keitaro; Guerchais, Véronique; Le Bozec, Hubert","A “reverse interrupter”: the novel molecular design of a fluorescent photochromic DTE-based bipyridine","New Journal of Chemistry","2009","33","6","1320","","10.1039/b823113c","","","0.71069","MoKα","","0.1082","0.0765","","","0.2513","0.2604","","","","","","1.27","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053784","21.5048","0.0009","21.5048","0.0009","21.5048","0.0009","91.042","0.011","91.042","0.011","91.042","0.011","9940","0.7","100","2","100","2","","","","","","","","3","R -3 :R","-P 3*","148","","","","- C64 H102 O17 -","- C64 H96 O17 -","- C384 H576 O102 -","6","1","","Kulikov, Oleg V.; Rath, Nigam P.; Zhou, Dan; Carasel, I. Alexandru; Gokel, George W.","Guest molecule entrapment by both capsule and hydrocarbon sidechains in self-assembled pyrogallol[4]arenes","New Journal of Chemistry","2009","33","7","1563","","10.1039/b823160e","","","0.71073","MoKα","","0.4117","0.1649","","","0.4189","0.5605","","","","","","1.458","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053785","37.21","0.002","37.21","0.002","25.915","0.004","90","","90","","120","","31074","5","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C146 H227 N O28 -","- C146 H227 N O28 -","- C1314 H2043 N9 O252 -","9","0.5","","Kulikov, Oleg V.; Rath, Nigam P.; Zhou, Dan; Carasel, I. Alexandru; Gokel, George W.","Guest molecule entrapment by both capsule and hydrocarbon sidechains in self-assembled pyrogallol[4]arenes","New Journal of Chemistry","2009","33","7","1563","","10.1039/b823160e","","","0.71073","MoKα","","0.3292","0.1898","","","0.4486","0.536","","","","","","1.601","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053786","37.052","0.002","37.052","0.002","25.8772","0.0019","90","","90","","120","","30766","3","100","2","100","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C71 H110 O15 -","- C71 H103 O15 -","- C1278 H1854 O270 -","18","1","","Kulikov, Oleg V.; Rath, Nigam P.; Zhou, Dan; Carasel, I. Alexandru; Gokel, George W.","Guest molecule entrapment by both capsule and hydrocarbon sidechains in self-assembled pyrogallol[4]arenes","New Journal of Chemistry","2009","33","7","1563","","10.1039/b823160e","","","0.71073","MoKα","","0.2448","0.1301","","","0.3501","0.4327","","","","","","1.335","","","","has coordinates,has disorder","180091","2020-10-21","18:00:00",""
"7053787","16.1217","0.0004","12.4587","0.0003","34.4958","0.001","90","","90","","90","","6928.7","0.3","103","","103","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C42 H26 Cl4 N4 -","- C42 H26 Cl4 N4 -","- C336 H208 Cl32 N32 -","8","1","","Kimoto, Atsushi; Niitsu, Shimpei; Iwahori, Fumiyasu; Abe, Jiro","Formation of hexaarylbiimidazole heterodimers via the cross recombination of two lophyl radicals","New Journal of Chemistry","2009","33","6","1339","","10.1039/b823277f","","","0.71073","MoKα","","0.1329","0.0708","","","0.1555","0.1922","","","","","","1.012","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053788","12.35","0.002","15.981","0.003","18","0.003","90","","107.4","0.002","90","","3390","1","103","","103","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H26 Cl4 N4 -","- C42 H26 Cl4 N4 -","- C168 H104 Cl16 N16 -","4","1","","Kimoto, Atsushi; Niitsu, Shimpei; Iwahori, Fumiyasu; Abe, Jiro","Formation of hexaarylbiimidazole heterodimers via the cross recombination of two lophyl radicals","New Journal of Chemistry","2009","33","6","1339","","10.1039/b823277f","","","0.71073","MoKα","","0.0584","0.0451","","","0.1442","0.1577","","","","","","1.003","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053789","17.8938","0.0004","14.1917","0.0003","18.1886","0.0003","90","","97.616","0.001","90","","4578.13","0.16","103","","103","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C54 H36 Cl6 N4 -","- C54 H36 Cl6 N4 -","- C216 H144 Cl24 N16 -","4","1","","Kimoto, Atsushi; Niitsu, Shimpei; Iwahori, Fumiyasu; Abe, Jiro","Formation of hexaarylbiimidazole heterodimers via the cross recombination of two lophyl radicals","New Journal of Chemistry","2009","33","6","1339","","10.1039/b823277f","","","0.71073","MoKα","","0.0752","0.0435","","","0.1007","0.1107","","","","","","1.025","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053790","24.7188","0.0014","12.7989","0.0009","13.7089","0.0008","90","","122.714","0.0014","90","","3649.2","0.4","193.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 N S3 -","- C21 H15 N S3 -","- C168 H120 N8 S24 -","8","2","","Kutsunugi, Yuichiro; Kawai, Shigekazu; Nakashima, Takuya; Kawai, Tsuyoshi","Photochromic properties of terarylene derivatives having a π-conjugation unit on central aromatic ring","New Journal of Chemistry","2009","33","6","1368","","10.1039/b823413b","","","0.71075","MoKα","","","0.0447","","","","0.0401","","","","","","0.955","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053791","13.8694","0.0008","14.3213","0.0008","26.3741","0.0014","90","","98.256","0.004","90","","5184.3","0.5","173","","173","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H44 Br2 Cl4 Si2 -","- C56 H44 Br2 Cl3.992 Si2 -","- C224 H176 Br8 Cl15.968 Si8 -","4","0.5","","Aubouy, Laurent; Huby, Nolwenn; Hirsch, Lionel; van der Lee, Arie; Gerbier, Philippe","Molecular engineering to improve the charge carrier balance in single-layer silole-based OLEDs","New Journal of Chemistry","2009","33","6","1290","","10.1039/b900780f","","","0.71069","MoKα","","0.1198","0.0391","","0.072","0.0383","0.0383","","","","","","1.126","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053792","9.0484","0.0002","17.9216","0.0003","8.8899","0.0002","90","","95.942","0.001","90","","1433.86","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1',2-bis(diphenylphosphanyl)ferrrocene-1-carboxylic acid","1',2-bis(diphenylphosphanyl)ferrrocene-1-carboxylic acid","","- C35 H28 Fe O2 P2 -","- C35 H28 Fe O2 P2 -","- C70 H56 Fe2 O4 P4 -","2","0.5","","Lamač, Martin; Císařová, Ivana; Štěpnička, Petr","Preparation, coordination and catalytic use of planar-chiral monocarboxylated dppf analogues","New Journal of Chemistry","2009","33","7","1549","","10.1039/b901262a","","","0.71073","MoKα","","0.0452","0.0347","","","0.0861","0.0925","","","","","","1.025","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7053793","9.0257","0.0002","17.9691","0.0003","9.0278","0.0002","90","","94.44","0.001","90","","1459.77","0.05","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","methyl (Rp)-1',2-bis(diphenylphosphino)ferrocene-1-carboxylate","methyl (Rp)-1',2-bis(diphenylphosphino)ferrocene-1-carboxylate","","- C36 H30 Fe O2 P2 -","- C36 H30 Fe O2 P2 -","- C72 H60 Fe2 O4 P4 -","2","1","","Lamač, Martin; Císařová, Ivana; Štěpnička, Petr","Preparation, coordination and catalytic use of planar-chiral monocarboxylated dppf analogues","New Journal of Chemistry","2009","33","7","1549","","10.1039/b901262a","","","0.71073","MoKα","","0.0314","0.0288","","","0.0811","0.083","","","","","","1.102","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053794","34.878","0.001","8.5038","0.0002","14.9636","0.0004","90","","110.062","0.001","90","","4168.84","0.19","150","2","150","2","","","","","","","","5","C 1 2 1","C 2y","5","1,2,5,6-Di-O-isopropylidene-alfa-D-3-glucofuranosyl (Rp)-1',2- bis(diphenylphosphino)ferrocene-1-carboxylate","1,2,5,6-Di-O-isopropylidene-alfa-D-3-glucofuranosyl (Rp)-1',2-bis(diphenylphosphino)ferrocene-1-carboxylate","","- C47 H46 Fe O7 P2 -","- C47 H46 Fe O7 P2 -","- C188 H184 Fe4 O28 P8 -","4","1","","Lamač, Martin; Císařová, Ivana; Štěpnička, Petr","Preparation, coordination and catalytic use of planar-chiral monocarboxylated dppf analogues","New Journal of Chemistry","2009","33","7","1549","","10.1039/b901262a","","","0.71073","MoKα","","0.0417","0.0331","","","0.0679","0.0718","","","","","","1.051","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053795","10.7792","0.0002","10.9451","0.0002","16.5867","0.0003","70.834","0.0009","82.3917","0.0009","68.1648","0.0009","1715.69","0.06","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H34 Cl2 Fe O3 P2 Pd -","- C38 H34 Cl2 Fe O3 P2 Pd -","- C76 H68 Cl4 Fe2 O6 P4 Pd2 -","2","1","","Lamač, Martin; Císařová, Ivana; Štěpnička, Petr","Preparation, coordination and catalytic use of planar-chiral monocarboxylated dppf analogues","New Journal of Chemistry","2009","33","7","1549","","10.1039/b901262a","","","0.71073","MoKα","","0.0364","0.0286","","","0.0646","0.0683","","","","","","1.063","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053796","13.0501","0.0007","14.616","0.001","16.703","0.001","90","","111.357","0.005","90","","2967.2","0.3","150","2","150","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C65 H64 Cl Fe N O9 P2 Pd -","- C57 H48 Cl Fe N O5 P2 Pd -","- C114 H96 Cl2 Fe2 N2 O10 P4 Pd2 -","2","1","","Lamač, Martin; Císařová, Ivana; Štěpnička, Petr","Preparation, coordination and catalytic use of planar-chiral monocarboxylated dppf analogues","New Journal of Chemistry","2009","33","7","1549","","10.1039/b901262a","","","0.71073","MoKα","","0.0681","0.0493","","","0.1002","0.109","","","","","","1.067","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053797","17.4443","0.0008","10.6294","0.0005","17.7187","0.0008","90","","101.511","0.004","90","","3219.4","0.3","180","2","180","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","beta-[Fe(sal2-trien)][Ni(dmit)2]","beta-(N,N'-3,6-diazaoctane-1,8-diylbis(salicylidenealdiminato))-iron(iii) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)-nickel","","- C26 H24 Fe N4 Ni O2 S10 -","- C26 H24 Fe N4 Ni O2 S10 -","- C104 H96 Fe4 N16 Ni4 O8 S40 -","4","1","","Faulmann, Christophe; Szilágyi, Petra Á.; Jacob, Kane; Chahine, Joe; Valade, Lydie","Polymorphism and its effects on the magnetic behaviour of the [Fe(sal2-trien)][Ni(dmit)2] spin-crossover complex","New Journal of Chemistry","2009","33","6","1268","","10.1039/b901779h","","","0.71073","MoKα","","0.0579","0.0414","","","0.1037","0.1111","","","","","","1.02","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053798","44.9352","0.0018","13.5827","0.0005","22.543","0.001","90","","104.386","0.002","90","","13327.5","0.9","160","2","160","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","delta-(N,N'-3,6-diazaoctane-1,8-diylbis(salicylidenealdiminato))-iron(iii) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)-nickel","","- C26 H24 Fe N4 Ni O2 S10 -","- C26 H24 Fe N4 Ni O2 S10 -","- C416 H384 Fe16 N64 Ni16 O32 S160 -","16","2","","Faulmann, Christophe; Szilágyi, Petra Á.; Jacob, Kane; Chahine, Joe; Valade, Lydie","Polymorphism and its effects on the magnetic behaviour of the [Fe(sal2-trien)][Ni(dmit)2] spin-crossover complex","New Journal of Chemistry","2009","33","6","1268","","10.1039/b901779h","","","0.71073","MoKα","","0.0749","0.0423","","","0.1037","0.1323","","","","","","1.022","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053799","17.5888","0.0014","10.7316","0.0008","17.7742","0.0012","90","","101.342","0.009","90","","3289.5","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","beta-[Fe(sal2-trien)][Ni(dmit)2]","beta-(N,N'-3,6-diazaoctane-1,8-diylbis(salicylidenealdiminato))-iron(iii) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)-nickel","","- C26 H24 Fe N4 Ni O2 S10 -","- C26 H24 Fe N4 Ni O2 S10 -","- C104 H96 Fe4 N16 Ni4 O8 S40 -","4","1","","Faulmann, Christophe; Szilágyi, Petra Á.; Jacob, Kane; Chahine, Joe; Valade, Lydie","Polymorphism and its effects on the magnetic behaviour of the [Fe(sal2-trien)][Ni(dmit)2] spin-crossover complex","New Journal of Chemistry","2009","33","6","1268","","10.1039/b901779h","","","0.71073","MoKα","","0.0465","0.0292","","","0.0635","0.067","","","","","","0.956","","","","has coordinates","180091","2020-10-21","18:00:00",""
"7053800","45.1691","0.0011","13.7916","0.0003","22.6893","0.0006","90","","104.541","0.001","90","","13681.6","0.6","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","delta-(N,N'-3,6-diazaoctane-1,8-diylbis(salicylidenealdiminato))-iron(iii) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)-nickel","","- C26 H24 Fe N4 Ni O2 S10 -","- C26 H24 Fe N4 Ni O2 S10 -","- C416 H384 Fe16 N64 Ni16 O32 S160 -","16","2","","Faulmann, Christophe; Szilágyi, Petra Á.; Jacob, Kane; Chahine, Joe; Valade, Lydie","Polymorphism and its effects on the magnetic behaviour of the [Fe(sal2-trien)][Ni(dmit)2] spin-crossover complex","New Journal of Chemistry","2009","33","6","1268","","10.1039/b901779h","","","0.71073","MoKα","","0.087","0.0456","","","0.1229","0.1623","","","","","","1.036","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053801","11.825","0.005","12.542","0.005","13.795","0.005","106.884","0.005","90.945","0.005","93.107","0.005","1953.7","1.3","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H33 Fe N5 Ni O3 S10 -","- C31 H33 Fe N5 Ni O3 S10 -","- C62 H66 Fe2 N10 Ni2 O6 S20 -","2","1","","Faulmann, Christophe; Szilágyi, Petra Á.; Jacob, Kane; Chahine, Joe; Valade, Lydie","Polymorphism and its effects on the magnetic behaviour of the [Fe(sal2-trien)][Ni(dmit)2] spin-crossover complex","New Journal of Chemistry","2009","33","6","1268","","10.1039/b901779h","","","0.71073","MoKα","","0.0807","0.0504","","","0.1246","0.1361","","","","","","0.977","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053802","11.851","0.0006","12.6497","0.0005","13.9373","0.0007","106.764","0.004","90.695","0.004","92.602","0.004","1997.81","0.17","250","2","250","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H33 Fe N5 Ni O3 S10 -","- C31 H33 Fe N5 Ni O3 S10 -","- C62 H66 Fe2 N10 Ni2 O6 S20 -","2","1","","Faulmann, Christophe; Szilágyi, Petra Á.; Jacob, Kane; Chahine, Joe; Valade, Lydie","Polymorphism and its effects on the magnetic behaviour of the [Fe(sal2-trien)][Ni(dmit)2] spin-crossover complex","New Journal of Chemistry","2009","33","6","1268","","10.1039/b901779h","","","0.71073","MoKα","","0.0769","0.0377","","","0.0961","0.1217","","","","","","1.082","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053803","11.929","0.0015","12.08","0.0016","16.541","0.002","111.183","0.016","76.94","0.016","115.272","0.014","2002.5","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","(N,N'-3,6-diazaoctane-1,8-diylbis(salicylidenealdiminato))-iron(iii) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)-nickel, acetone solvate","","- C29 H30 Fe N4 Ni O3 S10 -","- C29 H30 Fe N4 Ni O3 S10 -","- C58 H60 Fe2 N8 Ni2 O6 S20 -","2","1","","Faulmann, Christophe; Szilágyi, Petra Á.; Jacob, Kane; Chahine, Joe; Valade, Lydie","Polymorphism and its effects on the magnetic behaviour of the [Fe(sal2-trien)][Ni(dmit)2] spin-crossover complex","New Journal of Chemistry","2009","33","6","1268","","10.1039/b901779h","","","0.71069","MoKα","","0.0837","0.0515","","","0.1439","0.1535","","","","","","0.933","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053804","9.9","0.002","17.02","0.003","12.89","0.003","90","","96.53","0.03","90","","2157.8","0.8","180","2","180","","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 B2 Fe N12 -","- C18 H20 B2 Fe N12 -","- C72 H80 B8 Fe4 N48 -","4","1","","Salmon, Lionel; Molnár, Gábor; Cobo, Saioa; Oulié, Pascal; Etienne, Michel; Mahfoud, Tarik; Demont, Philippe; Eguchi, Akira; Watanabe, Hiroshi; Tanaka, Koichiro; Bousseksou, Azzedine","Re-investigation of the spin crossover phenomenon in the ferrous complex [Fe(HB(pz)3)2]","New Journal of Chemistry","2009","33","6","1283","","10.1039/b902811k","","","0.71073","MoKα","","0.0344","0.0269","","","0.0664","0.071","","","","","","1.028","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053805","9.9386","0.0007","17.072","0.002","12.9414","0.0014","90","","96.658","0.007","90","","2181","0.4","298","","","","","","","","","","Local laboratory","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 B2 Fe N12 -","- C18 H20 B2 Fe N12 -","- C72 H80 B8 Fe4 N48 -","4","1","","Salmon, Lionel; Molnár, Gábor; Cobo, Saioa; Oulié, Pascal; Etienne, Michel; Mahfoud, Tarik; Demont, Philippe; Eguchi, Akira; Watanabe, Hiroshi; Tanaka, Koichiro; Bousseksou, Azzedine","Re-investigation of the spin crossover phenomenon in the ferrous complex [Fe(HB(pz)3)2]","New Journal of Chemistry","2009","33","6","1283","","10.1039/b902811k","","","0.71073","MoKα","","0.0825","0.0409","","","0.0804","0.0955","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053806","9.8404","0.0006","17.621","0.002","13.3148","0.0014","90","","97.068","0.007","90","","2291.2","0.4","420","","","","","","","","","","Local laboratory","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 B2 Fe N12 -","- C18 H20 B2 Fe N12 -","- C72 H80 B8 Fe4 N48 -","4","1","","Salmon, Lionel; Molnár, Gábor; Cobo, Saioa; Oulié, Pascal; Etienne, Michel; Mahfoud, Tarik; Demont, Philippe; Eguchi, Akira; Watanabe, Hiroshi; Tanaka, Koichiro; Bousseksou, Azzedine","Re-investigation of the spin crossover phenomenon in the ferrous complex [Fe(HB(pz)3)2]","New Journal of Chemistry","2009","33","6","1283","","10.1039/b902811k","","","0.71073","MoKα","","0.1676","0.0501","","","0.0642","0.0866","","","","","","0.999","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053807","10.8056","0.0009","12.5425","0.0011","16.8485","0.0014","90","","96.964","0.002","90","","2266.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H52 Br2 N4 O2 -","- C50 H52 Br2 N4 O2 -","- C100 H104 Br4 N8 O4 -","2","0.5","","Zhang, Hui; Xie, Lixia; Yan, Wenbo; He, Cheng; Cao, Xin; Duan, Chunying","Conformational switching fluorescent chemodosimeter for the selective detection of silver(i) ions","New Journal of Chemistry","2009","33","7","1478","","10.1039/b904369a","","","0.71073","MoKα","","0.1645","0.0672","","","0.1381","0.1573","","","","","","0.996","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053808","12.779","0.001","12.956","0.001","13.7","0.001","77.252","0.001","69.776","0.001","69.642","0.001","1982.4","0.3","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C68 H82 Cl16 Cr2 N4 P4 -","- C68 H82 Cl16 Cr2 N4 P4 -","- C68 H82 Cl16 Cr2 N4 P4 -","1","0.5","","Klemps, Christian; Buchard, Antoine; Houdard, Romaric; Auffrant, Audrey; Mézailles, Nicolas; Le Goff, Xavier Frédéric; Ricard, Louis; Saussine, Lucien; Magna, Lionel; Le Floch, Pascal","Chromium (iii)-bis(iminophosphoranyl)methanido complexes: synthesis, X-ray crystal structures and catalytic ethylene oligomerization","New Journal of Chemistry","2009","33","8","1748","","10.1039/b904619d","","","0.71069","MoKα","","0.0466","0.0354","","","0.0936","0.1001","","","","","","1.051","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053809","11.078","0.001","22.191","0.001","14.487","0.001","90","","97.136","0.001","90","","3533.8","0.4","150","0.1","150","0.1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C74 H94 Cl4 Cr2 N4 O2 P4 -","- C74 H94 Cl4 Cr2 N4 O2 P4 -","- C148 H188 Cl8 Cr4 N8 O4 P8 -","2","0.5","","Klemps, Christian; Buchard, Antoine; Houdard, Romaric; Auffrant, Audrey; Mézailles, Nicolas; Le Goff, Xavier Frédéric; Ricard, Louis; Saussine, Lucien; Magna, Lionel; Le Floch, Pascal","Chromium (iii)-bis(iminophosphoranyl)methanido complexes: synthesis, X-ray crystal structures and catalytic ethylene oligomerization","New Journal of Chemistry","2009","33","8","1748","","10.1039/b904619d","","","0.71069","MoKα","","0.067","0.0445","","","0.1206","0.1337","","","","","","1.044","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053810","9.412","0.001","13.128","0.001","18.731","0.001","72.651","0.001","83.444","0.001","80.124","0.001","2171.5","0.3","150","0.1","150","0.1","","","","","","","","7","P -1","-P 1","2","","","","- C47 H51 Cl2 Cr N2 O4 P2 -","- C47 H51 Cl2 Cr N2 O4 P2 -","- C94 H102 Cl4 Cr2 N4 O8 P4 -","2","1","","Klemps, Christian; Buchard, Antoine; Houdard, Romaric; Auffrant, Audrey; Mézailles, Nicolas; Le Goff, Xavier Frédéric; Ricard, Louis; Saussine, Lucien; Magna, Lionel; Le Floch, Pascal","Chromium (iii)-bis(iminophosphoranyl)methanido complexes: synthesis, X-ray crystal structures and catalytic ethylene oligomerization","New Journal of Chemistry","2009","33","8","1748","","10.1039/b904619d","","","0.71069","MoKα","","0.1129","0.0733","","","0.2047","0.2261","","","","","","1.035","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053811","9.08","0.0002","9.104","0.0003","21.15","0.0007","94.899","0.003","94.81","0.002","91.322","0.002","1735.02","0.09","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H24 Co F6 N6 O9 S2 -","- C32 Co F6 N6 O9 S2 -","- C64 Co2 F12 N12 O18 S4 -","2","1","","Agustí, Gloria; Bartual, Carlos; Martínez, Víctor; Muñoz-Lara, Francisco J.; Gaspar, Ana B.; Muñoz, M. Carmen; Real, José A.","Polymorphism and “reverse” spin transition in the spin crossover system [Co(4-terpyridone)2](CF3SO3)2·1H2O","New Journal of Chemistry","2009","33","6","1262","","10.1039/b905674b","","","0.71073","MoKα","","0.1879","0.1575","","","0.4033","0.4406","","","","","","1.354","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053812","9.102","0.0005","9.241","0.0005","21.386","0.0018","94.896","0.002","94.487","0.002","90.73","0.006","1786.4","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H24 Co F6 N6 O9 S2 -","- C32 H20 Co F6 N6 O9 S2 -","- C64 H40 Co2 F12 N12 O18 S4 -","2","1","","Agustí, Gloria; Bartual, Carlos; Martínez, Víctor; Muñoz-Lara, Francisco J.; Gaspar, Ana B.; Muñoz, M. Carmen; Real, José A.","Polymorphism and “reverse” spin transition in the spin crossover system [Co(4-terpyridone)2](CF3SO3)2·1H2O","New Journal of Chemistry","2009","33","6","1262","","10.1039/b905674b","","","0.71073","MoKα","","0.1355","0.0936","","","0.2761","0.3208","","","","","","1.251","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053813","9.57","0.0004","14.351","0.0009","14.954","0.0008","75.456","0.004","71.982","0.004","72.274","0.002","1832.19","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H24 Co F6 N6 O9 S2 -","- C32 H20 Co F6 N6 O9 S2 -","- C64 H40 Co2 F12 N12 O18 S4 -","2","1","","Agustí, Gloria; Bartual, Carlos; Martínez, Víctor; Muñoz-Lara, Francisco J.; Gaspar, Ana B.; Muñoz, M. Carmen; Real, José A.","Polymorphism and “reverse” spin transition in the spin crossover system [Co(4-terpyridone)2](CF3SO3)2·1H2O","New Journal of Chemistry","2009","33","6","1262","","10.1039/b905674b","","","0.71073","MoKα","","0.1292","0.0903","","","0.2661","0.3108","","","","","","1.263","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053814","10.607","0.002","11.247","0.002","11.967","0.002","96.17","0.03","110.43","0.03","111.08","0.03","1203.2","0.6","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","9-(4-methoxyphenyl)-9H-xanthen-9-ol acridine clathrate","","- C33 H25 N O3 -","- C33 H25 N O3 -","- C66 H50 N2 O6 -","2","1","","Jacobs, Ayesha; Nassimbeni, Luigi R.; Nohako, Kanyisa L.; Ramon, Gaelle; Taljaard, Jana H.","Enclathration by a xanthenol host via solid‒solid reactions: structures and kinetics","New Journal of Chemistry","2009","33","9","1960","","10.1039/b906720e","","","0.71073","MoKα","","0.066","0.042","","","0.0964","0.1108","","","","","","1.049","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053815","8.3982","0.0017","8.9905","0.0018","12.954","0.003","96.36","0.03","91.64","0.03","109.14","0.03","916.1","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","9-(4-methoxyphenyl)-9H-xanthen-9-ol 8-hydroxyquinoline clathrate","","- C24 H18.5 N O3.5 -","- C24 H18.5 N O3.5 -","- C48 H37 N2 O7 -","2","1","","Jacobs, Ayesha; Nassimbeni, Luigi R.; Nohako, Kanyisa L.; Ramon, Gaelle; Taljaard, Jana H.","Enclathration by a xanthenol host via solid‒solid reactions: structures and kinetics","New Journal of Chemistry","2009","33","9","1960","","10.1039/b906720e","","","0.71073","MoKα","","0.0796","0.0551","","","0.1349","0.1544","","","","","","1.038","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053816","8.4231","0.0017","9.0634","0.0018","13.014","0.003","96.6","0.03","91.87","0.03","109.87","0.03","925.4","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","9-(4-methoxyphenyl)-9H-xanthen-9-ol 1-naphthylamine clathrate","","- C25 H20 N0.5 O3 -","- C25 H20 N0.5 O3 -","- C50 H40 N O6 -","2","1","","Jacobs, Ayesha; Nassimbeni, Luigi R.; Nohako, Kanyisa L.; Ramon, Gaelle; Taljaard, Jana H.","Enclathration by a xanthenol host via solid‒solid reactions: structures and kinetics","New Journal of Chemistry","2009","33","9","1960","","10.1039/b906720e","","","0.71073","MoKα","","0.1471","0.1109","","","0.3526","0.3939","","","","","","1.583","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053817","9.0572","0.0018","9.6751","0.0019","10.501","0.002","88.56","0.03","83.74","0.03","85.45","0.03","911.7","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","9-(4-methoxyphenyl)-9H-xanthen-9-ol triethylenediamine clathrate","","- C23 H22 N O3 -","- C23 H22 N O3 -","- C46 H44 N2 O6 -","2","1","","Jacobs, Ayesha; Nassimbeni, Luigi R.; Nohako, Kanyisa L.; Ramon, Gaelle; Taljaard, Jana H.","Enclathration by a xanthenol host via solid‒solid reactions: structures and kinetics","New Journal of Chemistry","2009","33","9","1960","","10.1039/b906720e","","","0.71073","MoKα","","0.0538","0.0379","","","0.0914","0.1003","","","","","","1.05","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053818","4.5748","0.0003","13.0074","0.0009","17.0717","0.0012","90","","90","","90","","1015.87","0.12","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H12 N2 O2 -","- C11 H12 N2 O2 -","- C44 H48 N8 O8 -","4","1","","Johnston, Karen A.; McNab, Hamish","Synthesis and properties of 5,6-dihydrodipyrrolo[1,2-d;2′,1′-g][1,4]diazepin-11-one","New Journal of Chemistry","2009","33","8","1703","","10.1039/b906802n","","","0.71073","MoKα","","0.0842","0.0703","","0.1841","0.1737","0.1841","","","","","","1.026","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053819","7.6509","0.0002","9.1569","0.0003","12.0975","0.0004","102.228","0.002","93.332","0.002","99.815","0.002","812.26","0.04","150","2","150","2","","","","","","","Karen Johnston","4","P -1","-P 1","2","","","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C40 H32 N8 O4 -","4","2","","Johnston, Karen A.; McNab, Hamish","Synthesis and properties of 5,6-dihydrodipyrrolo[1,2-d;2′,1′-g][1,4]diazepin-11-one","New Journal of Chemistry","2009","33","8","1703","","10.1039/b906802n","","","0.71073","MoKα","","0.0962","0.0597","","","0.1247","0.1396","","","","","","1.026","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053820","8.0365","0.0002","8.9123","0.0002","11.2816","0.0003","98.842","0.001","107.731","0.001","111.521","0.001","683.11","0.03","150","2","150","2","","","","","","","K. Johnston KAJ EYF","5","P -1","-P 1","2","","","","- C13 H14 N2 O2 S2 -","- C13 H14 N2 O2 S2 -","- C26 H28 N4 O4 S4 -","2","1","","Johnston, Karen A.; McNab, Hamish","Synthesis and properties of 5,6-dihydrodipyrrolo[1,2-d;2′,1′-g][1,4]diazepin-11-one","New Journal of Chemistry","2009","33","8","1703","","10.1039/b906802n","","","0.71073","MoKα","","0.0507","0.0481","","","0.116","0.118","","","","","","1.145","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7053821","17.5345","0.0015","15.2814","0.0014","20.3953","0.0018","90","","96.35","0.005","90","","5431.4","0.8","100","2","100","2","","","","","","","synthesis as described","4","P 1 2/n 1","-P 2yac","13","","","","- C57 H68 Cl2 N8 -","- C57 H68 Cl2 N8 -","- C228 H272 Cl8 N32 -","4","1","","Akdas-Kilig, Huriye; Roisnel, Thierry; Ledoux, Isabelle; Le Bozec, Hubert","A new class of bipyrimidine-based octupolar chromophores: synthesis, fluorescent and quadratic nonlinear optical properties","New Journal of Chemistry","2009","33","7","1470","","10.1039/b907323j","","x-ray","0.71073","MoKα","","0.1005","0.0731","","","0.2208","0.2425","","","","","","1.152","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053822","8.6251","0.0005","10.6442","0.0008","24.3193","0.0016","90","","90","","90","","2232.7","0.3","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","dibenzoylmethane","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","neutron","","neutron","","0.0777","0.0776","","","0.146","0.1461","","","","","","1.222","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053823","8.6251","0.0005","10.6442","0.0008","24.3193","0.0016","90","","90","","90","","2232.7","0.3","123","2","123","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","dibenzoylmethane","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","neutron","","neutron","","0.0721","0.0721","","","0.1417","0.1417","","","","","","1.222","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053824","8.6594","0.0007","10.7139","0.0011","24.359","0.002","90","","90","","90","","2259.9","0.3","160","2","160","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","dibenzoylmethane","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","neutron","","neutron","","0.0708","0.0708","","","0.1368","0.1368","","","","","","1.192","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053825","8.6886","0.0005","10.7434","0.0007","24.4019","0.0016","90","","90","","90","","2277.8","0.2","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","dibenzoylmethane","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","neutron","","neutron","","0.0714","0.0714","","","0.1463","0.1463","","","","","","1.347","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053826","8.723","0.003","10.7969","0.0012","24.4233","0.0016","90","","90","","90","","2300.2","0.8","240","2","240","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","dibenzoylmethane","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","neutron","","neutron","","0.0761","0.0761","","","0.1539","0.1539","","","","","","1.502","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053827","8.7652","0.0008","10.8627","0.0009","24.513","0.002","90","","90","","90","","2334","0.3","280","2","280","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","dibenzoylmethane","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","neutron","","neutron","","0.067","0.067","","","0.1284","0.1284","","","","","","1.318","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053828","8.6251","0.0005","10.6442","0.0008","24.3193","0.0016","90","","90","","90","","2232.7","0.3","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","","1.54186","CuKα","","0.0468","0.0382","","","0.0924","0.1018","","","","","","1.337","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053829","8.6594","0.0007","10.7139","0.0011","24.359","0.002","90","","90","","90","","2259.9","0.3","160","2","160","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","","1.54186","CuKα","","0.0868","0.0376","","","0.0677","0.1074","","","","","","1.166","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053830","8.6886","0.0005","10.7434","0.0007","24.4019","0.0016","90","","90","","90","","2277.8","0.2","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","","1.54186","CuKα","","0.044","0.0349","","","0.0855","0.0932","","","","","","1.082","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053831","8.7228","0.001","10.7969","0.0012","24.423","0.003","90","","90","","90","","2300.1","0.5","240","2","240","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","","1.54186","CuKα","","0.0619","0.0382","","","0.0746","0.0938","","","","","","1.13","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053832","8.7652","0.0008","10.8627","0.0009","24.513","0.002","90","","90","","90","","2334","0.3","280","2","280","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","","1.54186","CuKα","","0.0553","0.0396","","","0.0915","0.1108","","","","","","1.117","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053833","8.7669","0.0006","10.8752","0.0008","24.5043","0.0018","90","","90","","90","","2336.3","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","dibenzoylmethane","","- C15 H12 O2 -","- C15 H12 O2 -","- C120 H96 O16 -","8","1","","Thomas, Lynne H.; Florence, Alastair J.; Wilson, Chick C.","Hydrogen atom behaviour imaged in a short intramolecular hydrogen bond using the combined approach of X-ray and neutron diffraction","New Journal of Chemistry","2009","33","12","2486","","10.1039/b908915b","","","1.54186","CuKα","","0.0586","0.0371","","","0.087","0.1096","","","","","","1.096","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053834","31.721","0.019","8.715","0.005","9.919","0.006","90","","106.486","0.007","90","","2629","3","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","N-diisopropoxyphosphinyl-N'-(benzo-15-crown-5)-4'-yl-thiourea","N-diisopropoxyphosphinyl-N'-(benzo-15-crown-5)-4'-yl-thiourea","","- C21 H35 N2 O8 P S -","- C21 H35 N2 O8 P S -","- C84 H140 N8 O32 P4 S4 -","4","1","","Safin, Damir A.; Babashkina, Maria G.; Klein, Axel; Sokolov, Felix D.; Baranov, Sergey V.; Pape, Tania; Hahn, F. Ekkehardt; Krivolapov, Dmitriy B.","The influence of an intramolecular hydrogen bond on the 1,3-N,S-coordination of crown ether-containing N-phosphorylthiourea with NiII","New Journal of Chemistry","2009","33","12","2443","","10.1039/b9nj00252a","","x-ray","0.71073","MoKα","","0.0881","0.0667","","","0.1737","0.1885","","","","","","1.228","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053835","10.4922","0.0015","15.482","0.003","32.203","0.006","90","","93.214","0.013","90","","5222.8","1.6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Bis(N-diisopropoxy-N'-(benzo-15-crown-5-4'-yl)-thiocarbamido- N,S)nickel","Bis[N-diisopropoxy-N'-(benzo-15-crown-5-4'-yl)-thiocarbamido-N,S]nickel","","- C42 H68 N4 Ni O16 P2 S2 -","- C42 H68 N4 Ni O16 P2 S2 -","- C168 H272 N16 Ni4 O64 P8 S8 -","4","0.5","","Safin, Damir A.; Babashkina, Maria G.; Klein, Axel; Sokolov, Felix D.; Baranov, Sergey V.; Pape, Tania; Hahn, F. Ekkehardt; Krivolapov, Dmitriy B.","The influence of an intramolecular hydrogen bond on the 1,3-N,S-coordination of crown ether-containing N-phosphorylthiourea with NiII","New Journal of Chemistry","2009","33","12","2443","","10.1039/b9nj00252a","","x-ray","0.71073","MoKα","","0.1238","0.0502","","","0.1188","0.1403","","","","","","1.025","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053836","33.048","0.007","27.265","0.005","9.0412","0.0017","90","","90","","90","","8147","3","153","1","153","1","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C36 H48 N6 Ni O6 P2 S2 -","- C36 H48 N6 Ni O6 P2 S2 -","- C288 H384 N48 Ni8 O48 P16 S16 -","8","0.5","","Safin, Damir A.; Babashkina, Maria G.; Klein, Axel; Sokolov, Felix D.; Baranov, Sergey V.; Pape, Tania; Hahn, F. Ekkehardt; Krivolapov, Dmitriy B.","The influence of an intramolecular hydrogen bond on the 1,3-N,S-coordination of crown ether-containing N-phosphorylthiourea with NiII","New Journal of Chemistry","2009","33","12","2443","","10.1039/b9nj00252a","","","0.71073","MoKα","","0.0416","0.0338","","","0.0641","0.0653","","","","","","0.847","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053837","11.652","0.003","13.436","0.004","17.311","0.004","89.705","0.007","77.957","0.007","89.449","0.007","2650.4","1.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H50 Cl Mn4 N12 Na O21 -","- C35 H50 Cl Mn4 N12 Na O21 -","- C70 H100 Cl2 Mn8 N24 Na2 O42 -","2","1","","Cong, Linlin; Qin, Xiaoting; Sun, Wei; Wang, Yanqin; Ding, Shuai; Liu, Zhiliang","A series of [NaMnIII3MnII] clusters constructed using a multidentate Schiff-base ligand and decorated with different auxiliary ligands","New Journal of Chemistry","2014","38","2","545","","10.1039/c3nj00742a","","","0.71075","MoKα","","0.1206","0.1094","","","0.3435","0.3578","","","","","","1.35","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053838","12.01","0.002","13.787","0.003","16.094","0.003","94.06","0.03","106.74","0.03","109.78","0.03","2359.1","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H47 Cl Mn4 N12 Na O19 -","- C35 H47 Cl Mn4 N12 Na O19 -","- C70 H94 Cl2 Mn8 N24 Na2 O38 -","2","1","","Cong, Linlin; Qin, Xiaoting; Sun, Wei; Wang, Yanqin; Ding, Shuai; Liu, Zhiliang","A series of [NaMnIII3MnII] clusters constructed using a multidentate Schiff-base ligand and decorated with different auxiliary ligands","New Journal of Chemistry","2014","38","2","545","","10.1039/c3nj00742a","","","0.71073","MoKα","","0.0934","0.0744","","","0.185","0.1959","","","","","","1.089","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053839","11.996","0.003","13.521","0.003","16.09","0.003","92.969","0.002","90.744","0.004","112.64","0.004","2403.9","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H50 Cl Mn4 N3 Na O27 -","- C36 H50 Cl Mn4 N3 Na O27 -","- C72 H100 Cl2 Mn8 N6 Na2 O54 -","2","1","","Cong, Linlin; Qin, Xiaoting; Sun, Wei; Wang, Yanqin; Ding, Shuai; Liu, Zhiliang","A series of [NaMnIII3MnII] clusters constructed using a multidentate Schiff-base ligand and decorated with different auxiliary ligands","New Journal of Chemistry","2014","38","2","545","","10.1039/c3nj00742a","","","0.71073","MoKα","","0.0526","0.042","","","0.1071","0.1117","","","","","","1.057","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053840","14.061","0.003","14.937","0.003","18.31","0.004","84.71","0.03","74.37","0.03","63.73","0.03","3319.3","1.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C55 H65 Cl1.5 Mn4 N3 Na O29 -","- C55 H65 Cl1.5 Mn4 N3 Na O29 -","- C110 H130 Cl3 Mn8 N6 Na2 O58 -","2","1","","Cong, Linlin; Qin, Xiaoting; Sun, Wei; Wang, Yanqin; Ding, Shuai; Liu, Zhiliang","A series of [NaMnIII3MnII] clusters constructed using a multidentate Schiff-base ligand and decorated with different auxiliary ligands","New Journal of Chemistry","2014","38","2","545","","10.1039/c3nj00742a","","","0.71073","MoKα","","0.1751","0.0995","","","0.2601","0.3379","","","","","","0.994","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053841","9.506","0.0019","15.001","0.003","15.777","0.003","90","","94.68","0.03","90","","2242.3","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H30 B F4 N O7 -","- C18 H30 B F4 N O7 -","- C72 H120 B4 F16 N4 O28 -","4","1","","Luo, Yang-Hui; Ge, Shu-Wang; Song, Wen-Tao; Sun, Bai-Wang","Supramolecular assembly and host‒guest interaction of crown ether with inorganic acid and organic amine containing carboxyl groups","New Journal of Chemistry","2014","38","2","723","","10.1039/c3nj01005h","","","0.71073","MoKα","","0.2047","0.1093","","","0.2954","0.3653","","","","","","1.015","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053842","9.597","0.0019","15.241","0.003","15.677","0.003","90","","93.9","0.03","90","","2287.7","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H30 Cl N O11 -","- C18 H30 Cl N O11 -","- C72 H120 Cl4 N4 O44 -","4","1","","Luo, Yang-Hui; Ge, Shu-Wang; Song, Wen-Tao; Sun, Bai-Wang","Supramolecular assembly and host‒guest interaction of crown ether with inorganic acid and organic amine containing carboxyl groups","New Journal of Chemistry","2014","38","2","723","","10.1039/c3nj01005h","","","0.71073","MoKα","","0.1668","0.0945","","","0.2513","0.3006","","","","","","1.074","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053843","23.27","0.005","12.926","0.003","19.947","0.004","90","","117.76","0.03","90","","5309","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H34 B F4 N O8 -","- C20 H34 B F4 N O8 -","- C160 H272 B8 F32 N8 O64 -","8","1","","Luo, Yang-Hui; Ge, Shu-Wang; Song, Wen-Tao; Sun, Bai-Wang","Supramolecular assembly and host‒guest interaction of crown ether with inorganic acid and organic amine containing carboxyl groups","New Journal of Chemistry","2014","38","2","723","","10.1039/c3nj01005h","","","0.71073","MoKα","","0.1684","0.0805","","","0.1885","0.2333","","","","","","1.051","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053844","9.3105","0.0019","10.982","0.002","11.809","0.002","82.8","0.03","89.03","0.03","85.61","0.03","1194.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H32 B F4 N O8 -","- C19 H32 B F4 N O8 -","- C38 H64 B2 F8 N2 O16 -","2","1","","Luo, Yang-Hui; Ge, Shu-Wang; Song, Wen-Tao; Sun, Bai-Wang","Supramolecular assembly and host‒guest interaction of crown ether with inorganic acid and organic amine containing carboxyl groups","New Journal of Chemistry","2014","38","2","723","","10.1039/c3nj01005h","","","0.71073","MoKα","","0.2934","0.1125","","","0.2889","0.3904","","","","","","0.942","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053845","7.1105","0.0014","9.868","0.002","12.576","0.003","73.23","0.03","78.56","0.03","70.79","0.03","792.6","0.3","263","2","263","2","","","","","","","","4","P -1","-P 1","2","<i>N</i>,<i>N</i>-Bis(4-fluorophenyl)-<i>N</i>,<i>N</i>'-di(n-butyl) quinaridonediimine","<i>N</i>,<i>N</i>-Bis(4-fluorophenyl)-<i>N</i>,<i>N</i>'-di(n-butyl) quinaridonediimine","","- C40 H36 F2 N4 -","- C40 H36 F2 N4 -","- C40 H36 F2 N4 -","1","0.5","","Javed, Iqbal; Khurshid, Ayub; Arshad, Muhammad Nadeem; Wang, Yue","Photophysical and electrochemical properties and temperature dependent geometrical isomerism in alkyl quinacridonediimines","New Journal of Chemistry","2014","38","2","752","","10.1039/c3nj00477e","","","0.71073","MoKα","","0.0604","0.0461","","","0.1229","0.1305","","","","","","1.084","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053846","8.602","0.005","13.889","0.008","15.854","0.01","70.4","0.02","79.41","0.02","88.92","0.018","1752.1","1.8","263","2","263","2","","","","","","","","5","P -1","-P 1","2","<i>N</i>,<i>N</i>-Diphenyl-<i>N</i>,<i>N</i>'-di(n-butyl)-2,9-difluoro quinacridonediimine","<i>N</i>,<i>N</i>-Diphenyl-<i>N</i>,<i>N</i>'-di(n-butyl)-2,9-difluoro quinacridonediimine","","- C41 H38 Cl2 F2 N4 -","- C41 H38 Cl2 F2 N4 -","- C82 H76 Cl4 F4 N8 -","2","1","","Javed, Iqbal; Khurshid, Ayub; Arshad, Muhammad Nadeem; Wang, Yue","Photophysical and electrochemical properties and temperature dependent geometrical isomerism in alkyl quinacridonediimines","New Journal of Chemistry","2014","38","2","752","","10.1039/c3nj00477e","","","0.71073","MoKα","","0.095","0.0631","","","0.1935","0.2208","","","","","","0.963","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053847","8.778","0.005","9.171","0.006","13.365","0.008","71.67","0.03","72.14","0.02","62.81","0.03","891.4","1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","<i>N</i>,<i>N</i>-Bis(4-fluorophenyl)-<i>N</i>,<i>N</i>'-di(n-butyl)-1,3,8,10- tetramethylquinacridonediimine","<i>N</i>,<i>N</i>-Bis(4-fluorophenyl)-<i>N</i>,<i>N</i>'-di(n-butyl)-1,3,8,10- tetramethylquinacridonediimine","","- C44 H44 F2 N4 -","- C44 H44 F2 N4 -","- C44 H44 F2 N4 -","1","0.5","","Javed, Iqbal; Khurshid, Ayub; Arshad, Muhammad Nadeem; Wang, Yue","Photophysical and electrochemical properties and temperature dependent geometrical isomerism in alkyl quinacridonediimines","New Journal of Chemistry","2014","38","2","752","","10.1039/c3nj00477e","","","0.71073","MoKα","","0.0793","0.0549","","","0.1479","0.1605","","","","","","1.06","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053848","7.3925","0.0015","9.2554","0.0019","12.899","0.003","88.42","0.03","75.51","0.03","87.38","0.03","853.5","0.3","263","2","263","2","","","","","","","","4","P -1","-P 1","2","<i>N</i>,<i>N</i>-Bis(2,3,4,5,6-pentafluorophenyl)-<i>N</i>,<i>N</i>'- di(n-butyl)quinaridonediimine","<i>N</i>,<i>N</i>-Bis(2,3,4,5,6-pentafluorophenyl)-<i>N</i>,<i>N</i>'- di(n-butyl)quinaridonediimine","","- C40 H28 F10 N4 -","- C40 H28 F10 N4 -","- C40 H28 F10 N4 -","1","0.5","","Javed, Iqbal; Khurshid, Ayub; Arshad, Muhammad Nadeem; Wang, Yue","Photophysical and electrochemical properties and temperature dependent geometrical isomerism in alkyl quinacridonediimines","New Journal of Chemistry","2014","38","2","752","","10.1039/c3nj00477e","","","0.71073","MoKα","","0.0847","0.0598","","","0.1677","0.1831","","","","","","1.05","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053849","16.453","0.003","7.222","0.0014","31.554","0.01","90","","110.38","0.03","90","","3514.7","1.6","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","<i>N</i>,<i>N</i>-Bis(3,5-dimethylphenyl)-<i>N</i>,<i>N</i>'-di(n-butyl)-2,9- difluoroquinacridonediimine","<i>N</i>,<i>N</i>-Bis(3,5-dimethylphenyl)-<i>N</i>,<i>N</i>'-di(n-butyl)-2,9- difluoroquinacridonediimine","","- C44 H44 F2 N4 -","- C44 H44 F2 N4 -","- C176 H176 F8 N16 -","4","0.5","","Javed, Iqbal; Khurshid, Ayub; Arshad, Muhammad Nadeem; Wang, Yue","Photophysical and electrochemical properties and temperature dependent geometrical isomerism in alkyl quinacridonediimines","New Journal of Chemistry","2014","38","2","752","","10.1039/c3nj00477e","","","0.71073","MoKα","","0.1218","0.0642","","","0.1385","0.162","","","","","","1.028","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053850","8.8472","0.0018","9.2195","0.0018","14.044","0.003","84.46","0.03","76.26","0.03","64.35","0.03","1003.1","0.5","263","2","263","2","","","","","","","","3","P -1","-P 1","2","<i>N</i>,<i>N</i>-Bis(4-cyanophenyl)-<i>N</i>,<i>N</i>'-di(n-octyl) quinacridonediimine","<i>N</i>,<i>N</i>-Bis(4-cyanophenyl)-<i>N</i>,<i>N</i>'-di(n-octyl) quinacridonediimine","","- C50 H52 N6 -","- C50 H52 N6 -","- C50 H52 N6 -","1","0.5","","Javed, Iqbal; Khurshid, Ayub; Arshad, Muhammad Nadeem; Wang, Yue","Photophysical and electrochemical properties and temperature dependent geometrical isomerism in alkyl quinacridonediimines","New Journal of Chemistry","2014","38","2","752","","10.1039/c3nj00477e","","","0.71073","MoKα","","0.1607","0.0663","","","0.1268","0.158","","","","","","0.988","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053851","10.765","0.007","4.612","0.003","17.297","0.011","90","","97.133","0.013","90","","852.1","1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H9 N3 O4 -","- C8 H9 N3 O4 -","- C32 H36 N12 O16 -","4","1","","Kopylovich, Maximilian N.; Mahmudov, Kamran T.; Haukka, Matti; Pombeiro, Armando J. L.","Metal-free regioselective C‒C bond cleavage in 1,3,5-triazine derivatives of β-diketones","New Journal of Chemistry","2014","38","2","495","","10.1039/c3nj01292a","","","0.71073","MoKα","","0.1068","0.0529","","","0.1148","0.137","","","","","","0.998","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053852","9.0878","0.0006","11.2798","0.0008","6.7696","0.0005","90","","92.969","0.003","90","","693.01","0.08","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H7 N3 O3 -","- C6 H7 N3 O3 -","- C24 H28 N12 O12 -","4","1","","Kopylovich, Maximilian N.; Mahmudov, Kamran T.; Haukka, Matti; Pombeiro, Armando J. L.","Metal-free regioselective C‒C bond cleavage in 1,3,5-triazine derivatives of β-diketones","New Journal of Chemistry","2014","38","2","495","","10.1039/c3nj01292a","","","0.71073","MoKα","","0.047","0.0362","","","0.0943","0.1009","","","","","","1.052","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053853","7.5322","0.0015","16.363","0.003","24.127","0.005","90","","90","","90","","2973.6","1","293.15","","293.15","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C H N O -","- C35 H41 N O4 -","- C140 H164 N4 O16 -","4","1","","Yao, Guiyang; Li, Yajun; Zhu, Yongtao; Pan, Yingming; Huang, Fuping; Wang, Hengshan; Liao, Zhixin","Protonation-controlled axial chirality in maleopimaric imides","New Journal of Chemistry","2014","38","2","693","","10.1039/c3nj01194a","","","0.7107","Molybdenum","","0.2486","0.1379","","","0.2417","0.2804","","","","","","1.152","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053854","8.54394","0.00018","14.0556","0.0004","24.3015","0.0007","90","","90","","90","","2918.37","0.13","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C34 H40 N2 O4 -","- C34 H40 N2 O4 -","- C136 H160 N8 O16 -","4","1","","Yao, Guiyang; Li, Yajun; Zhu, Yongtao; Pan, Yingming; Huang, Fuping; Wang, Hengshan; Liao, Zhixin","Protonation-controlled axial chirality in maleopimaric imides","New Journal of Chemistry","2014","38","2","693","","10.1039/c3nj01194a","","","0.71073","MoKα","","0.0476","0.0431","","","0.1085","0.1118","","","","","","1.037","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053855","14.976","0.002","14.976","0.002","39.297","0.008","90","","90","","90","","8814","2","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C47 H53 N O10 -","- C47 H53 N O10 -","- C376 H424 N8 O80 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.1983","0.084","","","0.1502","0.1862","","","","","","1.044","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053856","14.928","0.004","14.928","0.004","39.286","0.01","90","","90","","90","","8755","4","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C46 H52 Cl2 O10 -","- C46 H52 Cl2 O10 -","- C368 H416 Cl16 O80 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.0784","0.0519","","","0.1271","0.1398","","","","","","1.065","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053857","15.03","0.002","15.03","0.002","40.076","0.008","90","","90","","90","","9053","2","291","2","291","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C49 H58 O12 -","- C49 H58 O12 -","- C392 H464 O96 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.1173","0.0666","","","0.1788","0.2071","","","","","","1.064","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053858","14.938","0.0005","14.938","0.0005","39.779","0.003","90","","90","","90","","8876.4","0.8","296","2","296","2","","","","","","","","3","I 41/a :2","-I 4ad","88","","","","- C48 H56 O11 -","- C48 H56 O11 -","- C384 H448 O88 -","8","0.5","","Tan, Li-Li; Zhang, Yumo; Li, Bao; Wang, Kai; Zhang, Sean Xiao-An; Tao, Yanchun; Yang, Ying-Wei","Selective recognition of “solvent” molecules in solution and the solid state by 1,4-dimethoxypillar[5]arene driven by attractive forces","New Journal of Chemistry","2014","38","2","845","","10.1039/c3nj01498c","","","0.71073","MoKα","","0.1518","0.0622","","","0.1717","0.2206","","","","","","1.048","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053859","8.9793","0.0002","9.1591","0.0002","11.2703","0.0003","69.9746","0.0009","77.7173","0.001","68.1433","0.001","804.39","0.03","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H19 Cl2 N3 O Pd -","- C12 H19 Cl2 N3 O Pd -","- C24 H38 Cl4 N6 O2 Pd2 -","2","1","","Mariconda, Annaluisa; Grisi, Fabia; Costabile, Chiara; Falcone, Salvatore; Bertolasi, Valerio; Longo, Pasquale","Synthesis, characterization and catalytic behaviour of a palladium complex bearing a hydroxy-functionalized N-heterocyclic carbene ligand","New Journal of Chemistry","2014","38","2","762","","10.1039/c3nj01281f","","","0.71073","MoKα","","0.0524","0.0354","","","0.0799","0.0853","","","","","","1.04","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053860","13.152","0.0002","13.192","0.0002","33.6132","0.0005","90.3211","0.0004","96.9646","0.0004","100.965","0.0006","5680.76","0.15","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C42 H67 Ag4 I4 N9 O4 -","- C42 H63 Ag4 I4 N9 O4 -","- C168 H252 Ag16 I16 N36 O16 -","4","2","","Mariconda, Annaluisa; Grisi, Fabia; Costabile, Chiara; Falcone, Salvatore; Bertolasi, Valerio; Longo, Pasquale","Synthesis, characterization and catalytic behaviour of a palladium complex bearing a hydroxy-functionalized N-heterocyclic carbene ligand","New Journal of Chemistry","2014","38","2","762","","10.1039/c3nj01281f","","","0.71073","MoKα","","0.1008","0.0604","","","0.1459","0.1713","","","","","","1.026","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053861","25.592","0.018","7.825","0.003","26.83","0.002","90","","92.66","0.02","90","","5367","4","295","2","295","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C27 H20 Ag F3 N6 O3 S -","- C27 H20 Ag F3 N6 O3 S -","- C216 H160 Ag8 F24 N48 O24 S8 -","8","1","","Marcinkowski, Damian; Wałęsa-Chorab, Monika; Patroniak, Violetta; Kubicki, Maciej; Kądziołka, Grzegorz; Michalkiewicz, Beata","A new polymeric complex of silver(i) with a hybrid pyrazine‒bipyridine ligand ‒ synthesis, crystal structure and its photocatalytic activity","New Journal of Chemistry","2014","38","2","604","","10.1039/c3nj01187a","","","0.7107","MoKα","","0.1957","0.0804","","","0.1444","0.1831","","","","","","0.917","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053862","10.9061","0.0002","8.5014","0.0003","16.9111","0.0005","90","","95.522","0.0012","90","","1560.67","0.08","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(mu2-(2-hydroxyethylamino ethanolato)-bis(o-methoxybenzoate)-di copper(II)","","- C28 H42 Cu2 N2 O12 -","- C28 H42 Cu2 N2 O12 -","- C56 H84 Cu4 N4 O24 -","2","0.5","","Sharma, Raj Pal; Saini, Anju; Venugopalan, Paloth; Ferretti, Valeria; Spizzo, Federico; Angeli, Celestino; Calzado, Carmen J.","Magnetic behaviour vs. structural changes in an isomeric series of binuclear copper(ii) complexes: an experimental and theoretical study","New Journal of Chemistry","2014","38","2","574","","10.1039/c3nj01080e","","","0.71073","MoKα","","0.0896","0.0567","","","0.1395","0.1662","","","","","","1.083","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053863","7.5706","0.0002","8.336","0.0002","15.0758","0.0004","96.122","0.001","99.627","0.001","114.943","0.001","833.65","0.04","295","","295","","","","","","","","","5","P -1","-P 1","2","","bis(mu2-(2-hydroxyethylamino ethanolato)-bis(m-methoxybenzoate)-di copper(II)dihydrate","","- C28 H46 Cu2 N2 O14 -","- C28 H46 Cu2 N2 O14 -","- C28 H46 Cu2 N2 O14 -","1","0.5","","Sharma, Raj Pal; Saini, Anju; Venugopalan, Paloth; Ferretti, Valeria; Spizzo, Federico; Angeli, Celestino; Calzado, Carmen J.","Magnetic behaviour vs. structural changes in an isomeric series of binuclear copper(ii) complexes: an experimental and theoretical study","New Journal of Chemistry","2014","38","2","574","","10.1039/c3nj01080e","","","0.71073","MoKα","","0.0467","0.0361","","","0.0887","0.0954","","","","","","0.953","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053864","7.6094","0.0001","8.0937","0.0002","14.6853","0.0004","102.858","0.0008","92.338","0.0008","110.54","0.0013","818.68","0.03","295","","295","","","","","","","","","5","P -1","-P 1","2","","bis(mu2-(2-hydroxyethylamino ethanolato)-bis(p-methoxybenzoate)-di copper(II)dihydrate","","- C28 H46 Cu2 N2 O14 -","- C28 H46 Cu2 N2 O14 -","- C28 H46 Cu2 N2 O14 -","1","0.5","","Sharma, Raj Pal; Saini, Anju; Venugopalan, Paloth; Ferretti, Valeria; Spizzo, Federico; Angeli, Celestino; Calzado, Carmen J.","Magnetic behaviour vs. structural changes in an isomeric series of binuclear copper(ii) complexes: an experimental and theoretical study","New Journal of Chemistry","2014","38","2","574","","10.1039/c3nj01080e","","","0.71073","MoKα","","0.0392","0.0339","","","0.087","0.0907","","","","","","1.075","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053865","9.0019","0.0004","8.0278","0.0003","16.0297","0.0007","90","","99.17","0.002","90","","1143.59","0.08","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cl2 Cu N4 O12 -","- C18 H20 Cl2 Cu N4 O12 -","- C36 H40 Cl4 Cu2 N8 O24 -","2","0.5","","Sarkar, Amrita; Bhattacharyya, Sudipta; Dey, Suman Kr; Karmakar, Subhendu; Mukherjee, Arindam","Structure and properties of metal complexes of a pyridine based oxazolidinone synthesized by atmospheric CO2 fixation","New Journal of Chemistry","2014","38","2","817","","10.1039/c3nj00990d","","","0.71073","MoKα","","0.061","0.042","","","0.1092","0.1208","","","","","","1.033","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053866","8.1277","0.0017","13.281","0.003","14.755","0.003","97.093","0.004","94.263","0.004","96.436","0.004","1564.3","0.6","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C11 H17 Cl2 N2 O3.5 Pt S -","- C11 H16 Cl2 N2 O3.5 Pt S -","- C44 H64 Cl8 N8 O14 Pt4 S4 -","4","2","","Sarkar, Amrita; Bhattacharyya, Sudipta; Dey, Suman Kr; Karmakar, Subhendu; Mukherjee, Arindam","Structure and properties of metal complexes of a pyridine based oxazolidinone synthesized by atmospheric CO2 fixation","New Journal of Chemistry","2014","38","2","817","","10.1039/c3nj00990d","","","0.71073","MoKα","","0.0211","0.0192","","","0.0495","0.0507","","","","","","1.047","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053867","10.13","","6.355","","13.522","","90","","105.71","","90","","837.977","","293","2","293","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","Compound X","","","- C18 H20 N2 O -","- C19 H22 N2 O -","- C38 H44 N4 O2 -","2","1","","Jiménez-Sánchez, Arturo; Rodríguez, Mario; Métivier, Rémi; Ramos-Ortíz, Gabriel; Maldonado, Jose Luis; Réboles, Netzahualcoyotl; Farfán, Norberto; Nakatani, Keitaro; Santillan, Rosa","Synthesis and crystal structures of a series of Schiff bases: a photo-, solvato- and acidochromic compound","New Journal of Chemistry","2014","38","2","730","","10.1039/c3nj00895a","","x-ray","0.71073","MoKα","","0.0458","0.0365","","","0.085","0.0893","","","","","","1.026","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053868","6.1828","0.0002","14.6917","0.0008","16.9541","0.0005","90","","90","","90","","1540.04","0.11","298","2","298","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","san557 mario","","","- C18 H20 N2 O -","- C18 H20 N2 O -","- C72 H80 N8 O4 -","4","1","","Jiménez-Sánchez, Arturo; Rodríguez, Mario; Métivier, Rémi; Ramos-Ortíz, Gabriel; Maldonado, Jose Luis; Réboles, Netzahualcoyotl; Farfán, Norberto; Nakatani, Keitaro; Santillan, Rosa","Synthesis and crystal structures of a series of Schiff bases: a photo-, solvato- and acidochromic compound","New Journal of Chemistry","2014","38","2","730","","10.1039/c3nj00895a","","x-ray","0.71073","MoKα","","0.0944","0.0536","","","0.1051","0.1213","","","","","","1.039","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053869","7.8065","0.0004","16.426","0.0014","12.1222","0.00119","90","","90","","90","","1554.4","0.2","293","2","293","2","","","","","","","synthesis as described","4","P 21 c a","P -2ac 2a","29","Compound X","","","- C18 H20 N2 O -","- C18 H20 N2 O -","- C72 H80 N8 O4 -","4","1","","Jiménez-Sánchez, Arturo; Rodríguez, Mario; Métivier, Rémi; Ramos-Ortíz, Gabriel; Maldonado, Jose Luis; Réboles, Netzahualcoyotl; Farfán, Norberto; Nakatani, Keitaro; Santillan, Rosa","Synthesis and crystal structures of a series of Schiff bases: a photo-, solvato- and acidochromic compound","New Journal of Chemistry","2014","38","2","730","","10.1039/c3nj00895a","","x-ray","0.71073","MoKα","","0.0459","0.0369","","","0.0968","0.1046","","","","","","0.968","","","","has coordinates","201910","2020-10-21","18:00:00",""
"7053870","11.35","0.003","12.153","0.003","14.391","0.004","65.37","0.03","66.76","0.03","80.51","0.03","1658","0.9","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- H72 Mn5 O76 W12 -","- H12 Mn5 O76 W12 -","- H12 Mn5 O76 W12 -","1","0.5","","Najafpour, Mohammad Mahdi; Abbasi Isaloo, Mohsen; Abasi, Mahnaz; Hołyńska, Małgorzata","Manganese oxide as a water-oxidizing catalyst: from the bulk to Ångström-scale","New Journal of Chemistry","2014","38","2","852","","10.1039/c3nj01393f","","","0.71073","MoKα","","0.0405","0.0317","","","0.0759","0.0789","","","","","","1.021","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053871","39.366","0.004","10.3992","0.0011","24.505","0.003","90","","104.747","0.002","90","","9701.3","1.9","150","","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C53 H52 Cl4 N2 P2 Ru -","- C53 H52 Cl4 N2 P2 Ru -","- C424 H416 Cl32 N16 P16 Ru8 -","8","1","","Larocque, Timothy G.; Lavoie, Gino G.","Reactivity study of low-coordinate phosphaalkene IMesPPh with Grubbs first-generation ruthenium benzylidene complexes","New Journal of Chemistry","2014","38","2","499","","10.1039/c3nj01416a","","","0.71073","MoKα","","0.0579","0.0367","","","0.0736","0.0834","","","","","","1.018","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053872","11.796","0.003","18.979","0.005","20.473","0.005","90","","99.625","0.007","90","","4519","2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H49 Cl N2 P2 Ru -","- C52 H49 Cl N2 P2 Ru -","- C208 H196 Cl4 N8 P8 Ru4 -","4","1","","Larocque, Timothy G.; Lavoie, Gino G.","Reactivity study of low-coordinate phosphaalkene IMesPPh with Grubbs first-generation ruthenium benzylidene complexes","New Journal of Chemistry","2014","38","2","499","","10.1039/c3nj01416a","","","0.71073","MoKα","","0.0506","0.0331","","","0.0675","0.0736","","","","","","1.011","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053873","31.183","0.007","9.097","0.002","21.277","0.005","90","","117.262","0.003","90","","5365","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H66 Cu4 N8 O11 -","- C58 H64 Cu4 N8 O11 -","- C232 H256 Cu16 N32 O44 -","4","0.5","","Borisova, Nataliya E.; Kostin, Andrey; Magdesieva, Tatiana V.; Reshetova, Marina D.; Nikitin, Oleg; Paredes-García, Verónica; Garland, M. Teresa; Hermosilla-Ibáñez, Patricio; Cañon-Mancisidor, Walter; Rodionov, Alexey; Venegas-Yazigi, Diego; Spodine, Evgenia","Solvent switchable CuII complexes","New Journal of Chemistry","2014","38","2","709","","10.1039/c3nj00722g","","","0.71073","MoKα","","0.0636","0.0456","","","0.0981","0.1059","","","","","","1.074","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053874","12.198","0.002","8.3508","0.0017","13.632","0.003","90","","110.5","0.03","90","","1300.7","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H13 O8 P2 Pr -","- C8 H13 O8 P2 Pr -","- C32 H52 O32 P8 Pr4 -","4","1","","Liu, Yi-Fu; Hou, Guang-Feng; Yu, Ying-Hui; Yan, Peng-Fei; Li, Guang-Ming; Gao, Jin-Sheng","pH-dependent syntheses, luminescence and magnetic properties of two-dimensional framework lanthanide 1,3-diarylphosphonate complexes","New Journal of Chemistry","2014","38","3","1328","","10.1039/c3nj01388j","","","0.71073","MoKα","","0.0321","0.0276","","","0.0576","0.0592","","","","","","1.072","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053875","3.8994","0.0004","15.6005","0.0015","21.254","0.002","90","","93.24","0.002","90","","1290.9","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 Ag F12 N6 P2 -","- C24 H18 Ag F12 N6 P2 -","- C48 H36 Ag2 F24 N12 P4 -","2","0.5","","Dinda, Joydev; Samanta, Tapastaru; Nandy, Abhishek; Saha, Krishna Das; Seth, Saikat Kumar; Chattopadhyay, Shymal Kumar; Bielawski, Christopher W.","N-heterocyclic carbene supported Au(i) and Au(iii) complexes: a comparison of cytotoxicities","New Journal of Chemistry","2014","38","3","1218","","10.1039/c3nj01463k","","","0.71073","MoKα","","0.0823","0.0741","","","0.213","0.2202","","","","","","1.073","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053876","7.8238","0.0018","9.795","0.002","10.093","0.002","112.116","0.005","95.677","0.005","97.329","0.006","701.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H9 Au Cl3 N3 -","- C12 H9 Au Cl3 N3 -","- C24 H18 Au2 Cl6 N6 -","2","1","","Dinda, Joydev; Samanta, Tapastaru; Nandy, Abhishek; Saha, Krishna Das; Seth, Saikat Kumar; Chattopadhyay, Shymal Kumar; Bielawski, Christopher W.","N-heterocyclic carbene supported Au(i) and Au(iii) complexes: a comparison of cytotoxicities","New Journal of Chemistry","2014","38","3","1218","","10.1039/c3nj01463k","","","0.71073","MoKα","","0.0475","0.0389","","","0.0987","0.106","","","","","","1.114","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053877","8.9999","0.0009","12.2528","0.0012","16.2526","0.0016","112.306","0.001","104.446","0.001","91.816","0.001","1589.6","0.3","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H23 Eu F6 N9 O6 P -","- C26 H23 Eu F6 N9 O6 P -","- C52 H46 Eu2 F12 N18 O12 P2 -","2","1","","Hasegawa, Miki; Ohtsu, Hideki; Kodama, Daisuke; Kasai, Takeshi; Sakurai, Shoya; Ishii, Ayumi; Suzuki, Kengo","Luminescence behaviour in acetonitrile and in the solid state of a series of lanthanide complexes with a single helical ligand","New Journal of Chemistry","2014","38","3","1225","","10.1039/c3nj00910f","","","0.71073","MoKα","","0.0387","0.0349","","","0.0947","0.0962","","","","","","1.082","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053878","9.0151","0.0007","12.214","0.0009","16.1835","0.0012","112.036","0.001","104.297","0.001","91.826","0.001","1585.2","0.2","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H23 F6 Gd N9 O6 P -","- C26 H23 F6 Gd N9 O6 P -","- C52 H46 F12 Gd2 N18 O12 P2 -","2","1","","Hasegawa, Miki; Ohtsu, Hideki; Kodama, Daisuke; Kasai, Takeshi; Sakurai, Shoya; Ishii, Ayumi; Suzuki, Kengo","Luminescence behaviour in acetonitrile and in the solid state of a series of lanthanide complexes with a single helical ligand","New Journal of Chemistry","2014","38","3","1225","","10.1039/c3nj00910f","","","0.71073","MoKα","","0.0366","0.0325","","","0.0821","0.0841","","","","","","1.061","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053879","9.961","0.003","13.593","0.004","13.751","0.004","68.307","0.003","86.035","0.003","87.405","0.003","1725.5","0.9","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C28 H26 F6 Ho N10 O6 P -","- C28 H26 F6 Ho N10 O6 P -","- C56 H52 F12 Ho2 N20 O12 P2 -","2","1","","Hasegawa, Miki; Ohtsu, Hideki; Kodama, Daisuke; Kasai, Takeshi; Sakurai, Shoya; Ishii, Ayumi; Suzuki, Kengo","Luminescence behaviour in acetonitrile and in the solid state of a series of lanthanide complexes with a single helical ligand","New Journal of Chemistry","2014","38","3","1225","","10.1039/c3nj00910f","","","0.71073","MoKα","","0.0513","0.0378","","","0.0845","0.0897","","","","","","1.072","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053880","8.949","0.002","12.231","0.003","16.394","0.004","112.158","0.002","104.132","0.002","92.428","0.003","1593.4","0.7","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H23 F6 N9 Nd O6 P -","- C26 H23 F6 N9 Nd O6 P -","- C52 H46 F12 N18 Nd2 O12 P2 -","2","1","","Hasegawa, Miki; Ohtsu, Hideki; Kodama, Daisuke; Kasai, Takeshi; Sakurai, Shoya; Ishii, Ayumi; Suzuki, Kengo","Luminescence behaviour in acetonitrile and in the solid state of a series of lanthanide complexes with a single helical ligand","New Journal of Chemistry","2014","38","3","1225","","10.1039/c3nj00910f","","","0.71073","MoKα","","0.034","0.0308","","","0.0823","0.0836","","","","","","1.055","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053881","9.0172","0.0011","12.2389","0.0015","16.133","0.002","112.054","0.001","104.269","0.001","91.622","0.001","1584.7","0.3","100","","100","","","","","","","","","7","P -1","-P 1","2","","","","- C26 H23 F6 N9 O6 P Tb -","- C26 H23 F6 N9 O6 P Tb -","- C52 H46 F12 N18 O12 P2 Tb2 -","2","1","","Hasegawa, Miki; Ohtsu, Hideki; Kodama, Daisuke; Kasai, Takeshi; Sakurai, Shoya; Ishii, Ayumi; Suzuki, Kengo","Luminescence behaviour in acetonitrile and in the solid state of a series of lanthanide complexes with a single helical ligand","New Journal of Chemistry","2014","38","3","1225","","10.1039/c3nj00910f","","","0.71073","MoKα","","0.0317","0.0294","","","0.0807","0.0818","","","","","","1.073","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053882","7.8205","0.0009","10.3904","0.0011","12.6744","0.0014","111.822","0.01","97.397","0.009","98.633","0.009","926","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H15 B F2 N4 O2 S -","- C19 H15 B F2 N4 O2 S -","- C38 H30 B2 F4 N8 O4 S2 -","2","1","","Wang, Xiaoqing; Liu, Hou-ting; Cui, Jichun; Wu, Yanping; Lu, Hua; Lu, Jing; Liu, Zhipeng; He, Weijiang","Synthesis and fluorescence properties of isoindoline‒benzazole-based boron difluoride complexes","New Journal of Chemistry","2014","38","3","1277","","10.1039/c3nj01361h","","","1.54184","CuKα","","0.1089","0.09","","","0.256","0.2804","","","","","","1.1","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053883","6.9557","0.0015","11.77","0.003","12.267","0.003","62.48","0.03","87.54","0.02","86.18","0.019","888.6","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H15 B F2 N4 O2 S -","- C17 H15 B F2 N4 O2 S -","- C34 H30 B2 F4 N8 O4 S2 -","2","1","","Wang, Xiaoqing; Liu, Hou-ting; Cui, Jichun; Wu, Yanping; Lu, Hua; Lu, Jing; Liu, Zhipeng; He, Weijiang","Synthesis and fluorescence properties of isoindoline‒benzazole-based boron difluoride complexes","New Journal of Chemistry","2014","38","3","1277","","10.1039/c3nj01361h","","","0.71073","MoKα","","0.0773","0.0505","","","0.1194","0.1415","","","","","","1.061","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053884","8.6511","0.0007","11.6621","0.0009","13.9426","0.0008","90","","100.04","0.007","90","","1385.13","0.18","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 B F2 N2 O S -","- C16 H9 B F2 N2 O S -","- C64 H36 B4 F8 N8 O4 S4 -","4","1","","Wang, Xiaoqing; Liu, Hou-ting; Cui, Jichun; Wu, Yanping; Lu, Hua; Lu, Jing; Liu, Zhipeng; He, Weijiang","Synthesis and fluorescence properties of isoindoline‒benzazole-based boron difluoride complexes","New Journal of Chemistry","2014","38","3","1277","","10.1039/c3nj01361h","","","0.71073","MoKα","","0.1154","0.0609","","","0.1504","0.1853","","","","","","1.021","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7053885","13.633","0.0014","9.7606","0.0011","21.294","0.003","90","","90","","90","","2833.5","0.6","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C17 H8 B F2 N3 O S -","- C17 H8 B F2 N3 O S -","- C136 H64 B8 F16 N24 O8 S8 -","8","1","","Wang, Xiaoqing; Liu, Hou-ting; Cui, Jichun; Wu, Yanping; Lu, Hua; Lu, Jing; Liu, Zhipeng; He, Weijiang","Synthesis and fluorescence properties of isoindoline‒benzazole-based boron difluoride complexes","New Journal of Chemistry","2014","38","3","1277","","10.1039/c3nj01361h","","","0.71073","MoKα","","0.1004","0.0625","","","0.1515","0.1821","","","","","","1.044","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053886","8.3276","0.0006","9.7084","0.0006","19.6254","0.0012","103.803","0.005","90.192","0.006","115.396","0.007","1381.81","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C15 H8 B F2 N3 O S -","- C15 H8 B F2 N3 O S -","- C60 H32 B4 F8 N12 O4 S4 -","4","2","","Wang, Xiaoqing; Liu, Hou-ting; Cui, Jichun; Wu, Yanping; Lu, Hua; Lu, Jing; Liu, Zhipeng; He, Weijiang","Synthesis and fluorescence properties of isoindoline‒benzazole-based boron difluoride complexes","New Journal of Chemistry","2014","38","3","1277","","10.1039/c3nj01361h","","","0.71073","MoKα","","0.1632","0.1487","","","0.3165","0.3225","","","","","","1.14","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053887","22.04","0.005","14.85","0.005","24.821","0.005","90","","100.605","0.005","90","","7985","4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C48 H53 Cu Mo12 N20 O44 P -","- C48 H44 Cu Mo12 N20 O44 P -","- C192 H176 Cu4 Mo48 N80 O176 P4 -","4","0.5","","Yu, Yan; Ma, Huiyuan; Pang, Haijun; Li, Shaobin; Yu, Tingting; Liu, Heng; Zhao, Chunyan; Zhang, Zhuanfang","Two novel zipper-like compounds of the usual and bivanadyl capped Keggin clusters connected by propeller-shaped complexes","New Journal of Chemistry","2014","38","3","1271","","10.1039/c3nj01329d","","","0.71069","MoKα","","0.1074","0.0877","","","0.21","0.2189","","","","","","0.973","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053888","32.193","0.005","15.456","0.005","22.188","0.005","90","","132.357","0.005","90","","8158","4","296","2","296","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C48 H45 Co Mo8 N20 O42 P V6 -","- C48 H40 Co Mo8 N20 O42 P V6 -","- C192 H160 Co4 Mo32 N80 O168 P4 V24 -","4","0.5","","Yu, Yan; Ma, Huiyuan; Pang, Haijun; Li, Shaobin; Yu, Tingting; Liu, Heng; Zhao, Chunyan; Zhang, Zhuanfang","Two novel zipper-like compounds of the usual and bivanadyl capped Keggin clusters connected by propeller-shaped complexes","New Journal of Chemistry","2014","38","3","1271","","10.1039/c3nj01329d","","","0.71069","MoKα","","0.0584","0.0508","","","0.1551","0.1604","","","","","","0.997","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053889","9.921","0.002","11.098","0.002","17.289","0.004","90","","97.5","0.03","90","","1887.3","0.7","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H17 Cl N4 O -","- C21 H17 Cl N4 O -","- C84 H68 Cl4 N16 O4 -","4","1","","Zhao, Xiao-Fei; Ouyang, Yan; Liu, Yan-Zhao; Su, Qiao-Juan; Tian, He; Xie, Cheng-Zhi; Xu, Jing-Yuan","Two polypyridyl copper(ii) complexes: synthesis, crystal structure and interaction with DNA and serum protein in vitro","New Journal of Chemistry","2014","38","3","955","","10.1039/c3nj01107k","","","0.71073","MoKα","","0.1255","0.0837","","","0.1561","0.1722","","","","","","1.166","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053890","8.586","0.0017","11.18","0.002","13.844","0.003","97.13","0.03","104.4","0.03","94.66","0.03","1268.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H22 Cl Cu N5 O6 -","- C25 H22 Cl Cu N5 O6 -","- C50 H44 Cl2 Cu2 N10 O12 -","2","1","","Zhao, Xiao-Fei; Ouyang, Yan; Liu, Yan-Zhao; Su, Qiao-Juan; Tian, He; Xie, Cheng-Zhi; Xu, Jing-Yuan","Two polypyridyl copper(ii) complexes: synthesis, crystal structure and interaction with DNA and serum protein in vitro","New Journal of Chemistry","2014","38","3","955","","10.1039/c3nj01107k","","","0.71073","MoKα","","0.1818","0.095","","","0.2131","0.2538","","","","","","1.01","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053891","8.418","0.003","9.753","0.003","28.363","0.01","92.028","0.007","90.542","0.006","93.765","0.008","2322","1.4","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H18 Cu N6 O7 -","- C24 H18 Cu N6 O7 -","- C96 H72 Cu4 N24 O28 -","4","2","","Zhao, Xiao-Fei; Ouyang, Yan; Liu, Yan-Zhao; Su, Qiao-Juan; Tian, He; Xie, Cheng-Zhi; Xu, Jing-Yuan","Two polypyridyl copper(ii) complexes: synthesis, crystal structure and interaction with DNA and serum protein in vitro","New Journal of Chemistry","2014","38","3","955","","10.1039/c3nj01107k","","","0.71073","MoKα","","0.0778","0.0544","","","0.1122","0.1225","","","","","","1.027","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053892","19.9204","0.0016","9.6139","0.0008","13.2845","0.0011","90","","98.934","0.004","90","","2513.3","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Al3 K6 Na3 O24 P6 -","- Al3 K6 Na3 O24 P6 -","- Al12 K24 Na12 O96 P24 -","4","1","","Wang, Ying; Pan, Shilie; Han, Shujuan; Dong, Lingyun; Zhang, Min; Wu, Kui","Synthesis and characterization of a new aluminophosphate with a Al3P6O249− three-dimensional framework","New Journal of Chemistry","2014","38","3","889","","10.1039/c3nj01484c","","","0.71073","MoKα","","0.0431","0.037","","","0.1033","0.1076","","","","","","1.047","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053893","9.3437","0.0017","10.538","0.002","11.5632","0.0015","105.416","0.015","94.821","0.013","114.063","0.019","978","0.4","100.05","0.1","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H17 N4 S -","- C26 H17 N4 S -","- C52 H34 N8 S2 -","2","1","","Constantinides, Christos P.; Berezin, Andrey A.; Manoli, Maria; Leitus, Gregory M.; Bendikov, Michael; Rawson, Jeremy M.; Koutentis, Panayiotis A.","Effective exchange coupling in alternating-chains of a π-extended 1,2,4-benzotriazin-4-yl","New Journal of Chemistry","2014","38","3","949","","10.1039/c3nj01235b","","","1.54184","CuKα","","0.0708","0.0558","","","0.1496","0.1723","","","","","","1.071","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053894","8.886","0.0014","19.167","0.003","13.127","0.002","90","","91.746","0.005","90","","2234.7","0.6","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H52 Ag2 N10 O22 -","- C32 H52 Ag2 N10 O22 -","- C64 H104 Ag4 N20 O44 -","2","0.5","","Kumar, Rakesh; Obrai, Sangeeta; Kaur, Amanpreet; Hundal, Maninder Singh; Meehnian, Harmanpreet; Jana, Asim Kumar","Synthesis, crystal structure investigation, DFT analyses and antimicrobial studies of silver(i) complexes with N,N,N′,N′′-tetrakis(2-hydroxyethyl/propyl) ethylenediamine and tris(2-hydroxyethyl)amine","New Journal of Chemistry","2014","38","3","1186","","10.1039/c3nj00729d","","","0.71069","MoKα","","0.1245","0.0769","","","0.1553","0.1786","","","","","","1.177","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053895","12.796","0.001","15.621","0.002","13.283","0.003","90","","94.297","0.002","90","","2647.6","0.7","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H68 Ag2 N10 O22 -","- C40 H68 Ag2 N10 O22 -","- C80 H136 Ag4 N20 O44 -","2","0.5","","Kumar, Rakesh; Obrai, Sangeeta; Kaur, Amanpreet; Hundal, Maninder Singh; Meehnian, Harmanpreet; Jana, Asim Kumar","Synthesis, crystal structure investigation, DFT analyses and antimicrobial studies of silver(i) complexes with N,N,N′,N′′-tetrakis(2-hydroxyethyl/propyl) ethylenediamine and tris(2-hydroxyethyl)amine","New Journal of Chemistry","2014","38","3","1186","","10.1039/c3nj00729d","","","0.71073","MoKα","","0.0449","0.0347","","","0.0828","0.0881","","","","","","1.019","","","","has coordinates,has disorder","180092","2020-10-21","18:00:00",""
"7053896","9.194","0.005","20.952","0.005","13.625","0.005","90","","108.315","0.005","90","","2491.7","1.7","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 Ag N5 O13 -","- C18 H32 Ag N5 O13 -","- C72 H128 Ag4 N20 O52 -","4","1","","Kumar, Rakesh; Obrai, Sangeeta; Kaur, Amanpreet; Hundal, Maninder Singh; Meehnian, Harmanpreet; Jana, Asim Kumar","Synthesis, crystal structure investigation, DFT analyses and antimicrobial studies of silver(i) complexes with N,N,N′,N′′-tetrakis(2-hydroxyethyl/propyl) ethylenediamine and tris(2-hydroxyethyl)amine","New Journal of Chemistry","2014","38","3","1186","","10.1039/c3nj00729d","","","0.71073","MoKα","","0.0671","0.0422","","","0.0985","0.1145","","","","","","1.089","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053897","17.164","0.003","6.6995","0.0013","19.809","0.004","90","","111.08","0.03","90","","2125.4","0.8","293","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C27 H20 N2 -","- C27 H20 N2 -","- C108 H80 N8 -","4","1","","Zhao, Xin; Xue, Pengchong; Wang, Kai; Chen, Peng; Zhang, Peng; Lu, Ran","Aggregation-induced emission of triphenylamine substituted cyanostyrene derivatives","New Journal of Chemistry","2014","38","3","1045","","10.1039/c3nj01343j","","","0.71073","MoKα","","0.1192","0.0535","","","0.1219","0.1451","","","","","","0.982","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053898","11.154","0.002","7.5463","0.0015","25.707","0.005","90","","96.42","0.03","90","","2150.2","0.7","293","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H19 N3 O2 -","- C27 H19 N3 O2 -","- C108 H76 N12 O8 -","4","1","","Zhao, Xin; Xue, Pengchong; Wang, Kai; Chen, Peng; Zhang, Peng; Lu, Ran","Aggregation-induced emission of triphenylamine substituted cyanostyrene derivatives","New Journal of Chemistry","2014","38","3","1045","","10.1039/c3nj01343j","","","0.71073","MoKα","","0.1153","0.0542","","","0.1212","0.1423","","","","","","1.031","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053899","8.65","0.002","12.44","0.002","16.14","0.003","105.39","0.02","90.16","0.02","94.95","0.02","1667.6","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H41 F N3 O6 P -","- C36 H41 F N3 O6 P -","- C72 H82 F2 N6 O12 P2 -","2","1","","Bykowska, Aleksandra; Starosta, Radosław; Komarnicka, Urszula K.; Ciunik, Zbigniew; Kyzioł, Agnieszka; Guz-Regner, Katarzyna; Bugla-Płoskońska, Gabriela; Jeżowska-Bojczuk, Małgorzata","Phosphine derivatives of ciprofloxacin and norfloxacin, a new class of potential therapeutic agents","New Journal of Chemistry","2014","38","3","1062","","10.1039/c3nj01243c","","","0.71073","MoKα","","0.0986","0.0858","","","0.2339","0.2435","","","","","","1.041","","","","has coordinates","180092","2020-10-21","18:00:00",""
"7053900","8.748","0.001","22.372","0.003","14.514","0.002","90","","94.6","0.02","90","","2831.4","0.6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C30.5 H30 Cl F N3 O3 P S -","- C30.5 H29 Cl F N3 O3 P S -","- C122 H116 Cl4 F4 N12 O12 P4 S4 -","4","1","","Bykowska, Aleksandra; Starosta, Radosław; Komarnicka, Urszula K.; Ciunik, Zbigniew; Kyzioł, Agnieszka; Guz-Regner, Katarzyna; Bugla-Płoskońska, Gabriela; Jeżowska-Bojczuk, Małgorzata","Phosphine derivatives of ciprofloxacin and norfloxacin, a new class of potential therapeutic agents","New Journal of Chemistry","2014","38","3","1062","","10.1039/c3nj01243c","","","0.71073","MoKα","","0.0701","0.0539","","","0.1465","0.1528","","","","","","1.322","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053901","8.102","0.003","25.993","0.006","14.216","0.004","90","","92.42","0.03","90","","2991.2","1.6","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C30.79 H32.36 F N3 O3.89 P Se -","- C30.785 H32.355 F N3 O3.8925 P Se -","- C123.14 H129.42 F4 N12 O15.57 P4 Se4 -","4","2","","Bykowska, Aleksandra; Starosta, Radosław; Komarnicka, Urszula K.; Ciunik, Zbigniew; Kyzioł, Agnieszka; Guz-Regner, Katarzyna; Bugla-Płoskońska, Gabriela; Jeżowska-Bojczuk, Małgorzata","Phosphine derivatives of ciprofloxacin and norfloxacin, a new class of potential therapeutic agents","New Journal of Chemistry","2014","38","3","1062","","10.1039/c3nj01243c","","","0.71073","MoKα","","0.047","0.0396","","","0.081","0.0844","","","","","","1.026","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053902","15.303","0.003","7.6263","0.0016","15.344","0.003","90","","107.767","0.004","90","","1705.3","0.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 Ag F6 N8 P -","- C28 H24 Ag F6 N8 P -","- C56 H48 Ag2 F12 N16 P2 -","2","0.5","","Wang, Pin-Ning; Yeh, Chun-Wei; Tsou, Chi-Hui; Ho, Yuh-Wen; Lin, Shui-Chuan; Suen, Maw-Cherng","Structural diversity in the self-assembly of Ag(i) complexes containing 2,6-dimethyl-3,5-dicyano-4-(3-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2014","38","3","1079","","10.1039/c3nj01322g","","","0.71073","MoKα","","0.0807","0.064","","","0.1911","0.21","","","","","","1.004","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053903","9.0792","0.0004","11.0233","0.0005","14.141","0.0007","97.122","0.002","101.625","0.002","92.199","0.002","1372.62","0.11","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H48 Ag2 F6 N16 P -","- C56 H48 Ag2 F6 N16 P -","- C56 H48 Ag2 F6 N16 P -","1","0.5","","Wang, Pin-Ning; Yeh, Chun-Wei; Tsou, Chi-Hui; Ho, Yuh-Wen; Lin, Shui-Chuan; Suen, Maw-Cherng","Structural diversity in the self-assembly of Ag(i) complexes containing 2,6-dimethyl-3,5-dicyano-4-(3-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2014","38","3","1079","","10.1039/c3nj01322g","","x-ray","0.71073","MoKα","","0.0264","0.0241","","","0.0699","0.0776","","","","","","1.121","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053904","8.7672","0.0006","19.8975","0.0014","11.2697","0.0007","90","","108.772","0.007","90","","1861.4","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 Ag B F4 N5 -","- C16 H15 Ag B F4 N5 -","- C64 H60 Ag4 B4 F16 N20 -","4","1","","Wang, Pin-Ning; Yeh, Chun-Wei; Tsou, Chi-Hui; Ho, Yuh-Wen; Lin, Shui-Chuan; Suen, Maw-Cherng","Structural diversity in the self-assembly of Ag(i) complexes containing 2,6-dimethyl-3,5-dicyano-4-(3-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2014","38","3","1079","","10.1039/c3nj01322g","","","0.71073","MoKα","","0.0605","0.0493","","","0.1103","0.116","","","","","","1.139","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053905","9.0714","0.0004","18.3581","0.0008","20.8126","0.0009","90","","102.06","0.002","90","","3389.5","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31 H27 Ag F3 N9 O3 S -","- C31 H27 Ag F3 N9 O3 S -","- C124 H108 Ag4 F12 N36 O12 S4 -","4","1","","Wang, Pin-Ning; Yeh, Chun-Wei; Tsou, Chi-Hui; Ho, Yuh-Wen; Lin, Shui-Chuan; Suen, Maw-Cherng","Structural diversity in the self-assembly of Ag(i) complexes containing 2,6-dimethyl-3,5-dicyano-4-(3-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2014","38","3","1079","","10.1039/c3nj01322g","","x-ray","0.71073","MoKα","","0.0425","0.0364","","","0.0948","0.1004","","","","","","1.066","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053906","8.5452","0.0004","12.2962","0.0004","15.9721","0.0006","84.345","0.003","80.885","0.003","71.359","0.004","1568.06","0.11","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H24 Ag2 Cl2 N8 O8 -","- C28 H24 Ag2 Cl2 N8 O8 -","- C56 H48 Ag4 Cl4 N16 O16 -","2","1","","Wang, Pin-Ning; Yeh, Chun-Wei; Tsou, Chi-Hui; Ho, Yuh-Wen; Lin, Shui-Chuan; Suen, Maw-Cherng","Structural diversity in the self-assembly of Ag(i) complexes containing 2,6-dimethyl-3,5-dicyano-4-(3-pyridyl)-1,4-dihydropyridine","New Journal of Chemistry","2014","38","3","1079","","10.1039/c3nj01322g","","x-ray","0.71073","MoKα","","0.0286","0.0237","","","0.0516","0.0537","","","","","","1.046","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053907","12.235","0.003","16.9476","0.0018","13.042","0.003","90","","103.294","0.009","90","","2631.8","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H64 N4 O11 Zn2 -","- C58 H56 N4 O11 Zn2 -","- C116 H112 N8 O22 Zn4 -","2","0.5","","Salmon, Lionel; Thuéry, Pierre; Rivière, Eric; Costes, Jean-Pierre; . Mota, Antonio J; Ephritikhine, Michel","Structural, magnetic and theoretical calculations of a ferromagnetically coupled tetranuclear copper(ii) square complex","New Journal of Chemistry","2014","38","3","1306","","10.1039/c3nj01512b","","","0.71073","MoKα","","0.2079","0.0936","","","0.1711","0.2204","","","","","","1.012","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053908","13.2695","0.0008","26.7073","0.0011","29.302","0.0017","90","","99.835","0.003","90","","10231.8","1","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C112 H120 Cu4 N8 O21 -","- C112 H120 Cu4 N8 O21 -","- C448 H480 Cu16 N32 O84 -","4","1","","Salmon, Lionel; Thuéry, Pierre; Rivière, Eric; Costes, Jean-Pierre; . Mota, Antonio J; Ephritikhine, Michel","Structural, magnetic and theoretical calculations of a ferromagnetically coupled tetranuclear copper(ii) square complex","New Journal of Chemistry","2014","38","3","1306","","10.1039/c3nj01512b","","","0.71073","MoKα","","0.1361","0.0811","","","0.1879","0.2253","","","","","","1.023","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053909","8.8996","0.0001","8.8996","0.0001","39.5773","0.0011","90","","90","","120","","2714.67","0.09","123","2","123","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C38 H40 Cu N4 O10 -","- C38 H40 Cu N4 O10 -","- C114 H120 Cu3 N12 O30 -","3","0.5","","Tanaka, Koichi; Kikumoto, Yuki; Hota, Naoki; Takahashi, Hiroki","Homochiral coordination polymers with nanotubular channels for enantioselective sorption of chiral guest molecules","New Journal of Chemistry","2014","38","3","880","","10.1039/c3nj01058a","","","0.71075","MoKα","","0.0558","0.0524","","","0.1377","0.1453","","","","","","1.124","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053910","22.934","0.004","30.885","0.005","10.5055","0.0018","90","","90","","90","","7441","2","100","2","100","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C40.5 H35.5 Cu N3.5 O7 -","- C40.5 H35.5 Cu N3.5 O7 -","- C324 H284 Cu8 N28 O56 -","8","1","","Tanaka, Koichi; Kikumoto, Yuki; Hota, Naoki; Takahashi, Hiroki","Homochiral coordination polymers with nanotubular channels for enantioselective sorption of chiral guest molecules","New Journal of Chemistry","2014","38","3","880","","10.1039/c3nj01058a","","","0.71075","MoKα","","0.0587","0.0535","","","0.1495","0.1539","","","","","","1.11","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053911","12.467","0.009","11.156","0.008","16.139","0.012","90","","96.304","0.009","90","","2231","3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cl Cu N5 O6 -","- C20 H20 Cl Cu N5 O6 -","- C80 H80 Cl4 Cu4 N20 O24 -","4","1","","Wu, Huilu; Wang, Hua; Wang, Xiaoli; Pan, Guolong; Shi, Furong; Zhang, Yanhui; Bai, Yuchen; Kong, Jin","V-shaped ligand bis(2-benzimidazolylmethyl)amine containing three copper(ii) ternary complexes: synthesis, structure, DNA-binding properties and antioxidant activity","New Journal of Chemistry","2014","38","3","1052","","10.1039/c3nj01145c","","","0.71073","MoKα","","0.0571","0.0457","","","0.1286","0.1376","","","","","","1.037","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053912","11.772","0.002","14.952","0.004","13.66","0.003","90","","116.415","0.01","90","","2153.3","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 Cl Cu N5 O6 -","- C20 H20 Cl Cu N5 O6 -","- C80 H80 Cl4 Cu4 N20 O24 -","4","1","","Wu, Huilu; Wang, Hua; Wang, Xiaoli; Pan, Guolong; Shi, Furong; Zhang, Yanhui; Bai, Yuchen; Kong, Jin","V-shaped ligand bis(2-benzimidazolylmethyl)amine containing three copper(ii) ternary complexes: synthesis, structure, DNA-binding properties and antioxidant activity","New Journal of Chemistry","2014","38","3","1052","","10.1039/c3nj01145c","","","0.71073","MoKα","","0.0512","0.0377","","","0.0949","0.1016","","","","","","1.04","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053913","17.298","0.002","8.5102","0.001","15.4923","0.0018","90","","97.711","0.002","90","","2260","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 Cu N6 O7 -","- C20 H24 Cu N6 O7 -","- C80 H96 Cu4 N24 O28 -","4","1","","Wu, Huilu; Wang, Hua; Wang, Xiaoli; Pan, Guolong; Shi, Furong; Zhang, Yanhui; Bai, Yuchen; Kong, Jin","V-shaped ligand bis(2-benzimidazolylmethyl)amine containing three copper(ii) ternary complexes: synthesis, structure, DNA-binding properties and antioxidant activity","New Journal of Chemistry","2014","38","3","1052","","10.1039/c3nj01145c","","","0.71073","MoKα","","0.0633","0.0506","","","0.1525","0.1621","","","","","","1.12","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053914","19.0393","0.0003","13.3551","0.0002","24.7011","0.0005","90","","110.139","0.002","90","","5896.79","0.19","118","2","118","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cl-gf, 118 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene","","- C33 H33 Cl3 O3 -","- C33 H33 Cl3 O3 -","- C264 H264 Cl24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0686","0.0452","","","0.0999","0.1093","","","","","","1.028","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053915","19.069","0.0007","13.3847","0.0004","24.7369","0.0009","90","","110.263","0.004","90","","5922.9","0.4","154","2","154","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cl-gf, 154 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene","","- C33 H33 Cl3 O3 -","- C33 H33 Cl3 O3 -","- C264 H264 Cl24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0892","0.0506","","","0.1133","0.131","","","","","","0.994","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053916","19.0913","0.0008","13.3962","0.0005","24.8034","0.0011","90","","110.348","0.005","90","","5947.6","0.5","190","2","190","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cl-gf, 190 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene","","- C33 H33 Cl3 O3 -","- C33 H33 Cl3 O3 -","- C264 H264 Cl24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0929","0.0554","","","0.1301","0.1508","","","","","","1.035","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053917","24.8803","0.001","13.4318","0.0004","28.8166","0.0011","90","","110.512","0.005","90","","9019.6","0.6","226","2","226","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Cl-gf, 226 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene","","- C33 H33 Cl3 O3 -","- C33 H33 Cl3 O3 -","- C396 H396 Cl36 O36 -","12","3","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1437","0.0717","","","0.1417","0.1786","","","","","","1.03","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053918","24.9516","0.001","13.4628","0.0004","28.8673","0.0011","90","","110.6","0.004","90","","9077","0.6","262","2","262","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Cl-gf, 262 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene","","- C33 H33 Cl3 O3 -","- C33 H33 Cl3 O3 -","- C396 H396 Cl36 O36 -","12","3","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1769","0.0753","","","0.1627","0.2145","","","","","","1.01","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053919","25.03","0.0011","13.4909","0.0005","28.938","0.0011","90","","110.676","0.005","90","","9142.3","0.7","298","2","298","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","Cl-gf, 298 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene","","- C33 H33 Cl3 O3 -","- C33 H33 Cl3 O3 -","- C396 H396 Cl36 O36 -","12","3","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1864","0.071","","","0.1684","0.2235","","","","","","1.017","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053920","19.1589","0.0007","13.3863","0.0004","25.1489","0.001","90","","109.755","0.004","90","","6070.3","0.4","118","2","118","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Br-gf, 118 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene","","- C33 H33 Br3 O3 -","- C33 H33 Br3 O3 -","- C264 H264 Br24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.107","0.0587","","","0.1247","0.1471","","","","","","1.025","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053921","19.1937","0.0007","13.4082","0.0004","25.1997","0.0011","90","","109.775","0.004","90","","6102.8","0.4","154","2","154","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Br-gf, 154 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene","","- C33 H33 Br3 O3 -","- C33 H33 Br3 O3 -","- C264 H264 Br24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.125","0.0638","","","0.1303","0.1569","","","","","","1.014","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053922","19.226","0.0007","13.4255","0.0005","25.2443","0.0013","90","","109.776","0.005","90","","6131.7","0.5","190","2","190","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Br-gf, 190 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene","","- C33 H33 Br3 O3 -","- C33 H33 Br3 O3 -","- C264 H264 Br24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1484","0.068","","","0.1404","0.1754","","","","","","1.008","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053923","19.267","0.0008","13.4479","0.0005","25.3027","0.0016","90","","109.815","0.006","90","","6167.8","0.6","226","2","226","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Br-gf, 226 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene","","- C33 H33 Br3 O3 -","- C33 H33 Br3 O3 -","- C264 H264 Br24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1953","0.0824","","","0.1825","0.2408","","","","","","1.011","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053924","9.6682","0.0004","13.4772","0.0007","23.8893","0.0014","90","","92.463","0.005","90","","3109.9","0.3","262","0.2","262","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Br-gf, 262 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene","","- C33 H33 Br3 O3 -","- C33 H33 Br3 O3 -","- C132 H132 Br12 O12 -","4","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1786","0.0644","","","0.1162","0.1538","","","","","","1.005","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053925","9.6977","0.0005","13.4907","0.0007","23.9687","0.0019","90","","92.416","0.006","90","","3133","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Br-gf, 298 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene","","- C33 H33 Br3 O3 -","- C33 H33 Br3 O3 -","- C132 H132 Br12 O12 -","4","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.2023","0.0701","","","0.1436","0.1989","","","","","","0.999","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053926","19.4397","0.0004","13.3256","0.0003","26.3234","0.0006","90","","108.968","0.003","90","","6448.7","0.3","118","2","118","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","I-gf, 118 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene","","- C33 H33 I3 O3 -","- C33 H33 I3 O3 -","- C264 H264 I24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0651","0.0388","","","0.0767","0.0873","","","","","","1.026","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053927","19.4896","0.0006","13.3369","0.0003","26.3205","0.0007","90","","108.892","0.003","90","","6473","0.3","154","2","154","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H33 I3 O3 -","- C33 H33 I3 O3 -","- C264 H264 I24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0966","0.0504","","","0.0899","0.109","","","","","","1.022","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053928","19.5482","0.0007","13.3514","0.0005","26.3226","0.0008","90","","108.848","0.004","90","","6501.7","0.4","190","2","190","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","I-gf, 190 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene","","- C33 H33 I3 O3 -","- C33 H33 I3 O3 -","- C264 H264 I24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1101","0.0542","","","0.093","0.115","","","","","","1.017","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053929","19.6173","0.0007","13.3722","0.0004","26.3254","0.0009","90","","108.829","0.004","90","","6536.3","0.4","226","2","226","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","I-gf, 226 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene","","- C33 H33 I3 O3 -","- C33 H33 I3 O3 -","- C264 H264 I24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1243","0.0576","","","0.1084","0.1373","","","","","","1.009","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053930","19.7104","0.0009","13.3901","0.0005","26.3231","0.001","90","","108.829","0.005","90","","6575.5","0.5","262","2","262","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","I-gf, 262 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene","","- C33 H33 I3 O3 -","- C33 H33 I3 O3 -","- C264 H264 I24 O24 -","8","2","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1501","0.0625","","","0.1214","0.1596","","","","","","1.007","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053931","9.9304","0.0005","13.4111","0.0006","24.9283","0.0015","90","","93.303","0.005","90","","3314.4","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","I-gf, 298 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene","","- C33 H33 I3 O3 -","- C33 H33 I3 O3 -","- C132 H132 I12 O12 -","4","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1043","0.0471","","","0.0962","0.1198","","","","","","1.005","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053932","9.6153","0.0003","13.3561","0.0006","14.5104","0.0008","111.81","0.005","92.311","0.004","90.228","0.003","1728.31","0.15","118","2","118","2","","","","","","","","4","P -1","-P 1","2","Cl-ea, 118 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Cl3 O5 -","- C33 H33 Cl3 O3 -","- C66 H66 Cl6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1399","0.1196","","","0.3345","0.3444","","","","","","1.112","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053933","9.6338","0.0004","13.382","0.0008","14.5496","0.0011","111.658","0.006","92.203","0.005","90.17","0.004","1741.7","0.2","154","2","154","2","","","","","","","","4","P -1","-P 1","2","Cl-ea, 154 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Cl3 O5 -","- C33 H33 Cl3 O3 -","- C66 H66 Cl6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.135","0.1068","","","0.3099","0.3252","","","","","","1.049","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053934","9.6558","0.0004","13.4048","0.0007","14.5814","0.0011","111.503","0.006","92.122","0.005","90.099","0.004","1754.53","0.19","190","2","190","2","","","","","","","","4","P -1","-P 1","2","Cl-ea, 190 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Cl3 O5 -","- C33 H33 Cl3 O3 -","- C66 H66 Cl6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1393","0.1086","","","0.3176","0.3354","","","","","","1.049","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053935","9.6879","0.0005","13.428","0.0008","14.6215","0.0011","111.346","0.006","92.071","0.005","90.031","0.005","1770.3","0.2","226","2","226","2","","","","","","","","4","P -1","-P 1","2","Cl-ea, 226 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Cl3 O5 -","- C33 H33 Cl3 O3 -","- C66 H66 Cl6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1476","0.1069","","","0.3096","0.3326","","","","","","1.042","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053936","9.7104","0.0004","13.4378","0.0009","14.6582","0.0012","111.156","0.007","92.048","0.005","89.974","0.004","1782.5","0.2","262","2","262","2","","","","","","","","4","P -1","-P 1","2","Cl-ea, 262 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Cl3 O5 -","- C33 H33 Cl3 O3 -","- C66 H66 Cl6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1544","0.1114","","","0.3405","0.3675","","","","","","1.075","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053937","9.7599","0.0007","13.466","0.0012","14.7073","0.0015","110.972","0.009","92.061","0.007","89.844","0.007","1803.6","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Cl-ea, 298 K","2,4,6-triethyl-1,3,5-tris(4-chlorophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Cl3 O5 -","- C33 H33 Cl3 O3 -","- C66 H66 Cl6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.147","0.0899","","","0.2636","0.3056","","","","","","1.026","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053938","9.6357","0.0004","13.3206","0.0006","14.8618","0.0008","111.93","0.005","93.132","0.004","90.688","0.003","1765.81","0.16","118","2","118","2","","","","","","","","4","P -1","-P 1","2","Br-ea, 118 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Br3 O5 -","- C33 H33 Br3 O3 -","- C66 H66 Br6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.071","0.0468","","","0.1286","0.1393","","","","","","1.057","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053939","9.6832","0.0005","13.3456","0.0007","14.8992","0.0009","111.677","0.006","92.868","0.005","90.53","0.004","1786.19","0.19","154","2","154","2","","","","","","","","4","P -1","-P 1","2","Br-ea, 154 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Br3 O5 -","- C33 H33 Br3 O3 -","- C66 H66 Br6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.078","0.045","","","0.1104","0.1215","","","","","","0.988","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053940","9.7089","0.0004","13.3527","0.0007","14.9175","0.0009","111.537","0.005","92.79","0.004","90.451","0.004","1796.06","0.17","190","2","190","2","","","","","","","","4","P -1","-P 1","2","Br-ea, 190 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Br3 O5 -","- C33 H33 Br3 O3 -","- C66 H66 Br6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0896","0.0489","","","0.1288","0.1424","","","","","","1.02","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053941","9.7426","0.0004","13.3708","0.0007","14.9451","0.0009","111.356","0.005","92.755","0.004","90.399","0.004","1810.44","0.17","226","2","226","2","","","","","","","","4","P -1","-P 1","2","Br-ea, 226 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Br3 O5 -","- C33 H33 Br3 O3 -","- C66 H66 Br6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.104","0.052","","","0.1355","0.1543","","","","","","0.968","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053942","9.776","0.0005","13.3875","0.0007","14.9897","0.001","111.204","0.006","92.694","0.005","90.304","0.004","1826.4","0.2","262","2","262","2","","","","","","","","4","P -1","-P 1","2","Br-ea, 262 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Br3 O5 -","- C33 H33 Br3 O3 -","- C66 H66 Br6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1245","0.0632","","","0.1807","0.2057","","","","","","1.035","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053943","9.8063","0.0006","13.4053","0.0012","15.0177","0.001","110.995","0.008","92.706","0.005","90.183","0.006","1840.6","0.3","298","2","298","2","","","","","","","","4","P -1","-P 1","2","Br-ea, 298 K","2,4,6-triethyl-1,3,5-tris(4-bromophenoxy)methylbenzene, ethyl acetate","","- C37 H41 Br3 O5 -","- C33 H33 Br3 O3 -","- C66 H66 Br6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.151","0.0623","","","0.1593","0.1906","","","","","","0.926","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053944","9.8275","0.0005","13.2269","0.0008","15.4915","0.0008","111.605","0.005","94.919","0.004","91.912","0.005","1860.74","0.19","118","2","118","2","","","","","","","","4","P -1","-P 1","2","I-ea, 118 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene, ethyl acetate","","- C37 H41 I3 O5 -","- C33 H33 I3 O3 -","- C66 H66 I6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0649","0.046","","","0.1205","0.1313","","","","","","1.056","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053945","9.8405","0.0007","13.2389","0.0011","15.5067","0.001","111.319","0.007","94.776","0.005","91.678","0.006","1871.5","0.3","154","2","154","2","","","","","","","","4","P -1","-P 1","2","I-ea, 154 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene, ethyl acetate","","- C37 H41 I3 O5 -","- C33 H33 I3 O3 -","- C66 H66 I6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0753","0.0493","","","0.1219","0.1368","","","","","","1.007","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053946","9.8581","0.0004","13.2593","0.0006","15.5438","0.0006","111.2","0.004","94.483","0.003","91.411","0.004","1885.4","0.15","190","2","190","2","","","","","","","","4","P -1","-P 1","2","I-ea, 190 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene, ethyl acetate","","- C37 H41 I3 O5 -","- C33 H33 I3 O3 -","- C66 H66 I6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.061","0.0425","","","0.1116","0.1207","","","","","","1.087","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053947","9.906","0.0005","13.3034","0.0006","15.5724","0.0007","111.092","0.004","94.353","0.004","91.198","0.004","1906.61","0.16","226","2","226","2","","","","","","","","4","P -1","-P 1","2","I-ea, 226 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene, ethyl acetate","","- C37 H41 I3 O5 -","- C33 H33 I3 O3 -","- C66 H66 I6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0694","0.0471","","","0.1258","0.1363","","","","","","1.085","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053948","9.9501","0.0004","13.3296","0.0005","15.5931","0.0007","110.937","0.004","94.265","0.004","91.077","0.004","1923.94","0.15","262","2","262","2","","","","","","","","4","P -1","-P 1","2","I-ea, 262 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene, ethyl acetate","","- C37 H41 I3 O5 -","- C33 H33 I3 O3 -","- C66 H66 I6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.0804","0.0506","","","0.1398","0.1523","","","","","","1.1","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053949","9.9945","0.0005","13.3552","0.0007","15.6205","0.0008","110.795","0.005","94.271","0.004","90.921","0.004","1941.74","0.18","298","2","298","2","","","","","","","","4","P -1","-P 1","2","I-ea, 298 K","2,4,6-triethyl-1,3,5-tris(4-iodophenoxy)methylbenzene, ethyl acetate","","- C37 H41 I3 O5 -","- C33 H33 I3 O3 -","- C66 H66 I6 O6 -","2","1","","Saraswatula, Viswanadha G.; Saha, Binoy K.","The effect of temperature on interhalogen interactions in a series of isostructural organic systems","New Journal of Chemistry","2014","38","3","897","","10.1039/c3nj01395b","","","0.71073","MoKα","","0.1014","0.0618","","","0.1671","0.1923","","","","","","1.126","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053950","6.6056","0.0007","8.1991","0.001","9.6416","0.0012","75.649","0.012","71.705","0.008","78.569","0.01","476.19","0.1","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","bis(3-nitrophenol-2-yl)tetranitrosyl diiron","","- C12 H8 Fe2 N6 O8 S2 -","- C12 H8 Fe2 N6 O8 S2 -","- C12 H8 Fe2 N6 O8 S2 -","1","0.5","","Sanina, N. A.; Krivenko, A. G.; Manzhos, R. A.; Emel'yanova, N. S.; Kozub, G. I.; Korchagin, D. V.; Shilov, G. V.; Kondrat'eva, T. A.; Ovanesyan, N. S.; Aldoshin, S. M.","Influence of aromatic ligand on the redox activity of neutral binuclear tetranitrosyl iron complexes [Fe2(μ-SR)2(NO)4]: experiments and quantum-chemical modeling","New Journal of Chemistry","2014","38","1","292","","10.1039/c3nj00704a","","","0.7107","MoKα","","0.0485","0.0344","","","0.0673","0.0734","","","","","","0.9","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053951","17.913","0.002","9.5455","0.0012","8.8695","0.0011","90","","99.613","0.002","90","","1495.3","0.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Fe O -","- C19 H16 Fe O -","- C76 H64 Fe4 O4 -","4","1","","Deepthi, Sadanala Bhavya; Trivedi, Rajiv; Giribabu, Lingamallu; Sujitha, Pombala; Ganesh Kumar, C.; Sridhar, B.","(4-Ferrocenylphenyl)propargyl ether derived carbohydrate triazoles: influence of a hydrophobic linker on the electrochemical and cytotoxic properties","New Journal of Chemistry","2014","38","1","227","","10.1039/c3nj01022h","","","0.71073","MoKα","","0.036","0.0309","","","0.0808","0.0842","","","","","","1.037","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053952","7.9131","0.0008","17.7611","0.0019","14.9879","0.0018","90","","99.912","0.003","90","","2075","0.4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H5 D6 N6 Ni S4 -","- C16 H5 D6 N6 Ni S4 -","- C64 H20 D24 N24 Ni4 S16 -","4","1","","Ning, Wei-Hua; Chen, Xuan-Rong; Liu, Jian-Lan; Guo, Ping-Chun; Ren, Xiao-Ming","Two magnetic phase transitions, driven by symmetry breaking and isostructural phase transitions, in a nickel-bis-dithiolene spin system","New Journal of Chemistry","2014","38","1","179","","10.1039/c3nj01101a","","","0.71073","MoKα","","0.1512","0.0619","","","0.1549","0.1955","","","","","","0.999","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053953","15.494","0.0012","17.3801","0.0012","16.0217","0.0014","90","","110.099","0.009","90","","4051.7","0.6","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H5 D6 N6 Ni S4 -","- C16 H5 D6 N6 Ni S4 -","- C128 H40 D48 N48 Ni8 S32 -","8","2","","Ning, Wei-Hua; Chen, Xuan-Rong; Liu, Jian-Lan; Guo, Ping-Chun; Ren, Xiao-Ming","Two magnetic phase transitions, driven by symmetry breaking and isostructural phase transitions, in a nickel-bis-dithiolene spin system","New Journal of Chemistry","2014","38","1","179","","10.1039/c3nj01101a","","","0.71073","MoKα","","0.0852","0.0467","","","0.1011","0.1169","","","","","","1.024","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053954","7.8725","0.0009","17.8806","0.0017","15.1206","0.0016","90","","99.488","0.011","90","","2099.3","0.4","353","2","353","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H5 D6 N6 Ni S4 -","- C16 H5 D6 N6 Ni S4 -","- C64 H20 D24 N24 Ni4 S16 -","4","1","","Ning, Wei-Hua; Chen, Xuan-Rong; Liu, Jian-Lan; Guo, Ping-Chun; Ren, Xiao-Ming","Two magnetic phase transitions, driven by symmetry breaking and isostructural phase transitions, in a nickel-bis-dithiolene spin system","New Journal of Chemistry","2014","38","1","179","","10.1039/c3nj01101a","","","0.71073","MoKα","","0.1275","0.065","","","0.1672","0.2022","","","","","","1.024","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053955","7.508","0.0004","9.0339","0.0007","12.3483","0.0007","82.421","0.005","87.073","0.004","65.899","0.006","757.85","0.09","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H16 O2 -","- C22 H16 O2 -","- C44 H32 O4 -","2","1","","Badave, Kirti D.; Patil, Shalaka S.; Khan, Ayesha A.; Srinivas, Darbha; Butcher, Raymond J.; Gonnade, Rajesh G.; Puranik, Vedavati G.; Pinjari, Rahul V.; Gejji, Shridhar P.; Rane, Sandhya Y.","Cu(ii) conjugation along the transformation of a vitamin K3 derivative to a dinaphthoquinone methide radical","New Journal of Chemistry","2014","38","1","277","","10.1039/c3nj00783a","","","1.54184","CuKα","","0.0523","0.0489","","","0.1381","0.142","","","","","","1.068","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053956","8.152","0.003","10.886","0.004","14.782","0.005","90","","90","","90","","1311.8","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 Dy O6 -","- C11 H15 Dy O6 -","- C44 H60 Dy4 O24 -","4","1","","Sun, Ming-Ling; Zhang, Xin; Huang, Yuan-Yuan; Lin, Qi-Pu; Qin, Ye-Yan; Yao, Yuan-Gen","Homochiral 3D lanthanide camphorates with high thermal stability","New Journal of Chemistry","2014","38","1","55","","10.1039/c3nj00981e","","","0.71073","MoKα","","0.0314","0.0293","","","0.0742","0.0754","","","","","","1.068","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053957","8.1178","0.0005","10.9087","0.0007","14.7493","0.001","90","","90","","90","","1306.12","0.15","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 Er O6 -","- C11 H15 Er O6 -","- C44 H60 Er4 O24 -","4","1","","Sun, Ming-Ling; Zhang, Xin; Huang, Yuan-Yuan; Lin, Qi-Pu; Qin, Ye-Yan; Yao, Yuan-Gen","Homochiral 3D lanthanide camphorates with high thermal stability","New Journal of Chemistry","2014","38","1","55","","10.1039/c3nj00981e","","","0.71073","MoKα","","0.0381","0.0352","","","0.0826","0.0844","","","","","","1.173","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053958","8.1824","0.0003","10.8837","0.0005","14.7894","0.0009","90","","90","","90","","1317.07","0.11","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 Ho O6 -","- C11 H15 Ho O6 -","- C44 H60 Ho4 O24 -","4","1","","Sun, Ming-Ling; Zhang, Xin; Huang, Yuan-Yuan; Lin, Qi-Pu; Qin, Ye-Yan; Yao, Yuan-Gen","Homochiral 3D lanthanide camphorates with high thermal stability","New Journal of Chemistry","2014","38","1","55","","10.1039/c3nj00981e","","","0.71073","MoKα","","0.0341","0.032","","","0.0731","0.0747","","","","","","1.054","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053959","32.8046","0.0013","7.5551","0.0007","16.8736","0.0014","90","0.004","104.401","0.003","90","0.003","4050.6","0.5","150","2","150","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C18.5 H16 Cl N3 Ni O2 S3 -","- C18.5 H16 Cl N3 Ni O2 S3 -","- C148 H128 Cl8 N24 Ni8 O16 S24 -","8","2","","Diwan, Kiran; Chauhan, Ratna; Singh, Santosh K.; Singh, Bandana; Drew, Michael G. B.; Bahadur, Lal; Singh, Nanhai","Light harvesting properties of some new heteroleptic dithiocarbimate‒diamine/diimine complexes of Ni, Pd and Pt studied as photosensitizer in dye-sensitized TiO2 solar cells","New Journal of Chemistry","2014","38","1","97","","10.1039/c3nj00507k","","","0.71073","MoKα","","0.1484","0.0658","","","0.1271","0.1484","","","","","","0.849","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053960","8.1369","0.0005","31.497","0.002","15.4964","0.0013","90","","99.381","0.006","90","","3918.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 N3 O2 Pd S3 -","- C18 H15 N3 O2 Pd S3 -","- C144 H120 N24 O16 Pd8 S24 -","8","2","","Diwan, Kiran; Chauhan, Ratna; Singh, Santosh K.; Singh, Bandana; Drew, Michael G. B.; Bahadur, Lal; Singh, Nanhai","Light harvesting properties of some new heteroleptic dithiocarbimate‒diamine/diimine complexes of Ni, Pd and Pt studied as photosensitizer in dye-sensitized TiO2 solar cells","New Journal of Chemistry","2014","38","1","97","","10.1039/c3nj00507k","","","0.71073","MoKα","","0.2011","0.0901","","","0.1508","0.1688","","","","","","0.919","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053961","12.4574","0.0013","15.641","0.0015","9.7801","0.001","90","","94.84","0.01","90","","1898.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H23 N3 O2 Pd S3 -","- C14 H23 N3 O2 Pd S3 -","- C56 H92 N12 O8 Pd4 S12 -","4","1","","Diwan, Kiran; Chauhan, Ratna; Singh, Santosh K.; Singh, Bandana; Drew, Michael G. B.; Bahadur, Lal; Singh, Nanhai","Light harvesting properties of some new heteroleptic dithiocarbimate‒diamine/diimine complexes of Ni, Pd and Pt studied as photosensitizer in dye-sensitized TiO2 solar cells","New Journal of Chemistry","2014","38","1","97","","10.1039/c3nj00507k","","","0.71073","MoKα","","0.1595","0.1","","","0.2635","0.3099","","","","","","1.064","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053962","17.4587","0.0017","5.3231","0.0006","25.758","0.002","90","","106.132","0.002","90","","2299.5","0.4","296.1","","296.1","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 S7 -","- C22 H18 S7 -","- C88 H72 S28 -","4","1","","Tsujimoto, Keijiro; Ogasawara, Reiko; Kishi, Yosuke; Fujiwara, Hideki","TTF‒fluorene dyads and their M(CN)2− (M = Ag, Au) salts designed for photoresponsive conducting materials","New Journal of Chemistry","2014","38","1","406","","10.1039/c3nj00979c","","","0.71075","MoKα","","","0.0547","","","","0.085","","","","","","0.877","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053963","4.8941","0.0011","29.077","0.007","16.27","0.004","90","","90.862","0.003","90","","2315.1","1","293.1","","293.1","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Ag0.5 N S6 -","- C24 H16 Ag0.5 N S6 -","- C96 H64 Ag2 N4 S24 -","4","1","","Tsujimoto, Keijiro; Ogasawara, Reiko; Kishi, Yosuke; Fujiwara, Hideki","TTF‒fluorene dyads and their M(CN)2− (M = Ag, Au) salts designed for photoresponsive conducting materials","New Journal of Chemistry","2014","38","1","406","","10.1039/c3nj00979c","","","0.7107","MoKα","","","0.042","","","","0.046","","","","","","1.112","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053964","4.8963","0.0016","29.144","0.01","16.156","0.006","90","","90.918","0.004","90","","2305.1","1.4","293.1","","293.1","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Au0.5 N S6 -","- C24 H16 Au0.5 N S6 -","- C96 H64 Au2 N4 S24 -","4","1","","Tsujimoto, Keijiro; Ogasawara, Reiko; Kishi, Yosuke; Fujiwara, Hideki","TTF‒fluorene dyads and their M(CN)2− (M = Ag, Au) salts designed for photoresponsive conducting materials","New Journal of Chemistry","2014","38","1","406","","10.1039/c3nj00979c","","","0.7107","MoKα","","","0.0473","","","","0.0482","","","","","","1.184","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053965","11.2202","0.0002","6.1966","0.0004","31.8009","0.001","90","","109.409","0.002","90","","2085.37","0.16","130","2","130","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Compound KO3","(E)-3-[(3-hydroxypropylamino)-phenylmethylidene]-1,3-dihydro-2H- 1-phenylpyrido[2,3-b]pyrrolo[2,3-e]pyrazin-2-one monohydrate","","- C25 H23 N5 O3 -","- C25 H23 N5 O3 -","- C100 H92 N20 O12 -","4","1","","Ostrowska, Katarzyna; Kaźmierska, Alicja; Rąpała-Kozik, Maria; Kalinowska-Tłuścik, Justyna","Ratiometric fluorescent Zn2+ and In3+ receptors of fused pyrazine with an aminopropanol chain in acetonitrile","New Journal of Chemistry","2014","38","1","213","","10.1039/c3nj00750b","","","0.71073","MoKα","","0.0984","0.0615","","","0.1642","0.1859","","","","","","1.038","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053966","9.1766","0.0001","11.1148","0.0001","21.7846","0.0002","90","","106.341","0.001","90","","2132.19","0.04","110","2","110","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-1-benzyl-3-[(3-hydroxypropylamino)-phenylmethylidene]-1,3-dihydro-2H- pyrido[2,3-b]pyrrolo[3,2-e]pyrazin-2-one- pyrido[3,4-b]pyrrolo[3,2-e]pyrazin-2-one","","- C26 H23 N5 O2 -","- C26 H23 N5 O2 -","- C104 H92 N20 O8 -","4","1","","Ostrowska, Katarzyna; Kaźmierska, Alicja; Rąpała-Kozik, Maria; Kalinowska-Tłuścik, Justyna","Ratiometric fluorescent Zn2+ and In3+ receptors of fused pyrazine with an aminopropanol chain in acetonitrile","New Journal of Chemistry","2014","38","1","213","","10.1039/c3nj00750b","","","0.71073","MoKα","","0.0498","0.0392","","","0.0952","0.1026","","","","","","1.034","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053967","13.2941","0.0005","4.6884","0.0002","21.0334","0.001","90","","90","","90","","1310.97","0.1","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","Compound 2","","","- C10 H18 Cl2 N2 -","- C10 H18 Cl2 N2 -","- C40 H72 Cl8 N8 -","4","1","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.0983","0.0509","","","0.1092","0.1306","","","","","","1.021","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053968","5.6218","0.0002","26.6363","0.0011","6.831","0.0002","90","","113.898","0.002","90","","935.2","0.06","173","2","173","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","Compound 3","","","- C20 H22 Cl2 N2 -","- C20 H22 Cl2 N2 -","- C40 H44 Cl4 N4 -","2","1","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.0473","0.0387","","","0.0841","0.0894","","","","","","1.063","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053969","13.7371","0.00004","6.922","0.0002","20.0985","0.00059","90","","90","","90","","1911.13","0.08","293","2","293","2","","","","","","","synthesis as described","4","P c a b","-P 2bc 2ac","61","Compound 3","","","- C20 H22 Cl2 N2 -","- C20 H22 Cl2 N2 -","- C80 H88 Cl8 N8 -","4","0.5","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.2867","0.2517","","","0.6082","0.6407","","","","","","2.986","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053970","11.6141","0.0003","17.4168","0.0005","21.0756","0.0008","90","","90","","90","","4263.2","0.2","293","2","293","2","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","Compound 10","","","- C12 H26 Al2 Cl4 N2 -","- C12 H26 Al2 Cl4 N2 -","- C96 H208 Al16 Cl32 N16 -","8","1","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.212","0.0876","","","0.2039","0.2776","","","","","","1.019","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053971","6.988","0.01","23.822","0.02","9.334","0.05","90","0.009","101.68","","90","0.009","1522","9","293","2","293","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","Compound 11","","","- C28 H30 Al Cl4 N3 -","- C28 H30 Al Cl4 N3 -","- C56 H60 Al2 Cl8 N6 -","2","1","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.0938","0.0617","","","0.1446","0.1627","","","","","","1.031","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053972","10.9102","0.0003","20.2966","0.0005","21.7692","0.0007","90","","90","","90","","4820.6","0.2","293","2","293","2","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","Compound 14[AlCl4]","","","- C16 H30 Al Cl4 N3 -","- C16 H30 Al Cl4 N3 -","- C128 H240 Al8 Cl32 N24 -","8","1","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.2139","0.0881","","","0.1997","0.2505","","","","","","1.018","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7053973","13.533","0.002","11.4237","0.0013","18.787","0.002","90","","125.466","0.008","90","","2365.5","0.6","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","Compound 14[I3]","","","- C16 H30 I3 N3 -","- C16 H30 I3 N3 -","- C64 H120 I12 N12 -","4","1","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.205","0.109","","","0.2556","0.3658","","","","","","1.15","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053974","6.9619","0.0002","13.4095","0.0005","35.1631","0.0009","90","","90","","90","","3282.67","0.18","173","2","173","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","Compound 17","","","- C28 H38 Cl5 In N2 O2 -","- C28 H38 Cl5 In N2 O2 -","- C112 H152 Cl20 In4 N8 O8 -","4","1","","Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina","1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides","New Journal of Chemistry","2014","38","1","391","","10.1039/c3nj01226c","","x-ray","0.71073","MoKα","","0.1719","0.0707","","","0.1152","0.1444","","","","","","0.994","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053975","8.0012","0.0005","11.8726","0.0007","14.0979","0.0009","90","","104.441","0.001","90","","1296.92","0.14","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Hydrazinium_nitroformate","","","- C H5 N5 O6 -","- C H5 N5 O6 -","- C8 H40 N40 O48 -","8","2","","Joo, Young-Hyuk; Min, Byoung Sun","Denitration of hydrazinium nitroformate to form hydrazinium dinitromethanide","New Journal of Chemistry","2014","38","1","50","","10.1039/c3nj01203d","","","0.71073","MoKα","","0.0525","0.039","","","0.0938","0.1","","","","","","0.989","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053976","3.701","0.003","13.875","0.011","10.753","0.009","90","","98.833","0.009","90","","545.6","0.8","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Hydrazinium_dinitromethanide","","","- C H6 N4 O4 -","- C H6 N4 O4 -","- C4 H24 N16 O16 -","4","1","","Joo, Young-Hyuk; Min, Byoung Sun","Denitration of hydrazinium nitroformate to form hydrazinium dinitromethanide","New Journal of Chemistry","2014","38","1","50","","10.1039/c3nj01203d","","","0.71073","MoKα","","0.1428","0.0415","","","0.0843","0.1064","","","","","","0.856","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053977","9.2673","0.0002","10.8959","0.0003","15.1558","0.0005","94.759","0.001","91.357","0.001","105.731","0.001","1466.27","0.07","115","","115","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H29 F6 N5 O8 S2 -","- C24 H29 F6 N5 O8 S2 -","- C48 H58 F12 N10 O16 S4 -","2","1","","Ranyuk, Elena; Ermakova, Elizaveta V.; Bovigny, Laura; Meyer, Michel; Bessmertnykh-Lemeune, Alla; Guilard, Roger; Rousselin, Yoann; Tsivadze, Aslan Yu.; Arslanov, Vladimir V.","Towards sensory Langmuir monolayers consisting of macrocyclic pentaaminoanthraquinone","New Journal of Chemistry","2014","38","1","317","","10.1039/c3nj01121f","","x-ray","0.71073","MoKα~1~","K-L~3~","0.0841","0.0443","","","0.0993","0.1146","","","","","","1.026","","","","has coordinates","190386","2020-10-21","18:00:00",""
"7053978","7.1884","0.0002","11.2777","0.0003","16.3837","0.0006","107.004","0.002","93.659","0.002","102.998","0.001","1225.57","0.07","115","","115","","","","","","","","","6","P -1","-P 1","2","","","","- C23 H30 F3 N5 O6 S -","- C23 H30 F3 N5 O6 S -","- C46 H60 F6 N10 O12 S2 -","2","1","","Ranyuk, Elena; Ermakova, Elizaveta V.; Bovigny, Laura; Meyer, Michel; Bessmertnykh-Lemeune, Alla; Guilard, Roger; Rousselin, Yoann; Tsivadze, Aslan Yu.; Arslanov, Vladimir V.","Towards sensory Langmuir monolayers consisting of macrocyclic pentaaminoanthraquinone","New Journal of Chemistry","2014","38","1","317","","10.1039/c3nj01121f","","x-ray","0.71073","MoKα~1~","K-L~3~","0.1635","0.0976","","","0.2758","0.3203","","","","","","1.079","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053979","14.6062","0.0015","17.4899","0.0016","13.2962","0.0015","90","","90","","90","","3396.7","0.6","296","2","296","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- B10 O21 Pb4 Zn2 -","- B10 O21 Pb4 Zn2 -","- B80 O168 Pb32 Zn16 -","8","1","","Yu, Hongwei; Wu, Hongping; Pan, Shilie; Zhang, Bingbing; Dong, Lingyun; Han, Shujuan; Yang, Zhihua","Pb4Zn2B10O21: a congruently melting lead zinc borate with a novel [B10O24] anionic group and an interesting [Pb4O12]∞chain","New Journal of Chemistry","2014","38","1","285","","10.1039/c3nj00893b","","","0.71073","MoKα","","0.0488","0.0289","","","0.0623","0.0702","","","","","","1.03","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053980","16.5929","0.0016","16.5929","0.0016","33.137","0.005","90","","90","","120","","7901.1","1.6","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","{[Cu2(1-tza)4].Br.H3O.1/3H2O}","[Cu2(1-tza)4]BrH3O1/3H2O","","- C12 H15.67 Br Cu2 N16 O9.33 -","- C12 H12 Br Cu2 N16 O9.33333 -","- C108 H108 Br9 Cu18 N144 O84 -","9","0.5","","Chen, Jun; Wang, Shuai-Hua; Liu, Zhi-Fa; Wu, Mei-Feng; Xiao, Yu; Zheng, Fa-Kun; Guo, Guo-Cong; Huang, Jin-Shun","Anion-directed self-assembly of Cu(ii) coordination compounds with tetrazole-1-acetic acid: syntheses in ionic liquids and crystal structures","New Journal of Chemistry","2014","38","1","269","","10.1039/c3nj01198d","","","0.71073","MoKα","","0.0631","0.0496","","","0.1663","0.1779","","","","","","1.024","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053981","24.074","0.004","24.074","0.004","5.1021","0.0016","90","","90","","90","","2957","1.2","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","[Cu2(1-tza)4]BF4.H3O.H2O","","","- C12 H19 B Cu2 F4 N16 O10 -","- C12 H12 B Cu2 F4 N16 O10 -","- C48 H48 B4 Cu8 F16 N64 O40 -","4","0.25","","Chen, Jun; Wang, Shuai-Hua; Liu, Zhi-Fa; Wu, Mei-Feng; Xiao, Yu; Zheng, Fa-Kun; Guo, Guo-Cong; Huang, Jin-Shun","Anion-directed self-assembly of Cu(ii) coordination compounds with tetrazole-1-acetic acid: syntheses in ionic liquids and crystal structures","New Journal of Chemistry","2014","38","1","269","","10.1039/c3nj01198d","","","0.71073","MoKα","","0.0862","0.0666","","","0.171","0.1875","","","","","","1.095","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053982","6.537","0.002","9.314","0.003","11.282","0.004","108.282","0.003","99.043","0.004","98.41","0.002","630","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Cu(Ì2-Cl)(1-tza)(1-Htza)(H2O)].1/2H2O","","","- C6 H10 Cl Cu N8 O5.5 -","- C6 H9 Cl Cu N8 O5.5 -","- C12 H18 Cl2 Cu2 N16 O11 -","2","1","","Chen, Jun; Wang, Shuai-Hua; Liu, Zhi-Fa; Wu, Mei-Feng; Xiao, Yu; Zheng, Fa-Kun; Guo, Guo-Cong; Huang, Jin-Shun","Anion-directed self-assembly of Cu(ii) coordination compounds with tetrazole-1-acetic acid: syntheses in ionic liquids and crystal structures","New Journal of Chemistry","2014","38","1","269","","10.1039/c3nj01198d","","","0.71073","MoKα","","0.0367","0.0299","","","0.0787","0.0958","","","","","","1.078","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053983","8.8662","0.0006","10.172","0.0006","16.634","0.0011","90","","90","","90","","1500.17","0.17","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[CuCl2(1-Htza)2(H2O)].H2O","","","- C6 H12 Cl2 Cu N8 O6 -","- C6 H12 Cl2 Cu N8 O6 -","- C24 H48 Cl8 Cu4 N32 O24 -","4","1","","Chen, Jun; Wang, Shuai-Hua; Liu, Zhi-Fa; Wu, Mei-Feng; Xiao, Yu; Zheng, Fa-Kun; Guo, Guo-Cong; Huang, Jin-Shun","Anion-directed self-assembly of Cu(ii) coordination compounds with tetrazole-1-acetic acid: syntheses in ionic liquids and crystal structures","New Journal of Chemistry","2014","38","1","269","","10.1039/c3nj01198d","","","0.71073","MoKα","","0.0492","0.0392","","","0.0769","0.0809","","","","","","1.004","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053984","26.882","0.016","6.802","0.003","7.981","0.007","90","","103.38","0.03","90","","1419.7","1.6","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","[CuCl2(1-Htza)2].H2O","","","- C6 H10 Cl2 Cu N8 O5 -","- C6 H10 Cl2 Cu N8 O5 -","- C24 H40 Cl8 Cu4 N32 O20 -","4","1","","Chen, Jun; Wang, Shuai-Hua; Liu, Zhi-Fa; Wu, Mei-Feng; Xiao, Yu; Zheng, Fa-Kun; Guo, Guo-Cong; Huang, Jin-Shun","Anion-directed self-assembly of Cu(ii) coordination compounds with tetrazole-1-acetic acid: syntheses in ionic liquids and crystal structures","New Journal of Chemistry","2014","38","1","269","","10.1039/c3nj01198d","","","0.71073","MoKα","","0.0356","0.0334","","","0.0845","0.0864","","","","","","1.01","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053985","10.8546","0.0005","7.6314","0.0004","36.279","0.003","90","","95.896","0.005","90","","2989.3","0.3","180","2","180","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C33 H32 B F4 Fe N2 P S -","- C33 H32 B F4 Fe N2 P S -","- C132 H128 B4 F16 Fe4 N8 P4 S4 -","4","1","","Loxq, Pauline; Debono, Nathalie; Gülcemal, Süleyman; Daran, Jean-Claude; Manoury, Eric; Poli, Rinaldo; Çetinkaya, Bekir; Labande, Agnès","Palladium(ii) complexes with planar chiral ferrocenyl phosphane‒(benz)imidazol-2-ylidene ligands","New Journal of Chemistry","2014","38","1","338","","10.1039/c3nj00863k","","","0.71073","MoKα","","0.0893","0.0818","","","0.173","0.1766","","","","","","1.235","","","","has coordinates,has disorder","180093","2020-10-21","18:00:00",""
"7053986","25.6211","0.0011","9.1","0.0004","34.974","0.0013","90","","98.942","0.002","90","","8055.2","0.6","180","2","180","2","","","","","","","","10","C 1 2/c 1","-C 2yc","15","","","","- C44.5 H48 B Cl F4 Fe N2 O0.5 P S -","- C42 H42 B F4 Fe N2 P S -","- C336 H336 B8 F32 Fe8 N16 P8 S8 -","8","1","","Loxq, Pauline; Debono, Nathalie; Gülcemal, Süleyman; Daran, Jean-Claude; Manoury, Eric; Poli, Rinaldo; Çetinkaya, Bekir; Labande, Agnès","Palladium(ii) complexes with planar chiral ferrocenyl phosphane‒(benz)imidazol-2-ylidene ligands","New Journal of Chemistry","2014","38","1","338","","10.1039/c3nj00863k","","","0.71073","MoKα","","0.0471","0.0389","","","0.0988","0.1029","","","","","","1.076","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053987","31.0431","0.001","9.7619","0.0003","12.6606","0.0004","90","","95.076","0.002","90","","3821.6","0.2","293","2","293","2","","","","","","","","8","C 1 2 1","C 2y","5","","","","- C39.5 H43 Cl5 Fe N2 O0.5 P Pd -","- C37 H33 Cl4 Fe N2 P Pd -","- C148 H132 Cl16 Fe4 N8 P4 Pd4 -","4","1","","Loxq, Pauline; Debono, Nathalie; Gülcemal, Süleyman; Daran, Jean-Claude; Manoury, Eric; Poli, Rinaldo; Çetinkaya, Bekir; Labande, Agnès","Palladium(ii) complexes with planar chiral ferrocenyl phosphane‒(benz)imidazol-2-ylidene ligands","New Journal of Chemistry","2014","38","1","338","","10.1039/c3nj00863k","","","0.71073","MoKα","","0.0326","0.0286","","","0.0732","0.0749","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053988","11.8749","0.0003","15.7967","0.0004","16.9843","0.0004","90","","100.01","0.002","90","","3137.49","0.14","180","2","180","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C67.5 H65 Cl4 Fe2 N4 O0.5 P2 Pd2 -","- C66 H62 Cl4 Fe2 N4 P2 Pd2 -","- C132 H124 Cl8 Fe4 N8 P4 Pd4 -","2","1","","Loxq, Pauline; Debono, Nathalie; Gülcemal, Süleyman; Daran, Jean-Claude; Manoury, Eric; Poli, Rinaldo; Çetinkaya, Bekir; Labande, Agnès","Palladium(ii) complexes with planar chiral ferrocenyl phosphane‒(benz)imidazol-2-ylidene ligands","New Journal of Chemistry","2014","38","1","338","","10.1039/c3nj00863k","","","0.71073","MoKα","","0.0339","0.0294","","","0.0702","0.0727","","","","","","1.07","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053989","10.6863","0.0008","13.7235","0.0009","13.9621","0.0009","75.975","0.006","77.655","0.006","70.728","0.006","1855.1","0.2","180","2","180","2","","","","","","","","8","P -1","-P 1","2","","","","- C42.5 H43 Cl2 Fe N2 O0.5 P Pd -","- C42 H41 Cl2 Fe N2 P Pd -","- C84 H82 Cl4 Fe2 N4 P2 Pd2 -","2","1","","Loxq, Pauline; Debono, Nathalie; Gülcemal, Süleyman; Daran, Jean-Claude; Manoury, Eric; Poli, Rinaldo; Çetinkaya, Bekir; Labande, Agnès","Palladium(ii) complexes with planar chiral ferrocenyl phosphane‒(benz)imidazol-2-ylidene ligands","New Journal of Chemistry","2014","38","1","338","","10.1039/c3nj00863k","","","0.71073","MoKα","","0.091","0.0594","","","0.116","0.1271","","","","","","1.006","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7053990","7.8506","0.0001","21.874","0.0004","8.1508","0.0002","90","","103.012","0.0006","90","","1363.75","0.05","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","aqua-bis(4-methylpyridine)-bis(3-nitrobenzoate) copper(ii)","","- C26 H22 Cu N4 O8 -","- C26 H22 Cu N4 O8 -","- C52 H44 Cu2 N8 O16 -","2","0.5","","Sharma, Raj Pal; Saini, Anju; Monga, Divyakshi; Venugopalan, Paloth; Jezierska, Julia; Ozarowski, Andrew; Ferretti, Valeria","Influence of nitrogen donor ligands on the coordination modes of copper(ii) 2-nitrobenzoate complexes: structures, DFT calculations and magnetic properties","New Journal of Chemistry","2014","38","1","437","","10.1039/c3nj00736g","","","0.71073","MoKα","","0.0472","0.038","","","0.1063","0.1148","","","","","","1.077","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053991","8.002","0.0002","12.2397","0.0003","14.518","0.0003","90","","105.179","0.0011","90","","1372.32","0.06","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Cu N4 O10 -","- C26 H26 Cu N4 O10 -","- C52 H52 Cu2 N8 O20 -","2","0.5","","Sharma, Raj Pal; Saini, Anju; Monga, Divyakshi; Venugopalan, Paloth; Jezierska, Julia; Ozarowski, Andrew; Ferretti, Valeria","Influence of nitrogen donor ligands on the coordination modes of copper(ii) 2-nitrobenzoate complexes: structures, DFT calculations and magnetic properties","New Journal of Chemistry","2014","38","1","437","","10.1039/c3nj00736g","","","0.71073","MoKα","","0.0599","0.043","","","0.1217","0.1358","","","","","","1.016","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053992","7.6633","0.0002","27.2585","0.0007","8.584","0.0002","90","","117.584","0.0011","90","","1589.29","0.07","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","bis(mu2-(2-hydroxyethylamino ethanolato)-bis(2-nitrobenzoate)-di copper(II)dihydrate","","- C26 H40 Cu2 N4 O16 -","- C26 H40 Cu2 N4 O16 -","- C52 H80 Cu4 N8 O32 -","2","0.5","","Sharma, Raj Pal; Saini, Anju; Monga, Divyakshi; Venugopalan, Paloth; Jezierska, Julia; Ozarowski, Andrew; Ferretti, Valeria","Influence of nitrogen donor ligands on the coordination modes of copper(ii) 2-nitrobenzoate complexes: structures, DFT calculations and magnetic properties","New Journal of Chemistry","2014","38","1","437","","10.1039/c3nj00736g","","","0.71073","MoKα","","0.0538","0.0454","","","0.1304","0.1415","","","","","","0.99","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7053993","9.39","0.005","10.293","0.005","10.426","0.005","101.979","0.004","108.296","0.005","106.798","0.005","865.2","0.8","110","0.1","110","0.2","","","","","","","","6","P -1","-P 1","2","[CuL2](ClO4)2","","","- C30 H40 Cl2 Cu N8 O12 -","- C30 H40 Cl2 Cu N8 O12 -","- C30 H40 Cl2 Cu N8 O12 -","1","0.5","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.71073","MoKα","","0.0274","0.0249","","","0.0661","0.0678","","","","","","1.047","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053994","9.383","0.005","10.299","0.008","11.3","0.009","70.19","0.04","66.08","0.03","73.3","0.05","924.7","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[CuL3](ClO4)2","","","- C32 H44 Cl2 Cu N8 O14 -","- C32 H44 Cl2 Cu N8 O14 -","- C32 H44 Cl2 Cu N8 O14 -","1","0.5","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.71073","MoKα","","0.0385","0.0344","","","0.0806","0.0839","","","","","","1.062","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053995","26.3848","0.0004","18.7279","0.0003","27.6457","0.0006","90","","143.259","0.001","90","","8171.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[CuL4](ClO4)2, DMF","","","- C33 H45 Cl4 Cu N9 O13 -","- C33 H45 Cl4 Cu N9 O13 -","- C264 H360 Cl32 Cu8 N72 O104 -","8","2","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.7107","MoKα","","0.058","0.04","","","0.0947","0.1075","","","","","","1.025","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7053996","13.8278","0.0005","14.1824","0.0005","16.083","0.0007","89.792","0.004","78.263","0.004","87.476","0.002","3085.1","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[CuL7(MCN)](ClO4)2","","","- C25 H31 Cl2 Cu N9 O8 -","- C25 H31 Cl2 Cu N9 O8 -","- C100 H124 Cl8 Cu4 N36 O32 -","4","2","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.71073","MoKα","","0.1138","0.0864","","","0.2113","0.2355","","","","","","1.212","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053997","10.806","0.003","12.898","0.003","14.296","0.003","80.451","0.01","85.534","0.014","73.186","0.012","1880","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[CuL8(DMF)2](ClO4)2","","","- C31 H46 Cl2 Cu N10 O12 -","- C31 H46 Cl2 Cu N10 O12 -","- C62 H92 Cl4 Cu2 N20 O24 -","2","1","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.71073","MoKα","","0.0602","0.0473","","","0.1067","0.1139","","","","","","1.063","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7053998","10.573","0.004","10.596","0.004","16.788","0.005","73.602","0.004","79.087","0.005","60.693","0.003","1570.4","1","100","2","100","","","","","","","","synthesis as described","6","P -1","-P 1","2","[CuL5(MeCN)](ClO4)2","","","- C26 H33 Cl2 Cu N9 O8 -","- C26 H33 Cl2 Cu N9 O8 -","- C52 H66 Cl4 Cu2 N18 O16 -","2","1","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","x-ray","0.71073","MoKα","","0.0439","0.0347","","","0.0795","0.0854","","","","","","1.052","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7053999","14.8356","0.0004","25.4907","0.0006","8.1556","0.0002","90","","90","","90","","3084.2","0.13","100","2","100","2","","","","","","","","6","C m c 21","C 2c -2","36","[CuL6(ClO4)](ClO4)","","","- C25 H32 Cl2 Cu N8 O8 -","- C25 H32 Cl2 Cu N8 O8 -","- C100 H128 Cl8 Cu4 N32 O32 -","4","0.5","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.71073","MoKα","","0.0508","0.0465","","","0.1239","0.1365","","","","","","1.192","","","","has coordinates","180093","2020-10-21","18:00:00",""
"7054000","9.1849","0.0015","9.2931","0.0008","11.8913","0.0012","98.876","0.004","108.784","0.005","105.48","0.006","893.4","0.2","110","2","110","2","","","","","","","","6","P -1","-P 1","2","[CuL1](ClO4)2","","","- C32 H44 Cl2 Cu N8 O12 -","- C32 H44 Cl2 Cu N8 O12 -","- C32 H44 Cl2 Cu N8 O12 -","1","0.5","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.71073","MoKα","","0.0286","0.0265","","","0.0684","0.0696","","","","","","1.041","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054001","10.9","0.004","11.582","0.003","16.395","0.003","71.824","0.011","79.864","0.015","68.647","0.012","1826.9","0.9","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H46 Cl2 N8 O14 -","- C30 H46 Cl2 N8 O14 -","- C60 H92 Cl4 N16 O28 -","2","1","","Benkhellat, Zakia; Allali, Mustapha; Beley, Marc; Wenger, Emmanuel; Bernard, Maxime; Parizel, Nathalie; Selmeczi, Katalin; Joly, Jean-Pierre","Click synthesis of symmetric bis-triazol ligands and full characterisation of their copper(ii)-complexes","New Journal of Chemistry","2014","38","1","419","","10.1039/c3nj00570d","","","0.71073","MoKα","","0.0968","0.0706","","","0.1638","0.1779","","","","","","1.118","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054002","6.9499","0.0005","9.4914","0.0007","13.2856","0.0011","104.262","0.007","91.624","0.006","100.777","0.006","831.83","0.12","132","2","132","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C20 H19 F N2 O3 -","- C20 H19 F N2 O3 -","- C40 H38 F2 N4 O6 -","2","1","","Maldonado-Domínguez, Mauricio; Arcos-Ramos, Rafael; Romero, Margarita; Flores-Pérez, Blas; Farfán, Norberto; Santillan, Rosa; Lacroix, Pascal G.; Malfant, Isabelle","The amide bridge in donor‒acceptor systems: delocalization depends on push‒pull stress","New Journal of Chemistry","2014","38","1","260","","10.1039/c3nj01176c","","x-ray","0.71073","MoKα","","0.0896","0.0493","","","0.1178","0.132","","","","","","0.933","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054003","8.4489","0.0004","8.9514","0.0004","12.9033","0.0007","92.3649","0.003","104.602","0.0025","92.5782","0.003","942","0.08","173","2","173","2","","","","","","","synthesis as described","4","P -1","-P 1","2","Compound X","","","- C22 H22 N2 O5 -","- C22 H22 N2 O5 -","- C44 H44 N4 O10 -","2","1","","Maldonado-Domínguez, Mauricio; Arcos-Ramos, Rafael; Romero, Margarita; Flores-Pérez, Blas; Farfán, Norberto; Santillan, Rosa; Lacroix, Pascal G.; Malfant, Isabelle","The amide bridge in donor‒acceptor systems: delocalization depends on push‒pull stress","New Journal of Chemistry","2014","38","1","260","","10.1039/c3nj01176c","","x-ray","0.71073","MoKα","","0.0702","0.049","","","0.1162","0.1302","","","","","","1.041","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054004","6.9026","0.0002","7.3751","0.0002","19.537","0.00059","81.8816","0.0018","82.0634","0.0018","65.3173","0.0018","891.18","0.05","298","2","298","2","","","","","","","synthesis as described","4","P -1","-P 1","2","Compound X","","","- C21 H19 N3 O3 -","- C21 H19 N3 O3 -","- C42 H38 N6 O6 -","2","1","","Maldonado-Domínguez, Mauricio; Arcos-Ramos, Rafael; Romero, Margarita; Flores-Pérez, Blas; Farfán, Norberto; Santillan, Rosa; Lacroix, Pascal G.; Malfant, Isabelle","The amide bridge in donor‒acceptor systems: delocalization depends on push‒pull stress","New Journal of Chemistry","2014","38","1","260","","10.1039/c3nj01176c","","x-ray","0.71073","MoKα","","0.0975","0.0685","","","0.1597","0.1789","","","","","","1.075","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054005","4.9427","0.0002","12.5574","0.0004","14.6612","0.0005","98.169","0.0021","99.3016","0.0019","92.6732","0.0019","886.65","0.06","298","2","298","2","","","","","","","synthesis as described","4","P -1","-P 1","2","Compound X","","","- C20 H19 N3 O5 -","- C20 H19 N3 O5 -","- C40 H38 N6 O10 -","2","1","","Maldonado-Domínguez, Mauricio; Arcos-Ramos, Rafael; Romero, Margarita; Flores-Pérez, Blas; Farfán, Norberto; Santillan, Rosa; Lacroix, Pascal G.; Malfant, Isabelle","The amide bridge in donor‒acceptor systems: delocalization depends on push‒pull stress","New Journal of Chemistry","2014","38","1","260","","10.1039/c3nj01176c","","x-ray","0.71073","MoKα","","0.0658","0.0482","","","0.1198","0.1323","","","","","","1.045","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054006","14.1051","0.0013","15.3365","0.0013","17.8162","0.0015","89.985","0.004","86.89","0.004","89.747","0.004","3848.3","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H58 Ce5 N4 O34 -","- C72 H58 Ce5 N4 O34 -","- C144 H116 Ce10 N8 O68 -","2","1","","D'Arras, Loïc; Sassoye, Capucine; Rozes, Laurence; Sanchez, Clément; Marrot, Jérôme; Marre, Samuel; Aymonier, Cyril","Fast and continuous processing of a new sub-micronic lanthanide-based metal‒organic framework","New Journal of Chemistry","2014","38","4","1477","","10.1039/c3nj01371e","","","0.71073","MoKα","","0.1738","0.16","","","0.3717","0.3781","","","","","","1.178","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054007","11.9767","0.0008","5.9302","0.0004","16.1269","0.001","90","","96.635","0.002","90","","1137.73","0.13","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C52 H40 N8 O12 -","4","1","","Madhuprasad,; Swathi, N.; Manjunatha, J. R.; Das, Uttam Kumar; Shetty, A. Nityananda; Trivedi, Darshak R.","Dual colorimetric receptor with logic gate operations: anion induced solvatochromism","New Journal of Chemistry","2014","38","4","1484","","10.1039/c3nj01229h","","","0.71073","MoKα","","0.0577","0.0523","","","0.1314","0.1485","","","","","","1.113","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054008","14.648","0.0002","10.8265","0.0002","14.7278","0.0002","90","","101.94","0.001","90","","2285.1","0.06","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H10 N2 O2 -","- C13 H10 N2 O2 -","- C104 H80 N16 O16 -","8","2","","Madhuprasad,; Swathi, N.; Manjunatha, J. R.; Das, Uttam Kumar; Shetty, A. Nityananda; Trivedi, Darshak R.","Dual colorimetric receptor with logic gate operations: anion induced solvatochromism","New Journal of Chemistry","2014","38","4","1484","","10.1039/c3nj01229h","","","0.71073","MoKα","","0.1054","0.0685","","","0.144","0.158","","","","","","1.099","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054009","17.158","0.003","17.158","0.003","15.91","0.005","90","","90","","90","","4683.9","1.9","100","2","100","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C48 H48 Co N12 O8 -","- C48 H48 Co N12 O8 -","- C192 H192 Co4 N48 O32 -","4","0.25","","Dey, Soumyajit; Ikbal, Sk Asif; Rath, Sankar Prasad","Self-assembly of cobalt(ii) and zinc(ii) tetranitrooctaethylporphyrin via bidentate axial ligands: synthesis, structure, surface morphology and effect of axial coordination","New Journal of Chemistry","2014","38","4","1458","","10.1039/c3nj01248d","","","0.71073","MoKα","","0.0771","0.0577","","","0.1446","0.1615","","","","","","1.047","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054010","12.274","0.005","13.707","0.005","18.913","0.005","107.964","0.005","104.161","0.005","98.063","0.005","2853.4","1.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C47.5 H49.5 Cl4.5 Co N12 O8 -","- C46 H48 Co N12 O8 -","- C92 H96 Co2 N24 O16 -","2","1","","Dey, Soumyajit; Ikbal, Sk Asif; Rath, Sankar Prasad","Self-assembly of cobalt(ii) and zinc(ii) tetranitrooctaethylporphyrin via bidentate axial ligands: synthesis, structure, surface morphology and effect of axial coordination","New Journal of Chemistry","2014","38","4","1458","","10.1039/c3nj01248d","","","0.71069","MoKα","","0.1188","0.0815","","","0.2135","0.24","","","","","","0.939","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054011","12.924","0.003","13.663","0.003","13.678","0.003","69.774","0.004","66.261","0.004","85.852","0.004","2068.3","0.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H90 N20 O16 Zn2 -","- C84 H90 N20 O16 Zn2 -","- C84 H90 N20 O16 Zn2 -","1","0.5","","Dey, Soumyajit; Ikbal, Sk Asif; Rath, Sankar Prasad","Self-assembly of cobalt(ii) and zinc(ii) tetranitrooctaethylporphyrin via bidentate axial ligands: synthesis, structure, surface morphology and effect of axial coordination","New Journal of Chemistry","2014","38","4","1458","","10.1039/c3nj01248d","","","0.71073","MoKα","","0.0799","0.0676","","","0.1885","0.1974","","","","","","1.065","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054012","13.9272","0.0019","37.718","0.005","11.317","0.0015","90","","110.296","0.002","90","","5575.8","1.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C99.6 H121.2 N20 O16 Zn2 -","- C84 H90 N20 O16 Zn2 -","- C168 H180 N40 O32 Zn4 -","2","0.5","","Dey, Soumyajit; Ikbal, Sk Asif; Rath, Sankar Prasad","Self-assembly of cobalt(ii) and zinc(ii) tetranitrooctaethylporphyrin via bidentate axial ligands: synthesis, structure, surface morphology and effect of axial coordination","New Journal of Chemistry","2014","38","4","1458","","10.1039/c3nj01248d","","","0.71073","MoKα","","0.0794","0.0524","","","0.1231","0.1334","","","","","","0.916","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054013","11.3631","0.0011","33.868","0.003","26.769","0.003","90","","101.816","0.002","90","","10083.6","1.7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C86 H92 Cl12 N20 O16 Zn2 -","- C82 H88 N20 O16 Zn2 -","- C328 H352 N80 O64 Zn8 -","4","1","","Dey, Soumyajit; Ikbal, Sk Asif; Rath, Sankar Prasad","Self-assembly of cobalt(ii) and zinc(ii) tetranitrooctaethylporphyrin via bidentate axial ligands: synthesis, structure, surface morphology and effect of axial coordination","New Journal of Chemistry","2014","38","4","1458","","10.1039/c3nj01248d","","","0.71073","MoKα","","0.1004","0.073","","","0.1836","0.202","","","","","","0.969","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054014","5.9624","0.0002","13.0786","0.0007","19.7678","0.001","92.174","0.004","95.89","0.004","90.352","0.004","1532.17","0.12","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H26 Fe2 -","- C36 H26 Fe2 -","- C72 H52 Fe4 -","2","1","","Misra, Rajneesh; Maragani, Ramesh; Jadhav, Thaksen; Mobin, Shaikh M.","Ferrocenyl end capped molecular rods: synthesis, structure, and properties","New Journal of Chemistry","2014","38","4","1446","","10.1039/c3nj01244a","","","0.71073","MoKα","","0.0441","0.0349","","","0.0904","0.0953","","","","","","1.061","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054015","14.6452","0.0003","10.2825","0.0002","14.8003","0.0003","90","","111.902","0.002","90","","2067.9","0.08","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 Fe2 -","- C28 H22 Fe2 -","- C112 H88 Fe8 -","4","1","","Misra, Rajneesh; Maragani, Ramesh; Jadhav, Thaksen; Mobin, Shaikh M.","Ferrocenyl end capped molecular rods: synthesis, structure, and properties","New Journal of Chemistry","2014","38","4","1446","","10.1039/c3nj01244a","","","0.71073","MoKα","","0.0647","0.0587","","","0.1534","0.1592","","","","","","1.055","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054016","10.1907","0.0012","7.5711","0.0003","20.759","0.003","90","","126.477","0.019","90","","1287.9","0.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C34 H26 Fe2 -","- C34 H26 Fe2 -","- C68 H52 Fe4 -","2","0.5","","Misra, Rajneesh; Maragani, Ramesh; Jadhav, Thaksen; Mobin, Shaikh M.","Ferrocenyl end capped molecular rods: synthesis, structure, and properties","New Journal of Chemistry","2014","38","4","1446","","10.1039/c3nj01244a","","","0.71073","MoKα","","0.1058","0.0987","","","0.2776","0.2822","","","","","","1.105","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054017","11.0972","0.0004","13.1305","0.0003","13.4256","0.0004","90","","112.67","0.004","90","","1805.13","0.11","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Fe Si -","- C21 H22 Fe Si -","- C84 H88 Fe4 Si4 -","4","1","","Misra, Rajneesh; Maragani, Ramesh; Jadhav, Thaksen; Mobin, Shaikh M.","Ferrocenyl end capped molecular rods: synthesis, structure, and properties","New Journal of Chemistry","2014","38","4","1446","","10.1039/c3nj01244a","","","0.71073","MoKα","","0.0366","0.0327","","","0.0803","0.0841","","","","","","1.029","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054018","10.2384","0.0003","10.6457","0.0004","14.4194","0.0005","88.562","0.003","78.624","0.003","69.948","0.003","1445.82","0.09","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H13 Fe I -","- C18 H13 Fe I -","- C72 H52 Fe4 I4 -","4","2","","Misra, Rajneesh; Maragani, Ramesh; Jadhav, Thaksen; Mobin, Shaikh M.","Ferrocenyl end capped molecular rods: synthesis, structure, and properties","New Journal of Chemistry","2014","38","4","1446","","10.1039/c3nj01244a","","","0.71073","MoKα","","0.019","0.0178","","","0.0443","0.0452","","","","","","1.032","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054019","9.3382","0.0004","27.1749","0.0012","12.0639","0.0005","90","","102.556","0.002","90","","2988.2","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C35 H36 N4 O4 -","- C35 H36 N4 O4 -","- C140 H144 N16 O16 -","4","2","","Dhara, Anamika; Jana, Atanu; Guchhait, Nikhil; Ghosh, Prasanta; Kar, Susanta K.","Rhodamine-based molecular clips for highly selective recognition of Al3+ ions: synthesis, crystal structure and spectroscopic properties","New Journal of Chemistry","2014","38","4","1627","","10.1039/c3nj01447a","","","0.71073","MoKα","","0.1231","0.0775","","","0.2001","0.2308","","","","","","1.121","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054020","8.5694","0.0006","9.3227","0.0004","8.4631","0.0009","90","","92.1","0.009","90","","675.66","0.09","295","0.2","295","0.2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H4 Cu N2 O4 -","- C5 H4 Cu N2 O4 -","- C20 H16 Cu4 N8 O16 -","4","1","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0619","0.0363","","","0.066","0.0714","","","","","","1.02","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054021","9.0343","0.0005","9.2812","0.0006","10.1736","0.0006","63.807","0.006","74.368","0.005","82.407","0.005","737.05","0.09","295","0.2","295","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 Cu N6 O7 -","- C8 H16 Cu N6 O7 -","- C16 H32 Cu2 N12 O14 -","2","1","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0404","0.0325","","","0.0695","0.0725","","","","","","1.056","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054022","19.423","0.0005","8.6184","0.0002","16.8313","0.0005","90","","90","","90","","2817.48","0.13","295","0.2","295","0.2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C10 H16 Cu N6 O5 -","- C10 H16 Cu N6 O5 -","- C80 H128 Cu8 N48 O40 -","8","1","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0401","0.0329","","","0.0858","0.0894","","","","","","1.036","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054023","7.2518","0.0002","8.3493","0.0003","20.456","0.0007","90","","90.762","0.003","90","","1238.45","0.07","295","0.2","295","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 Cu N4 O4 -","- C10 H12 Cu N4 O4 -","- C40 H48 Cu4 N16 O16 -","4","1","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0316","0.0265","","","0.07","0.0723","","","","","","1.067","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054024","15.979","0.001","11.31","0.0008","8.5968","0.0005","90","","94.62","0.006","90","","1548.59","0.17","295","0.2","295","0.2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H12 Cu N4 O4 -","- C16 H12 Cu N4 O4 -","- C64 H48 Cu4 N16 O16 -","4","0.5","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0337","0.0287","","","0.0708","0.0724","","","","","","1.057","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054025","9.1374","0.0006","11.7993","0.0007","12.279","0.0006","87.214","0.004","85.536","0.005","75.414","0.005","1276.73","0.13","295","0.2","295","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H46 Cu4 N16 O23 -","- C36 H44 Cu4 N16 O23 -","- C36 H44 Cu4 N16 O23 -","1","0.5","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0547","0.0397","","","0.1212","0.1426","","","","","","1.171","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054026","7.1301","0.0003","12.8192","0.0005","21.3279","0.0007","90","","90","","90","","1949.42","0.13","295","0.2","295","0.2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H10 Cu N2 O5 -","- C8 H10 Cu N2 O5 -","- C64 H80 Cu8 N16 O40 -","8","1","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.032","0.0261","","","0.0717","0.0735","","","","","","1.087","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054027","7.6832","0.0005","8.848","0.0006","10.4914","0.0007","98.405","0.006","90.733","0.005","101.71","0.006","690.21","0.08","295","0.2","295","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H28 Cu3 N4 O16 -","- C20 H28 Cu3 N4 O16 -","- C20 H28 Cu3 N4 O16 -","1","0.5","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0381","0.0315","","","0.0722","0.0761","","","","","","1.053","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054028","12.1604","0.0006","7.1869","0.0004","23.42","0.0015","90","","93.407","0.005","90","","2043.2","0.2","295","0.2","295","0.2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H44 Cl2 Cu4 N8 O14 -","- C34 H44 Cl2 Cu4 N8 O14 -","- C68 H88 Cl4 Cu8 N16 O28 -","2","0.5","","Świtlicka-Olszewska, Anna; Machura, Barbara; Mroziński, Jerzy; Kalińska, Bożena; Kruszynski, Rafał; Penkala, Mateusz","Effect of N-donor ancillary ligands on structural and magnetic properties of oxalate copper(ii) complexes","New Journal of Chemistry","2014","38","4","1611","","10.1039/c3nj01541f","","","0.71073","MoKα","","0.0487","0.0397","","","0.106","0.109","","","","","","1.18","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054029","11.441","0.0007","11.441","0.0007","81.313","0.006","90","","90","","120","","9217.6","1","296","2","296","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C18 H40 I4 N2 O6.17 Zn -","- C18 H38 I4 N2 O6.15 Zn -","- C216 H456 I48 N24 O73.8 Zn12 -","12","0.333333","","Martí-Rujas, Javier; Cametti, Massimo","Synthesis of a novel hybrid metal‒organic salt and its solid-state transformation","New Journal of Chemistry","2014","38","4","1385","","10.1039/c3nj01400b","","","1.54178","CuKα","","0.0667","0.0617","","","0.1701","0.176","","","","","","1.127","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054030","16.3228","0.0018","16.3228","0.0018","16.3228","0.0018","90","","90","","90","","4348.9","0.8","100","2","100","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","","","- C24 H58 I4 N2 O12 Zn4 -","- C24 H56 I4 N2 O12.3 Zn4 -","- C96 H224 I16 N8 O49.2 Zn16 -","4","0.333333","","Martí-Rujas, Javier; Cametti, Massimo","Synthesis of a novel hybrid metal‒organic salt and its solid-state transformation","New Journal of Chemistry","2014","38","4","1385","","10.1039/c3nj01400b","","","1.54178","CuKα","","0.0343","0.0316","","","0.0709","0.0718","","","","","","1.072","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054031","11.06","0.0006","11.06","0.0006","78.221","0.005","90","","90","","120","","8286.4","0.8","100","2","100","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C18 H40 Br4 N2 O7 Zn -","- C18 H38 Br4 N2 O6.5 Zn -","- C216 H456 Br48 N24 O78 Zn12 -","12","0.333333","","Martí-Rujas, Javier; Cametti, Massimo","Synthesis of a novel hybrid metal‒organic salt and its solid-state transformation","New Journal of Chemistry","2014","38","4","1385","","10.1039/c3nj01400b","","","1.54178","CuKα","","0.0384","0.0344","","","0.0998","0.1019","","","","","","1.093","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054032","15.8194","0.0003","7.939","0.0001","16.6596","0.0003","90","","110.723","0.0008","90","","1956.92","0.06","110","","110","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H35 B N2 -","- C20 H35 B N2 -","- C80 H140 B4 N8 -","4","1","","Liu, Mengran; Ptaszek, Marcin; Mass, Olga; Minkler, Daniel F.; Sommer, Roger D.; Bhaumik, Jayeeta; Lindsey, Jonathan S.","Regioselective β-pyrrolic electrophilic substitution of hydrodipyrrin‒dialkylboron complexes facilitates access to synthetic models for chlorophyll f","New Journal of Chemistry","2014","38","4","1717","","10.1039/c3nj01508d","","","0.71073","MolybdenumKα","","0.074","0.052","","0.157","0.079","","","","","2.8","2.8","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054033","8.8715","0.0003","26.3874","0.0012","9.8079","0.0004","90","","115.588","0.002","90","","2070.8","0.15","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Br8","","","- C20 H34 B Br N2 -","- C20 H34 B Br N2 -","- C80 H136 B4 Br4 N8 -","4","1","","Liu, Mengran; Ptaszek, Marcin; Mass, Olga; Minkler, Daniel F.; Sommer, Roger D.; Bhaumik, Jayeeta; Lindsey, Jonathan S.","Regioselective β-pyrrolic electrophilic substitution of hydrodipyrrin‒dialkylboron complexes facilitates access to synthetic models for chlorophyll f","New Journal of Chemistry","2014","38","4","1717","","10.1039/c3nj01508d","","","0.71073","MoKα","","0.0771","0.0643","","","0.1296","0.1343","","","","","","1.162","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054034","17.5208","0.0003","16.5255","0.0003","15.1765","0.0003","90","","90","","90","","4394.2","0.14","","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C21 H34 B Br N2 O -","- C21 H34 B Br N2 O -","- C168 H272 B8 Br8 N16 O8 -","8","2","","Liu, Mengran; Ptaszek, Marcin; Mass, Olga; Minkler, Daniel F.; Sommer, Roger D.; Bhaumik, Jayeeta; Lindsey, Jonathan S.","Regioselective β-pyrrolic electrophilic substitution of hydrodipyrrin‒dialkylboron complexes facilitates access to synthetic models for chlorophyll f","New Journal of Chemistry","2014","38","4","1717","","10.1039/c3nj01508d","","","0.71073","","","0.0496","0.0455","","","","0.1119","","","","","","1.0686","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054035","9.077","0.002","16.466","0.006","18.163","0.006","90","","109.714","0.008","90","","2555.6","1.4","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H39 B N2 -","- C27 H39 B N2 -","- C108 H156 B4 N8 -","4","1","","Liu, Mengran; Ptaszek, Marcin; Mass, Olga; Minkler, Daniel F.; Sommer, Roger D.; Bhaumik, Jayeeta; Lindsey, Jonathan S.","Regioselective β-pyrrolic electrophilic substitution of hydrodipyrrin‒dialkylboron complexes facilitates access to synthetic models for chlorophyll f","New Journal of Chemistry","2014","38","4","1717","","10.1039/c3nj01508d","","","0.71073","MoKα","","0.1097","0.0696","","","0.191","0.222","","","","","","1.058","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054036","10.519","0.0006","10.7555","0.0006","14.847","0.0009","90","","90.532","0.001","90","","1679.67","0.17","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cl N2 Rh -","- C18 H20 Cl N2 Rh -","- C72 H80 Cl4 N8 Rh4 -","4","1","","Cassani, Maria Cristina; Brucka, Marta Anna; Femoni, Cristina; Mancinelli, Michele; Mazzanti, Andrea; Mazzoni, Rita; Solinas, Gavino","N-Heterocyclic carbene rhodium(i) complexes containing an axis of chirality: dynamics and catalysis","New Journal of Chemistry","2014","38","4","1768","","10.1039/c3nj01620j","","","0.71073","MoKα","","0.0445","0.0319","","","0.0803","0.0883","","","","","","1.051","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054037","11.3295","0.0006","10.5864","0.0006","18.0379","0.0009","90","","106.826","0.001","90","","2070.82","0.19","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 Cl N2 Rh -","- C24 H24 Cl N2 Rh -","- C96 H96 Cl4 N8 Rh4 -","4","1","","Cassani, Maria Cristina; Brucka, Marta Anna; Femoni, Cristina; Mancinelli, Michele; Mazzanti, Andrea; Mazzoni, Rita; Solinas, Gavino","N-Heterocyclic carbene rhodium(i) complexes containing an axis of chirality: dynamics and catalysis","New Journal of Chemistry","2014","38","4","1768","","10.1039/c3nj01620j","","","0.71073","MoKα","","0.0261","0.0218","","","0.0536","0.0561","","","","","","1.044","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054038","12.6116","0.0005","13.0839","0.0006","20.257","0.0014","80.833","0.006","77.449","0.006","80.043","0.006","3187.7","0.3","193","2","193","2","","","","","","","","8","P -1","-P 1","2","","","","- C67.7 H53.4 B Cl5.4 F2 I N4 S2 -","- C65 H48 B F2 I N4 S2 -","- C130 H96 B2 F4 I2 N8 S4 -","2","1","","Sutter, Alexandra; Retailleau, Pascal; Huang, Wei-Ching; Lin, Hao-Wu; Ziessel, Raymond","Photovoltaic performance of novel push‒pull‒push thienyl‒Bodipy dyes in solution-processed BHJ-solar cells","New Journal of Chemistry","2014","38","4","1701","","10.1039/c3nj01436c","","","1.54187","CuKα","","0.0889","0.0593","","","0.1682","0.2094","","","","","","1.188","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054039","15.634","0.005","4.72","0.002","19.585","0.005","90","","91.229","0.005","90","","1444.9","0.9","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H14 N2 O4 -","- C17 H14 N2 O4 -","- C68 H56 N8 O16 -","4","1","","Parveen, Mehtab; Malla, Ali Mohammed; Alam, Mahboob; Ahmad, Musheer; Rafiq, Shahnawaz","Stereoselective synthesis of Z-acrylonitrile derivatives: catalytic and acetylcholinesterase inhibition studies","New Journal of Chemistry","2014","38","4","1655","","10.1039/c3nj01384g","","","0.71073","MoKα","","0.0633","0.0494","","","0.1345","0.1712","","","","","","1.129","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054040","22.4667","0.001","22.4667","0.001","14.6274","0.0007","90","","90","","90","","7383.2","0.6","150","2","150","2","","","","","","","","6","I -4 2 m","I -4 2","121","","","","- C96 H188 Cl4 Mn10 O44 P4 -","- C96 H188 Cl4 Mn10 O44 P4 -","- C192 H376 Cl8 Mn20 O88 P8 -","2","0.125","","Burkovskaya, Nataliya; Aleksandrov, Grigory; Ugolkova, Elena; Efimov, Nikolay; Evstifeev, Igor; Kiskin, Mikhail; Dobrokhotova, Zhanna; Minin, Vadim; Eremenko, Igor","Self-assembly and decay of Mn(ii) pivalate‒phosphonate complexes","New Journal of Chemistry","2014","38","4","1587","","10.1039/c3nj00899a","","","0.71073","MoKα","","0.035","0.0264","","","0.0712","0.0851","","","","","","1.086","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054041","20.0158","0.001","20.4213","0.001","20.6563","0.001","86.2682","0.0007","68.5806","0.0007","62.3876","0.0007","6909.1","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C164 H354 Cl2 Mn20 O88 P12 -","- C164 H328 Cl2 Mn20 O88 P12 -","- C164 H328 Cl2 Mn20 O88 P12 -","1","0.5","","Burkovskaya, Nataliya; Aleksandrov, Grigory; Ugolkova, Elena; Efimov, Nikolay; Evstifeev, Igor; Kiskin, Mikhail; Dobrokhotova, Zhanna; Minin, Vadim; Eremenko, Igor","Self-assembly and decay of Mn(ii) pivalate‒phosphonate complexes","New Journal of Chemistry","2014","38","4","1587","","10.1039/c3nj00899a","","","0.71073","MoKα","","0.121","0.0619","","","0.1631","0.2075","","","","","","1.011","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054042","27.413","0.017","17.073","0.011","26.29","0.016","90","","108.213","0.01","90","","11688","13","184","2","184","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C76 H156 Mn4 O36 P4 -","- C76 H156 Mn4 O36 P4 -","- C304 H624 Mn16 O144 P16 -","4","0.5","","Burkovskaya, Nataliya; Aleksandrov, Grigory; Ugolkova, Elena; Efimov, Nikolay; Evstifeev, Igor; Kiskin, Mikhail; Dobrokhotova, Zhanna; Minin, Vadim; Eremenko, Igor","Self-assembly and decay of Mn(ii) pivalate‒phosphonate complexes","New Journal of Chemistry","2014","38","4","1587","","10.1039/c3nj00899a","","","0.71073","MoKα","","0.2036","0.1148","","","0.2744","0.2985","","","","","","1.401","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054043","16.2519","0.0015","16.2519","0.0015","25.431","0.005","90","","90","","120","","5817","1.4","120","2","120","2","","","","","","","","5","P -3","-P 3","147","","","","- C76 H156 Mn4 O36 P4 -","- C76 H156 Mn4 O36 P4 -","- C152 H312 Mn8 O72 P8 -","2","0.333333","","Burkovskaya, Nataliya; Aleksandrov, Grigory; Ugolkova, Elena; Efimov, Nikolay; Evstifeev, Igor; Kiskin, Mikhail; Dobrokhotova, Zhanna; Minin, Vadim; Eremenko, Igor","Self-assembly and decay of Mn(ii) pivalate‒phosphonate complexes","New Journal of Chemistry","2014","38","4","1587","","10.1039/c3nj00899a","","","0.71073","MoKα","","0.1827","0.0842","","","0.2364","0.2927","","","","","","1.321","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054044","9.6409","0.0002","9.7269","0.0002","13.3073","0.0002","74.438","0.001","81.178","0.001","80.181","0.001","1176.91","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Pyridoxal phenylene molybdenum complex","","","- C18 H28 Mo N3 O8.5 S2 -","- C18 H28 Mo N3 O8.5 S2 -","- C36 H56 Mo2 N6 O17 S4 -","2","1","","Pereira, Mateus Brum; Kopp, Cristiéli R.; Fontana, Liniquer A.; de Oliveira, Gelson Manzoni; Back, Davi Fernando; Piquini, Paulo C.; Villetti, Marcos A.","Synthesis, X-ray structural features, DFT calculations and fluorescence studies of a new pyridoxal-benzimidazole ligand and its respective molybdenum complex","New Journal of Chemistry","2014","38","7","3092","","10.1039/c4nj00259h","","","0.71073","MoKα","","0.0813","0.0523","","","0.1222","0.1388","","","","","","1.012","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054045","10.8031","0.0013","4.9069","0.0006","24.726","0.003","90","","100.434","0.008","90","","1289","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","pyridoxal imidazol salt","4-(1H-benzo imidazol-2-yl)-5-(hydroxymethyl)-2-methylpyridin-3-ol chloride salt","","- C14 H14 Cl N3 O2 -","- C14 H14 Cl N3 O2 -","- C56 H56 Cl4 N12 O8 -","4","1","","Pereira, Mateus Brum; Kopp, Cristiéli R.; Fontana, Liniquer A.; de Oliveira, Gelson Manzoni; Back, Davi Fernando; Piquini, Paulo C.; Villetti, Marcos A.","Synthesis, X-ray structural features, DFT calculations and fluorescence studies of a new pyridoxal-benzimidazole ligand and its respective molybdenum complex","New Journal of Chemistry","2014","38","7","3092","","10.1039/c4nj00259h","","","0.71073","MoKα","","0.1441","0.0488","","","0.094","0.1222","","","","","","0.986","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054046","10.599","0.005","31.295","0.005","15.997","0.005","90","","101.404","0.005","90","","5201","3","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Fe12i(C8)(dmap)2]","","","- C49.5 H76 Fe N6 O9.5 -","- C49.5 H76 Fe N6 O9.5 -","- C198 H304 Fe4 N24 O38 -","4","1","","Schlamp, Stephan; Dankhoff, Katja; Weber, Birgit","Amphiphilic iron(ii) complexes with short alkyl chains ‒ crystal packing and spin transition properties","New Journal of Chemistry","2014","38","5","1965","","10.1039/c3nj00991b","","","0.71069","MoKα","","0.1626","0.0852","","","0.2167","0.2514","","","","","","0.931","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054047","11.9872","0.0007","12.538","0.0008","14.6613","0.001","95.394","0.005","102.327","0.005","106.231","0.005","2039","0.2","133","2","133","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H60 Fe N4 O8 -","- C41 H60 Fe N4 O8 -","- C82 H120 Fe2 N8 O16 -","2","1","","Schlamp, Stephan; Dankhoff, Katja; Weber, Birgit","Amphiphilic iron(ii) complexes with short alkyl chains ‒ crystal packing and spin transition properties","New Journal of Chemistry","2014","38","5","1965","","10.1039/c3nj00991b","","","0.71069","MoKα","","0.1335","0.0632","","","0.1177","0.138","","","","","","0.877","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054048","11.9287","0.0005","13.1406","0.0005","17.0569","0.0007","103.154","0.003","100.508","0.003","100.246","0.003","2491.76","0.18","133","2","133","2","","","","","","","","5","P -1","-P 1","2","Fe12i(C8)(dmap)2","","","- C49 H74 Fe N6 O9 -","- C49 H74 Fe N6 O9 -","- C98 H148 Fe2 N12 O18 -","2","1","","Schlamp, Stephan; Dankhoff, Katja; Weber, Birgit","Amphiphilic iron(ii) complexes with short alkyl chains ‒ crystal packing and spin transition properties","New Journal of Chemistry","2014","38","5","1965","","10.1039/c3nj00991b","","","0.71073","MoKα","","0.0531","0.0384","","","0.0933","0.0975","","","","","","0.93","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054049","12.0361","0.0008","13.4241","0.001","17.3275","0.0013","103.289","0.006","101.608","0.006","99.935","0.006","2597.7","0.3","273","2","273","2","","","","","","","","5","P -1","-P 1","2","[Fe12i(C8)(dmap)2]","","","- C49 H74 Fe N6 O9 -","- C49 H74 Fe N6 O9 -","- C98 H148 Fe2 N12 O18 -","2","1","","Schlamp, Stephan; Dankhoff, Katja; Weber, Birgit","Amphiphilic iron(ii) complexes with short alkyl chains ‒ crystal packing and spin transition properties","New Journal of Chemistry","2014","38","5","1965","","10.1039/c3nj00991b","","","0.71073","MoKα","","0.1055","0.066","","","0.1596","0.1737","","","","","","0.868","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054050","19.8161","0.0009","8.2415","0.0004","25.5905","0.0011","90","","98.224","0.003","90","","4136.3","0.3","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Fe12i(C8)(dmap)]","","","- C41 H60 Fe N4 O8 -","- C41 H60 Fe N4 O8 -","- C164 H240 Fe4 N16 O32 -","4","1","","Schlamp, Stephan; Dankhoff, Katja; Weber, Birgit","Amphiphilic iron(ii) complexes with short alkyl chains ‒ crystal packing and spin transition properties","New Journal of Chemistry","2014","38","5","1965","","10.1039/c3nj00991b","","","0.71069","MoKα","","0.1147","0.1008","","","0.2535","0.2606","","","","","","1.125","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054051","15.2194","0.0018","11.4434","0.0018","19.218","0.003","90","","90.342","0.004","90","","3347","0.8","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C72 H52 Cu2 Mo N16 O5 -","- C72 H52 Cu2 Mo N16 O5 -","- C144 H104 Cu4 Mo2 N32 O10 -","2","0.5","","Shiga, Takuya; Takeo, Mayumi; Iijima, Fumichika; Newton, Graham N.; Oshio, Hiroki","Syntheses, structures and magnetic properties of two-dimensional chiral coordination polymers based on a tetradentate chiral ligand","New Journal of Chemistry","2014","38","5","1946","","10.1039/c3nj01128c","","","0.71073","MoKα","","0.0925","0.0564","","","0.1061","0.1395","","","","","","0.856","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054052","14.943","0.007","11.568","0.007","19.366","0.01","90","","90.045","0.019","90","","3348","3","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C72 H52 Co2 Mo N16 O5 -","- C72 H52 Co2 Mo N16 O5 -","- C144 H104 Co4 Mo2 N32 O10 -","2","0.5","","Shiga, Takuya; Takeo, Mayumi; Iijima, Fumichika; Newton, Graham N.; Oshio, Hiroki","Syntheses, structures and magnetic properties of two-dimensional chiral coordination polymers based on a tetradentate chiral ligand","New Journal of Chemistry","2014","38","5","1946","","10.1039/c3nj01128c","","","0.71073","MoKα","","0.245","0.0782","","","0.1442","0.2482","","","","","","0.691","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054053","21.66396","0.00016","23.9589","0.00014","18.11334","0.00012","90","","90","","90","","9401.63","0.11","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C87.5 H81.5 N8.5 O26.5 Zn7 -","- C80 H60 N6 O22 Zn7 -","- C320 H240 N24 O88 Zn28 -","4","0.5","","Chen, Kai-Jie; He, Chun-Ting; Liao, Pei-Qin; Wei, Yong-Sheng; Zhang, Peng-Xiang; Xue, Wei; Zhang, Wei-Xiong; Zhang, Jie-Peng; Chen, Xiao-Ming","A flexible, porous, cluster-based Zn-pyrazolate-dicarboxylate framework showing selective adsorption properties","New Journal of Chemistry","2014","38","5","2002","","10.1039/c3nj00918a","","","1.54178","CuKα","","0.0358","0.0325","","","0.0995","0.1026","","","","","","1.042","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054054","21.9889","0.0003","24.0194","0.0002","18.0882","0.0002","90","","90","","90","","9553.47","0.19","300","2","300","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C87.5 H81.5 N8.5 O26.5 Zn7 -","- C80 H60 N6 O22 Zn7 -","- C320 H240 N24 O88 Zn28 -","4","","","Chen, Kai-Jie; He, Chun-Ting; Liao, Pei-Qin; Wei, Yong-Sheng; Zhang, Peng-Xiang; Xue, Wei; Zhang, Wei-Xiong; Zhang, Jie-Peng; Chen, Xiao-Ming","A flexible, porous, cluster-based Zn-pyrazolate-dicarboxylate framework showing selective adsorption properties","New Journal of Chemistry","2014","38","5","2002","","10.1039/c3nj00918a","","","1.54178","CuKα","","0.0345","0.0334","","","0.1045","0.1058","","","","","","1.028","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054055","7.15364","0.00018","7.3059","0.0002","19.467","0.0005","91.284","0.002","90.918","0.002","102.456","0.002","992.99","0.05","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H18 N2 S6 -","- C18 H18 N2 S6 -","- C36 H36 N4 S12 -","2","1","","Geng, Yan; Fiolka, Christoph; Krämer, Karl; Hauser, Jürg; Laukhin, Vladimir; Decurtins, Silvio; Liu, Shi-Xia","A quinoxaline-fused tetrathiafulvalene derivative and its semiconducting charge-transfer salt: synthesis, crystal structures and physical properties","New Journal of Chemistry","2014","38","5","2052","","10.1039/c3nj01200j","","","0.71073","MoKα","","0.0331","0.0274","","","0.0666","0.0702","","","","","","1.046","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054056","7.59591","0.00008","11.61481","0.00013","25.9543","0.0003","83.0995","0.001","84.6415","0.0009","89.8152","0.0009","2263.22","0.04","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H36 I3 N4 S12 -","- C36 H36 I3 N4 S12 -","- C72 H72 I6 N8 S24 -","2","1","","Geng, Yan; Fiolka, Christoph; Krämer, Karl; Hauser, Jürg; Laukhin, Vladimir; Decurtins, Silvio; Liu, Shi-Xia","A quinoxaline-fused tetrathiafulvalene derivative and its semiconducting charge-transfer salt: synthesis, crystal structures and physical properties","New Journal of Chemistry","2014","38","5","2052","","10.1039/c3nj01200j","","","0.71073","MoKα","","0.0362","0.0297","","","0.062","0.0661","","","","","","1.165","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054057","17.1614","0.0006","17.3252","0.0006","24.4236","0.0007","70.309","0.003","79.499","0.003","77.344","0.003","6624.3","0.4","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C173 H236 Cl4 Fe12 N92 O35 S20 -","- C173 H192 Cl4 Fe12 N92 O35 S20 -","- C173 H192 Cl4 Fe12 N92 O35 S20 -","1","0.5","","Abhervé, Alexandre; Clemente-Juan, Juan Modesto; Clemente-León, Miguel; Coronado, Eugenio; Boonmak, Jaursup; Youngme, Sujittra","Tuning the nuclearity of iron(iii) polynuclear clusters by using tetradentate Schiff-base ligands","New Journal of Chemistry","2014","38","5","2105","","10.1039/c3nj01516e","","","0.71073","MoKα","","0.1937","0.0968","","","0.2427","0.3045","","","","","","1.051","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054058","20.2912","0.0006","11.7876","0.0005","22.1837","0.0006","90","","98.084","0.003","90","","5253.3","0.3","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H28 Fe4 N15.5 O7.7 S7 -","- C36 H28 Fe4 N15.5 O7.7 S7 -","- C144 H112 Fe16 N62 O30.8 S28 -","4","1","","Abhervé, Alexandre; Clemente-Juan, Juan Modesto; Clemente-León, Miguel; Coronado, Eugenio; Boonmak, Jaursup; Youngme, Sujittra","Tuning the nuclearity of iron(iii) polynuclear clusters by using tetradentate Schiff-base ligands","New Journal of Chemistry","2014","38","5","2105","","10.1039/c3nj01516e","","","0.71073","MoKα","","0.098","0.066","","","0.159","0.1816","","","","","","1.028","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054059","15.5153","0.0004","25.855","0.0009","26.6761","0.0011","90","","90","","90","","10701.1","0.6","120","2","120","2","","","","","","","","6","P b n a","-P 2ac 2b","60","","","","- C69 H86 Fe6 N48 O25 S6 -","- C69 H72 Fe6 N48 O25 S6 -","- C276 H288 Fe24 N192 O100 S24 -","4","0.5","","Abhervé, Alexandre; Clemente-Juan, Juan Modesto; Clemente-León, Miguel; Coronado, Eugenio; Boonmak, Jaursup; Youngme, Sujittra","Tuning the nuclearity of iron(iii) polynuclear clusters by using tetradentate Schiff-base ligands","New Journal of Chemistry","2014","38","5","2105","","10.1039/c3nj01516e","","","0.7107","MoKα","","0.1775","0.0826","","","0.1889","0.2527","","","","","","1.027","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054060","45.2573","0.0013","27.5089","0.0006","28.4547","0.0009","90","","119.372","0.004","90","","30871.7","1.9","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C93.5 H142 F3 Fe6.5 N46.5 O15 S10.5 -","- C84.5 H96 F3 Fe6.5 N46.5 O5 S10.5 -","- C676 H768 F24 Fe52 N372 O40 S84 -","8","1","","Abhervé, Alexandre; Clemente-Juan, Juan Modesto; Clemente-León, Miguel; Coronado, Eugenio; Boonmak, Jaursup; Youngme, Sujittra","Tuning the nuclearity of iron(iii) polynuclear clusters by using tetradentate Schiff-base ligands","New Journal of Chemistry","2014","38","5","2105","","10.1039/c3nj01516e","","","0.71073","MoKα","","0.1799","0.1149","","","0.3198","0.3644","","","","","","1.081","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054061","28.5279","0.0003","28.5279","0.0003","41.3731","0.0006","90","","90","","90","","33671.1","0.7","120","2","120","2","","","","","","","","7","I 41 c d","I 4bw -2c","110","","","","- C91 H108 Cl5 Fe8 N59 O30 S11 -","- C91 H96 Cl5 Fe8 N59 O30 S11 -","- C728 H768 Cl40 Fe64 N472 O240 S88 -","8","0.5","","Abhervé, Alexandre; Clemente-Juan, Juan Modesto; Clemente-León, Miguel; Coronado, Eugenio; Boonmak, Jaursup; Youngme, Sujittra","Tuning the nuclearity of iron(iii) polynuclear clusters by using tetradentate Schiff-base ligands","New Journal of Chemistry","2014","38","5","2105","","10.1039/c3nj01516e","","","0.71073","MoKα","","0.2154","0.1109","","","0.2758","0.347","","","","","","1.01","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054062","7.603","0.004","14.991","0.006","20.824","0.01","91.37","0.04","98.31","0.04","90.64","0.02","2347.6","1.9","293","","293","","","","","","","","","5","P -1","-P 1","2","CoW4mepyprm","","","- C36 Co3 N22 O6 W2 -","- C36 Co3 N22 O6 W2 -","- C72 Co6 N44 O12 W4 -","2","1","","Ozaki, Noriaki; Tokoro, Hiroko; Miyamoto, Yasuto; Ohkoshi, Shin-ichi","Humidity dependency of the thermal phase transition of a cyano bridged Co‒W bimetal assembly","New Journal of Chemistry","2014","38","5","1950","","10.1039/c3nj01656k","powder diffraction","","1.54059","CuKα","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054063","23.156","0.001","8.0465","0.0003","26.901","0.001","90","","90","","90","","5012.3","0.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H18 F6 N8 O6 S2 -","- C18 H18 F6 N8 O6 S2 -","- C144 H144 F48 N64 O48 S16 -","8","1","","Aguiló, Joan; Naeimi, Atena; Bofill, Roger; Mueller-Bunz, Helge; Llobet, Antoni; Escriche, Lluís; Sala, Xavier; Albrecht, Martin","Dinuclear ruthenium complexes containing a new ditopic phthalazin-bis(triazole) ligand that promotes metal‒metal interactions","New Journal of Chemistry","2014","38","5","1980","","10.1039/c3nj01209c","","","0.71073","MoKα","","0.0918","0.087","","","0.164","0.1661","","","","","","1.194","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054064","16.5447","0.0006","6.8596","0.0003","19.1037","0.0008","90","","102.175","0.004","90","","2119.31","0.15","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Cl3 I N8 -","- C16 H16 Cl3 I N8 -","- C64 H64 Cl12 I4 N32 -","4","1","","Aguiló, Joan; Naeimi, Atena; Bofill, Roger; Mueller-Bunz, Helge; Llobet, Antoni; Escriche, Lluís; Sala, Xavier; Albrecht, Martin","Dinuclear ruthenium complexes containing a new ditopic phthalazin-bis(triazole) ligand that promotes metal‒metal interactions","New Journal of Chemistry","2014","38","5","1980","","10.1039/c3nj01209c","","","0.71073","MoKα","","0.0412","0.0288","","","0.0578","0.0638","","","","","","1.06","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054065","11.8427","0.0005","21.0984","0.0007","12.933","0.001","90","","103.303","0.006","90","","3144.8","0.3","100","2","100","2","","","","","","","","8","P 1 21/m 1","-P 2yb","11","","","","- C50 H46 Cl F18 N14 O2 P3 Ru2 -","- C47 H40 Cl F18 N14 O P3 Ru2 -","- C94 H80 Cl2 F36 N28 O2 P6 Ru4 -","2","0.5","","Aguiló, Joan; Naeimi, Atena; Bofill, Roger; Mueller-Bunz, Helge; Llobet, Antoni; Escriche, Lluís; Sala, Xavier; Albrecht, Martin","Dinuclear ruthenium complexes containing a new ditopic phthalazin-bis(triazole) ligand that promotes metal‒metal interactions","New Journal of Chemistry","2014","38","5","1980","","10.1039/c3nj01209c","","","0.71073","MoKα","","0.0698","0.0485","","","0.1204","0.1298","","","","","","1.044","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054066","7.6805","0.0003","13.5584","0.0004","9.0977","0.0003","90","","101.345","0.004","90","","928.88","0.06","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H6 B Cl F2 N2 -","- C9 H6 B Cl F2 N2 -","- C36 H24 B4 Cl4 F8 N8 -","4","1","","Misra, Rajneesh; Dhokale, Bhausaheb; Jadhav, Thaksen; Mobin, Shaikh M.","meso-Aryloxy and meso-arylaza linked BODIPY dimers: synthesis, structures and properties","New Journal of Chemistry","2014","38","8","3579","","10.1039/C4NJ00354C","","","0.71073","MoKα","","0.0263","0.0253","","","0.0635","0.0646","","","","","","1.055","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054067","14.2703","0.0002","8.2079","0.0001","22.8846","0.0002","90","","104.578","0.001","90","","2594.16","0.05","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 B2 F4 N6 O -","- C27 H24 B2 F4 N6 O -","- C108 H96 B8 F16 N24 O4 -","4","1","","Misra, Rajneesh; Dhokale, Bhausaheb; Jadhav, Thaksen; Mobin, Shaikh M.","meso-Aryloxy and meso-arylaza linked BODIPY dimers: synthesis, structures and properties","New Journal of Chemistry","2014","38","8","3579","","10.1039/C4NJ00354C","","","1.5418","CuKα","","0.0417","0.0378","","","0.0994","0.1033","","","","","","1.026","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054068","9.9907","0.0007","10.7791","0.0009","11.2843","0.0009","81.573","0.007","66.188","0.008","83.531","0.007","1097.84","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H16 B2 F4 N4 O2 -","- C24 H16 B2 F4 N4 O2 -","- C48 H32 B4 F8 N8 O4 -","2","1","","Misra, Rajneesh; Dhokale, Bhausaheb; Jadhav, Thaksen; Mobin, Shaikh M.","meso-Aryloxy and meso-arylaza linked BODIPY dimers: synthesis, structures and properties","New Journal of Chemistry","2014","38","8","3579","","10.1039/C4NJ00354C","","","1.5418","CuKα","","0.0491","0.0393","","","0.1004","0.11","","","","","","1.028","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054069","10.7934","0.0002","15.9368","0.0002","14.8791","0.0002","90","","105.658","0.002","90","","2464.41","0.07","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25 H20 B2 Cl2 F4 N6 -","- C25 H20 B2 Cl2 F4 N6 -","- C100 H80 B8 Cl8 F16 N24 -","4","0.5","","Misra, Rajneesh; Dhokale, Bhausaheb; Jadhav, Thaksen; Mobin, Shaikh M.","meso-Aryloxy and meso-arylaza linked BODIPY dimers: synthesis, structures and properties","New Journal of Chemistry","2014","38","8","3579","","10.1039/C4NJ00354C","","","1.5418","CuKα","","0.0602","0.0565","","","0.1416","0.1452","","","","","","1.061","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054070","8.4373","0.0014","9.5358","0.0016","10.6711","0.0018","91.896","0.003","105.717","0.003","107.104","0.003","784","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C5 H26 B9 N4 S -","- C5 H26 B9 N4 S -","- C10 H52 B18 N8 S2 -","2","1","","Stogniy, Marina Yu.; Sivaev, Igor B.; Godovikov, Ivan A.; Starikova, Zoya A.; Bregadze, Vladimir I.; Qi, Shicheng","Synthesis of new ω-amino- and ω-azidoalkyl carboranes","New Journal of Chemistry","2013","37","12","3865","","10.1039/c3nj00677h","","","0.71073","MoKα","","0.0504","0.0447","","","0.1184","0.1241","","","","","","1.062","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054071","8.947","0.0018","20.874","0.004","10.471","0.002","90","","100.02","0.03","90","","1925.7","0.7","95","2","95","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H25 Mn2 N O9 -","- C16 H25 Mn2 N O9 -","- C64 H100 Mn8 N4 O36 -","4","1","","Kim, Tae Kyung; Lee, Kyung Joo; Choi, Min; Park, Noejung; Moon, Dohyun; Moon, Hoi Ri","Metal‒organic frameworks constructed from flexible ditopic ligands: conformational diversity of an aliphatic ligand","New Journal of Chemistry","2013","37","12","4130","","10.1039/c3nj00812f","","","0.75001","synchrotron","","0.0457","0.0453","","","0.1172","0.1174","","","","","","1.115","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054072","28.365","0.004","28.365","0.004","13.361","0.003","90","","90","","90","","10750","3","95","2","95","2","","","","","","","","5","I 41/a","-I 4ad","88","","","","- C18 H33 Co2 N2 O11.5 -","- C18 H30 Co2 N2 O10 -","- C288 H480 Co32 N32 O160 -","16","","","Kim, Tae Kyung; Lee, Kyung Joo; Choi, Min; Park, Noejung; Moon, Dohyun; Moon, Hoi Ri","Metal‒organic frameworks constructed from flexible ditopic ligands: conformational diversity of an aliphatic ligand","New Journal of Chemistry","2013","37","12","4130","","10.1039/c3nj00812f","","","0.80003","synchrotron","","0.0645","0.0614","","","0.1411","0.1423","","","","","","1.206","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054073","12.108","0.002","17.477","0.004","20.111","0.004","90","","91.99","0.03","90","","4253.2","1.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C33 H50 N2 O20 Tb3 -","- C33 H50 N2 O20 Tb3 -","- C132 H200 N8 O80 Tb12 -","4","1","","Kim, Tae Kyung; Lee, Kyung Joo; Choi, Min; Park, Noejung; Moon, Dohyun; Moon, Hoi Ri","Metal‒organic frameworks constructed from flexible ditopic ligands: conformational diversity of an aliphatic ligand","New Journal of Chemistry","2013","37","12","4130","","10.1039/c3nj00812f","","","0.71073","MoKα","","0.0638","0.0396","","","0.0827","0.0937","","","","","","1.028","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054074","16.681","0.006","18.988","0.006","15.587","0.007","90","","90","","90","","4937","3","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C16 H48 Ce3 Mn2 Na O31 -","- C16 H24 Ce3 Mn2 Na O27 -","- C64 H96 Ce12 Mn8 Na4 O108 -","4","0.5","","Zhang, Chunjing; Chen, Yanyan; Ma, Huiyuan; Yu, Tingting; Liu, Bo; Pang, Haijun","Synthesis and structural characterization of 3d‒4f heterometallic coordination polymers: from cluster to chain","New Journal of Chemistry","2013","37","5","1364","","10.1039/c3nj41064a","","","0.71069","MoKα","","0.0927","0.0578","","","0.1351","0.1478","","","","","","0.93","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054075","8.255","0.001","10.394","0.001","11.55","0.001","111.477","0.001","107.859","0.001","93.506","0.001","860.78","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H38 Mn Na2 Nd2 O24 -","- C16 H24 Mn Na2 Nd2 O24 -","- C16 H24 Mn Na2 Nd2 O24 -","1","0.5","","Zhang, Chunjing; Chen, Yanyan; Ma, Huiyuan; Yu, Tingting; Liu, Bo; Pang, Haijun","Synthesis and structural characterization of 3d‒4f heterometallic coordination polymers: from cluster to chain","New Journal of Chemistry","2013","37","5","1364","","10.1039/c3nj41064a","","","0.71069","MoKα","","0.038","0.0316","","","0.0749","0.0779","","","","","","1.024","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054076","19.6993","0.0002","20.9296","0.0003","19.2039","0.0002","90","","92.301","0.001","90","","7911.35","0.16","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C70 H70 O15 S14 Ti4 -","- C70 H70 O15 S14 Ti4 -","- C280 H280 O60 S56 Ti16 -","4","1","","Mehner, Alexander; Rüffer, Tobias; Lang, Heinrich; Schlesinger, Maik; Mehring, Michael; Spange, Stefan","Chirality and reversible solid state phase transition of a tetranuclear titanium oxido cluster","New Journal of Chemistry","2013","37","5","1290","","10.1039/c3nj40775f","","","1.54184","CuKα","","0.0763","0.0592","","","0.1584","0.1758","","","","","","1.028","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054077","20.1052","0.0006","20.8771","0.0005","18.6043","0.0005","90","","96.981","0.003","90","","7751","0.4","160","","160","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C70 H70 O15 S14 Ti4 -","- C70 H70 O15 S14 Ti4 -","- C280 H280 O60 S56 Ti16 -","4","1","","Mehner, Alexander; Rüffer, Tobias; Lang, Heinrich; Schlesinger, Maik; Mehring, Michael; Spange, Stefan","Chirality and reversible solid state phase transition of a tetranuclear titanium oxido cluster","New Journal of Chemistry","2013","37","5","1290","","10.1039/c3nj40775f","","","0.71073","MoKα","","0.0749","0.0527","","","0.1415","0.1591","","","","","","1.065","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054078","22.889","0.007","13.486","0.004","21.398","0.006","90","","113.624","0.004","90","","6052","3","163","2","163","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C60 H72 O16 S4 -","- C60 H72 O16 S4 -","- C240 H288 O64 S16 -","4","0.5","","Georghiou, Paris E.; Rahman, Shofiur; Valluru, Gopikishore; Dawe, Louise N.; Rahman, S. M. Saydur; Alodhayb, Abdullah N.; Beaulieu, L. Y.","Synthesis of an upper- and lower-rim functionalized calix[4]arene for detecting calcium ions using a microcantilever sensor","New Journal of Chemistry","2013","37","5","1298","","10.1039/c3nj00223c","","","0.71075","MoKα","","0.1061","0.0944","","","0.2554","0.266","","","","","","1.126","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054079","20.167","0.003","19.979","0.005","15.367","0.004","90","","113.935","0.013","90","","5659","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H22 N4 O2 S7 -","- C26 H22 N4 O2 S7 -","- C208 H176 N32 O16 S56 -","8","1","","Belhadj, Esmah; El-Ghayoury, Abdelkrim; Ripaud, Emilie; Zorina, Leokadiya; Allain, Magali; Batail, Patrick; Mazari, Miloud; Sallé, Marc","Terpyridine‒tetrathiafulvalene hybrid ligands and their electroactive metal complexes","New Journal of Chemistry","2013","37","5","1427","","10.1039/c3nj00041a","","","0.71073","MoKα","","0.1545","0.0675","","","0.1266","0.168","","","","","","1.077","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054080","25.001","0.002","11.856","0.001","20.044","0.001","90","","117.164","0.007","90","","5286","0.7","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H20 N4 O2 S6 -","- C25 H20 N4 O2 S6 -","- C200 H160 N32 O16 S48 -","8","1","","Belhadj, Esmah; El-Ghayoury, Abdelkrim; Ripaud, Emilie; Zorina, Leokadiya; Allain, Magali; Batail, Patrick; Mazari, Miloud; Sallé, Marc","Terpyridine‒tetrathiafulvalene hybrid ligands and their electroactive metal complexes","New Journal of Chemistry","2013","37","5","1427","","10.1039/c3nj00041a","","","0.71073","MoKα","","0.1375","0.0589","","","0.0841","0.1066","","","","","","1.07","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054081","8.967","0.009","17.79","0.01","21.38","0.02","83","0.1","88.3","0.1","77.74","0.09","3308","5","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H45 Cl2 N8 Ni O10.5 S16 -","- C52 H44 Cl2 N8 Ni O10.5 S16 -","- C104 H88 Cl4 N16 Ni2 O21 S32 -","2","1","","Belhadj, Esmah; El-Ghayoury, Abdelkrim; Ripaud, Emilie; Zorina, Leokadiya; Allain, Magali; Batail, Patrick; Mazari, Miloud; Sallé, Marc","Terpyridine‒tetrathiafulvalene hybrid ligands and their electroactive metal complexes","New Journal of Chemistry","2013","37","5","1427","","10.1039/c3nj00041a","","","0.71073","MoKα","","0.3442","0.1152","","","0.2286","0.3306","","","","","","1.028","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054082","8.199","0.0008","11.455","0.001","19.958","0.002","96.439","0.007","90.342","0.007","110.707","0.008","1740.2","0.3","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H26 Cl2 N4 O2 S8 Zn -","- C26 H22 Cl2 N4 O S8 Zn -","- C52 H44 Cl4 N8 O2 S16 Zn2 -","2","1","","Belhadj, Esmah; El-Ghayoury, Abdelkrim; Ripaud, Emilie; Zorina, Leokadiya; Allain, Magali; Batail, Patrick; Mazari, Miloud; Sallé, Marc","Terpyridine‒tetrathiafulvalene hybrid ligands and their electroactive metal complexes","New Journal of Chemistry","2013","37","5","1427","","10.1039/c3nj00041a","","","0.71073","MoKα","","0.0836","0.059","","","0.144","0.1553","","","","","","1.05","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054083","8.177","0.001","11.319","0.001","20.788","0.001","90","","90","","90","","1924","0.3","150","0.1","150","0.1","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H16 F3 N3 O8 S -","- C15 H16 F3 N3 O8 S -","- C60 H64 F12 N12 O32 S4 -","4","1","","Chaume, Grégory; Feytens, Debby; Chassaing, Gérard; Lavielle, Solange; Brigaud, Thierry; Miclet, Emeric","Conformational properties of peptides incorporating a fluorinated pseudoproline residue","New Journal of Chemistry","2013","37","5","1336","","10.1039/c3nj41084f","","","0.71069","MoKα","","0.044","0.0345","","","0.0791","0.0829","","","","","","1.056","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054084","6.8983","0.0006","12.0634","0.001","12.5086","0.001","90","","90","","90","","1040.93","0.15","293","2","293","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H17 Cl F N O -","- C9 H17 Cl F N O -","- C36 H68 Cl4 F4 N4 O4 -","4","1","","Dutheuil, Guillaume; Pierry, Camille; Villiers, Emilie; Couve-Bonnaire, Samuel; Pannecoucke, Xavier","Straightforward asymmetric synthesis of Ala-Ψ[CFCH]-Pro, a proline-containing pseudodipeptide bearing a fluoroolefin as a peptide bond mimic","New Journal of Chemistry","2013","37","5","1320","","10.1039/c2nj40891k","","x-ray","0.71073","MoKα","","0.0272","0.0266","","","0.0689","0.07","","","","","","1.118","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054085","18.489","0.0008","39.5013","0.0017","47.111","0.002","90","","96.154","0.001","90","","34209","3","113","2","113","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C234 H153 Br9 F162 Gd9 N18 O72 S9 -","- C234 H153 Br9 F162 Gd9 N18 O72 S9 -","- C936 H612 Br36 F648 Gd36 N72 O288 S36 -","4","1","","Liu, Ruina; Zhang, Congming; Mei, Xuelan; Hu, Peng; Tian, Haixia; Li, Licun; Liao, Daizheng; Sutter, Jean-Pascal","Slow magnetic relaxation and antiferromagnetic ordering in a one dimensional nitronyl nitroxide‒Tb(iii) chain","New Journal of Chemistry","2012","36","10","2088","","10.1039/c2nj40570a","","","0.71073","MoKα","","0.2162","0.1034","","","0.2241","0.313","","","","","","1.041","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054086","18.476","0.004","39.497","0.008","47.072","0.009","90","","96.06","0.03","90","","34159","12","113","2","113","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C234 H153 Br9 F162 N18 O72 S9 Tb9 -","- C234 H153 Br9 F162 N18 O72 S9 Tb9 -","- C936 H612 Br36 F648 N72 O288 S36 Tb36 -","4","1","","Liu, Ruina; Zhang, Congming; Mei, Xuelan; Hu, Peng; Tian, Haixia; Li, Licun; Liao, Daizheng; Sutter, Jean-Pascal","Slow magnetic relaxation and antiferromagnetic ordering in a one dimensional nitronyl nitroxide‒Tb(iii) chain","New Journal of Chemistry","2012","36","10","2088","","10.1039/c2nj40570a","","","0.71073","MoKα","","0.1428","0.0901","","","0.2107","0.2571","","","","","","1.019","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054087","10.2352","0.0002","11.7803","0.0002","12.9715","0.0002","79.119","0.001","71.609","0.001","64.342","0.001","1335.31","0.04","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H26 Cl Cu2 N5 O10 -","- C23 H26 Cl Cu2 N5 O10 -","- C46 H52 Cl2 Cu4 N10 O20 -","2","1","","He, Fang-Hong; Tao, Lin; Li, Xiao-Wen; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei","Syntheses and structures of new dicopper(ii) complexes bridged by N-(2-hydroxyphenyl)-N′-(3-aminopropyl)oxamide: DNA-binding properties and cytotoxic activities","New Journal of Chemistry","2012","36","10","2078","","10.1039/c2nj40397h","","","0.71073","MoKα","","0.0698","0.0446","","","0.1094","0.1237","","","","","","1.035","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054088","9.876","0.004","11.21","0.004","11.834","0.005","92.41","0.007","110.147","0.007","95.229","0.007","1221.1","0.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H26 Cu2 N6 O7 -","- C23 H26 Cu2 N6 O7 -","- C46 H52 Cu4 N12 O14 -","2","1","","He, Fang-Hong; Tao, Lin; Li, Xiao-Wen; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei","Syntheses and structures of new dicopper(ii) complexes bridged by N-(2-hydroxyphenyl)-N′-(3-aminopropyl)oxamide: DNA-binding properties and cytotoxic activities","New Journal of Chemistry","2012","36","10","2078","","10.1039/c2nj40397h","","","0.71073","MoKα","","0.0817","0.0443","","","0.0885","0.1021","","","","","","1.012","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054089","23.6799","0.0004","9.7018","0.0002","10.2777","0.0001","90","","90","","90","","2361.17","0.07","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C21 H24 Cu2 N6 O8 -","- C21 H24 Cu2 N6 O8 -","- C84 H96 Cu8 N24 O32 -","4","1","","He, Fang-Hong; Tao, Lin; Li, Xiao-Wen; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei","Syntheses and structures of new dicopper(ii) complexes bridged by N-(2-hydroxyphenyl)-N′-(3-aminopropyl)oxamide: DNA-binding properties and cytotoxic activities","New Journal of Chemistry","2012","36","10","2078","","10.1039/c2nj40397h","","","0.71073","MoKα","","0.0558","0.0372","","","0.0786","0.087","","","","","","1.026","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054090","10.459","0.003","11.329","0.003","17.261","0.004","78.15","0.02","84","0.02","85.35","0.02","1987","0.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H44 Co N4 O8 P2 S4 -","- C29.999 H44 Co N4 O8 P2 S4 -","- C59.998 H88 Co2 N8 O16 P4 S8 -","2","1","","Babashkina, Maria G.; Safin, Damir A.; Railliet, Antoine P.; Bolte, Michael; Brzuszkiewicz, Anna; Kozlowski, Henryk; Garcia, Yann","Spin-canted ferromagnetic behaviour and unusual thermal decomposition of [Co{MeO(O)CC6H4NHC(S)NP(S)(OiPr)2}2]","New Journal of Chemistry","2012","36","12","2642","","10.1039/c2nj40868f","","","0.71073","MoKα","","0.0335","0.0289","","","0.0775","0.0792","","","","","","1.08","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054091","10.4743","0.0008","11.3943","0.0009","17.3391","0.0014","78.149","0.006","84.676","0.006","85.234","0.006","2012.2","0.3","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H44 Co N4 O8 P2 S4 -","- C30 H44 Co N4 O8 P2 S4 -","- C60 H88 Co2 N8 O16 P4 S8 -","2","1","","Babashkina, Maria G.; Safin, Damir A.; Railliet, Antoine P.; Bolte, Michael; Brzuszkiewicz, Anna; Kozlowski, Henryk; Garcia, Yann","Spin-canted ferromagnetic behaviour and unusual thermal decomposition of [Co{MeO(O)CC6H4NHC(S)NP(S)(OiPr)2}2]","New Journal of Chemistry","2012","36","12","2642","","10.1039/c2nj40868f","","","0.71073","MoKα","","0.0674","0.0554","","","0.1428","0.1492","","","","","","0.983","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054092","13.8833","0.0003","33.8521","0.0009","19.152","0.0004","90","","94.9954","0.0012","90","","8966.8","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C92 H88 Cl4 Cu2 N12 O22 -","- C92 H88 Cl4 Cu2 N12 O22 -","- C368 H352 Cl16 Cu8 N48 O88 -","4","1","","Wang, Wen-Zhen; Hsieh, Chang-Lin; Ismayilov, Rayyat H.; Hsu, Chia-Hung; Liu, Isiah Po-Chun; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming","Transition metal complexes of a super rigid anthyridine ligand: structural, magnetic and DFT studies","New Journal of Chemistry","2012","36","11","2340","","10.1039/c2nj40452d","","","0.71073","MoKα","","0.1969","0.0774","","","0.22","0.2667","","","","","","1.044","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054093","13.4297","0.0002","35.6133","0.0005","19.3597","0.0003","90","","99.9636","0.0007","90","","9119.6","0.2","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C82.27 H63.1 Cl4 N14.42 Ni2 O20.5 -","- C82.269 H56.961 Cl4 N14.423 Ni2 O20.5 -","- C329.076 H227.844 Cl16 N57.692 Ni8 O82 -","4","1","","Wang, Wen-Zhen; Hsieh, Chang-Lin; Ismayilov, Rayyat H.; Hsu, Chia-Hung; Liu, Isiah Po-Chun; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming","Transition metal complexes of a super rigid anthyridine ligand: structural, magnetic and DFT studies","New Journal of Chemistry","2012","36","11","2340","","10.1039/c2nj40452d","","","0.71073","MoKα","","0.1688","0.1084","","","0.2906","0.3155","","","","","","1.248","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054094","13.6511","0.0002","70.3157","0.0011","18.977","0.0004","90","","99.703","0.002","90","","17955.2","0.6","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C87 H64.5 Cl4 Co2 N15.5 O17.5 -","- C87 H64.5 Cl4 Co2 N15.5 O17.5 -","- C696 H516 Cl32 Co16 N124 O140 -","8","2","","Wang, Wen-Zhen; Hsieh, Chang-Lin; Ismayilov, Rayyat H.; Hsu, Chia-Hung; Liu, Isiah Po-Chun; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming","Transition metal complexes of a super rigid anthyridine ligand: structural, magnetic and DFT studies","New Journal of Chemistry","2012","36","11","2340","","10.1039/c2nj40452d","","","1.54178","CuKα","","0.2003","0.1398","","","0.3507","0.3707","","","","","","1.502","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054095","13.6133","0.0003","69.9138","0.0014","19.1264","0.0005","90","","99.834","0.002","90","","17936.2","0.7","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C177 H133.5 Cl8 N32.5 O34 Zn4 -","- C177 H133.5 Cl8 N32.5 O34 Zn4 -","- C708 H534 Cl32 N130 O136 Zn16 -","4","1","","Wang, Wen-Zhen; Hsieh, Chang-Lin; Ismayilov, Rayyat H.; Hsu, Chia-Hung; Liu, Isiah Po-Chun; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming","Transition metal complexes of a super rigid anthyridine ligand: structural, magnetic and DFT studies","New Journal of Chemistry","2012","36","11","2340","","10.1039/c2nj40452d","","","1.54178","CuKα","","0.1583","0.1237","","","0.304","0.3157","","","","","","1.831","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054096","13.6597","0.0004","70.1804","0.0014","19.0319","0.0005","90","","100.028","0.003","90","","17966.1","0.8","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C87 H62.5 Cl4 Fe2 N16.5 O16.5 -","- C87 H62.5 Cl4 Fe2 N16.5 O16.5 -","- C696 H500 Cl32 Fe16 N132 O132 -","8","2","","Wang, Wen-Zhen; Hsieh, Chang-Lin; Ismayilov, Rayyat H.; Hsu, Chia-Hung; Liu, Isiah Po-Chun; Liu, Yi-Hung; Lee, Gene-Hsiang; Peng, Shie-Ming","Transition metal complexes of a super rigid anthyridine ligand: structural, magnetic and DFT studies","New Journal of Chemistry","2012","36","11","2340","","10.1039/c2nj40452d","","","1.54178","CuKα","","0.187","0.1002","","","0.2382","0.2711","","","","","","1.117","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054097","5.2025","0.0003","17.5718","0.0014","20.0241","0.0013","90","","90","","90","","1830.5","0.2","120","2","120","2","","","","","","","","4","P 2 21 21","P 2bc 2","18","","","","- C39 H42 N2 O12 -","- C39 H42 N2 O12 -","- C78 H84 N4 O24 -","2","0.5","","Baghel, Garima Singh; Chinta, Jugun Prakash; Rao, Chebrolu P.","Synthesis, characterization of the amido-conjugates of 1,1′-methylene-bis(2-naphthol) and recognition of Cu2+ in aqueous acetonitrile","New Journal of Chemistry","2012","36","11","2397","","10.1039/c2nj40409e","","","0.71073","MoKα","","0.0669","0.0446","","","0.0883","0.0959","","","","","","0.993","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054098","17.022","0.003","27.254","0.006","26.995","0.005","90","","93.55","0.03","90","","12499","4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C119 H91 Cl2 N14 O7 Y3 -","- C119 H91 Cl2 N14 O7 Y3 -","- C476 H364 Cl8 N56 O28 Y12 -","4","1","","Zhang, Wenjuan; Liu, Shaofeng; Sun, Wen-Hua; Hao, Xiang; Redshaw, Carl","Trimetallic yttrium N-(2-methylquinolin-8-yl)benzamides: synthesis, structure and use in ring-opening polymerization (ROP) of ε-caprolactone","New Journal of Chemistry","2012","36","11","2392","","10.1039/c2nj40711f","","","0.71073","MoKα","","0.1553","0.1144","","","0.2674","0.2917","","","","","","1.138","","","","has coordinates","180094","2020-10-21","18:00:00",""
"7054099","15.229","0.004","16.593","0.004","16.934","0.004","90","","94.428","0.006","90","","4266.4","1.8","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C52 H80 Cd4 F24 N4 O37 Ti4 -","- C52 H80 Cd4 F24 N4 O37 Ti4 -","- C104 H160 Cd8 F48 N8 O74 Ti8 -","2","0.5","","Abu Bakar, Shahzad; Tajammul Hussain, Syed; Mazhar, Muhammad","CdTiO3 thin films from an octa-nuclear bimetallic single source precursor by aerosol assisted chemical vapor deposition (AACVD)","New Journal of Chemistry","2012","36","9","1844","","10.1039/c2nj40275k","","","0.71073","MoKα","","0.0805","0.0518","","","0.1346","0.1574","","","","","","1.043","","","","has coordinates,has disorder","180094","2020-10-21","18:00:00",""
"7054100","35.671","0.0009","10.436","0.0003","24.934","0.0008","90","","116.437","0.001","90","","8311.3","0.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36.75 H58.75 Al N2 O2 -","- C36 H56.9999 Al N2 O2 -","- C288 H455.999 Al8 N16 O16 -","8","1","","Hancock, Stuart L.; Jones, Matthew D.; Langridge, Conrad J.; Mahon, Mary F.","Al(iii)‒homopiperazine complexes and their exploitation for the production of polyesters","New Journal of Chemistry","2012","36","9","1891","","10.1039/c2nj40300e","","","0.71073","MoKα","","0.1319","0.1196","","","0.3258","0.335","","","","","","1.09","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054101","14.781","0.0002","15.101","0.0002","29.119","0.0004","90","","90","","90","","6499.59","0.15","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33.5 H49 Al N2 O2 -","- C33.5 H49 Al N2 O2 -","- C268 H392 Al8 N16 O16 -","8","2","","Hancock, Stuart L.; Jones, Matthew D.; Langridge, Conrad J.; Mahon, Mary F.","Al(iii)‒homopiperazine complexes and their exploitation for the production of polyesters","New Journal of Chemistry","2012","36","9","1891","","10.1039/c2nj40300e","","","0.71073","MoKα","","0.0676","0.0619","","","0.1606","0.1651","","","","","","1.091","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054102","32.935","0.003","7.056","0.001","31.375","0.004","90","","114.289","0.005","90","","6645.8","1.4","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H49 Al N2 O2 -","- C35 H48.5 Al N2 O2 -","- C280 H388 Al8 N16 O16 -","8","1","","Hancock, Stuart L.; Jones, Matthew D.; Langridge, Conrad J.; Mahon, Mary F.","Al(iii)‒homopiperazine complexes and their exploitation for the production of polyesters","New Journal of Chemistry","2012","36","9","1891","","10.1039/c2nj40300e","","","0.71073","MoKα","","0.1818","0.1154","","","0.2713","0.3088","","","","","","1.077","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054103","6.5494","0.0013","9.196","0.0018","23.512","0.005","90","","90.39","0.03","90","","1416.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H12 N4 O6 -","- C13 H12 N4 O6 -","- C52 H48 N16 O24 -","4","1","","Ding, Xue-Hua; Cui, Lin-Fang; Li, Yong-Hua; Wang, Shi; Huang, Wei","Proton-transfer supramolecular salts resulting from 3,5-dinitrobenzoic acid and aminomethyl pyridine","New Journal of Chemistry","2012","36","9","1884","","10.1039/c2nj40252a","","","0.71073","MoKα","","0.0781","0.0549","","","0.1351","0.1482","","","","","","1.092","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054104","7.4234","0.0015","11.738","0.002","17.698","0.004","102.99","0.03","100.52","0.03","101.26","0.03","1431.8","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H24 N8 O12 -","- C26 H24 N8 O12 -","- C52 H48 N16 O24 -","2","1","","Ding, Xue-Hua; Cui, Lin-Fang; Li, Yong-Hua; Wang, Shi; Huang, Wei","Proton-transfer supramolecular salts resulting from 3,5-dinitrobenzoic acid and aminomethyl pyridine","New Journal of Chemistry","2012","36","9","1884","","10.1039/c2nj40252a","","","0.71073","MoKα","","0.1177","0.0616","","","0.1385","0.1671","","","","","","1.032","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054105","6.877","0.0014","9.2116","0.0018","22.056","0.004","90","","90","","90","","1397.2","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H12 N4 O6 -","- C13 H12 N4 O6 -","- C52 H48 N16 O24 -","4","1","","Ding, Xue-Hua; Cui, Lin-Fang; Li, Yong-Hua; Wang, Shi; Huang, Wei","Proton-transfer supramolecular salts resulting from 3,5-dinitrobenzoic acid and aminomethyl pyridine","New Journal of Chemistry","2012","36","9","1884","","10.1039/c2nj40252a","","","0.71073","MoKα","","0.0456","0.0388","","","0.0881","0.0915","","","","","","1.083","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054106","4.7079","0.0004","7.0524","0.0008","14.1691","0.0017","94.124","0.004","91.235","0.003","102.963","0.003","456.92","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","picolinic acid magnesium nitrate tetrahydrate","","- C12 H18 Mg N4 O14 -","- C12 H18 Mg N4 O14 -","- C12 H18 Mg N4 O14 -","1","0.5","","Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C.","Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes","New Journal of Chemistry","2014","38","5","2135","","10.1039/c3nj01218b","","","0.71073","MoKα","","0.0324","0.0277","","","0.0732","0.0751","","","","","","1.119","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054107","6.976","0.0012","10.184","0.002","13.819","0.003","80.832","0.007","83.325","0.006","77.664","0.005","943.4","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","picolinic acid magnesium nitrate tetrahydrate","","- C12 H18 Mg N4 O14 -","- C12 H18 Mg N4 O14 -","- C24 H36 Mg2 N8 O28 -","2","1","","Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C.","Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes","New Journal of Chemistry","2014","38","5","2135","","10.1039/c3nj01218b","","","0.71075","MoKα","","0.0583","0.0341","","","0.0804","0.0994","","","","","","1.226","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7054108","6.1279","0.0006","8.1151","0.001","9.4126","0.0012","89.443","0.005","86.609","0.004","88.628","0.004","467.11","0.09","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","isonicotinic acid magnesium nitrate tetrahydrate","","- C12 H18 Mg N4 O14 -","- C12 H18 Mg N4 O14 -","- C12 H18 Mg N4 O14 -","1","0.5","","Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C.","Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes","New Journal of Chemistry","2014","38","5","2135","","10.1039/c3nj01218b","","","0.71075","MoKα","","0.0401","0.0332","","","0.0843","0.0888","","","","","","1.09","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054109","9.9683","0.0006","6.8418","0.0003","18.8376","0.001","90","","103.938","0.002","90","","1246.92","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","picolinic acid magnesium nitrate trihydrate","","- C6 H11 Mg N3 O11 -","- C6 H11 Mg N3 O11 -","- C24 H44 Mg4 N12 O44 -","4","1","","Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C.","Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes","New Journal of Chemistry","2014","38","5","2135","","10.1039/c3nj01218b","","","0.71073","MoKα","","0.0471","0.0381","","","0.0919","0.097","","","","","","1.102","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054110","9.561","0.0008","8.3362","0.0006","13.9891","0.001","90","","102.135","0.007","90","","1090.05","0.15","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4-pyridine dicarboxylate pentahydrate","","- C7 H12 Mg N O8.5 -","- C7 H12 Mg N O8.5 -","- C28 H48 Mg4 N4 O34 -","4","1","","Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C.","Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes","New Journal of Chemistry","2014","38","5","2135","","10.1039/c3nj01218b","","","0.71075","MoKα","","0.1317","0.0787","","","0.2056","0.2809","","","","","","1.135","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7054111","7.0638","0.0006","8.9852","0.0008","9.6628","0.0012","83.104","0.009","75.593","0.009","83.597","0.007","587.58","0.11","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","diaqua-bis(pyridine-2,4-dicarboxylato)-magnesium(II), magnesium hexahydrate, water solvate","","- C14 H28 Mg2 N2 O19 -","- C14 H28 Mg2 N2 O19 -","- C14 H28 Mg2 N2 O19 -","1","0.5","","Hamdy, Louise B.; Raithby, Paul R.; Thomas, Lynne H.; Wilson, Chick C.","Self-assembly synthesis of precursors to potential open framework alkali earth metal‒organic complexes","New Journal of Chemistry","2014","38","5","2135","","10.1039/c3nj01218b","","","0.71073","MoKα","","0.1042","0.0627","","","","0.1925","","","","","","1.078","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054112","6.8185","0.0002","9.5913","0.0003","10.5299","0.0003","90","","105.586","0.002","90","","663.31","0.03","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Mo4 O15 Y2 -","- Mo4 O15 Y2 -","- Mo8 O30 Y4 -","2","0.5","","Laufer, Sonja; Strobel, Sabine; Schleid, Thomas; Cybinska, Joanna; Mudring, Anja-Verena; Hartenbach, Ingo","Yttrium(iii) oxomolybdates(vi) as potential host materials for luminescence applications: an investigation of Eu3±doped Y2[MoO4]3 and Y2[MoO4]2[Mo2O7]","New Journal of Chemistry","2013","37","7","1919","","10.1039/c3nj00166k","","","0.71073","MoKα","","0.0277","0.0271","","","0.0704","0.071","","","","","","1.046","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054113","10.3021","0.0003","10.3241","0.0003","10.5725","0.0003","90","","90","","90","","1124.49","0.06","293","2","293","2","","","","","","","","3","P b a 2","P 2 -2ab","32","","","","- Mo3 O12 Y2 -","- Mo3 O12 Y2 -","- Mo12 O48 Y8 -","4","1","","Laufer, Sonja; Strobel, Sabine; Schleid, Thomas; Cybinska, Joanna; Mudring, Anja-Verena; Hartenbach, Ingo","Yttrium(iii) oxomolybdates(vi) as potential host materials for luminescence applications: an investigation of Eu3±doped Y2[MoO4]3 and Y2[MoO4]2[Mo2O7]","New Journal of Chemistry","2013","37","7","1919","","10.1039/c3nj00166k","","","0.71073","MoKα","","0.047","0.037","","","0.0721","0.0755","","","","","","1.032","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054114","7.2927","0.0002","7.2927","0.0002","10.5726","0.0003","90","","90","","90","","562.29","0.03","293","2","293","2","","","","","","","","3","P -4 21 m","P -4 2ab","113","","","","- Mo3 O12 Y2 -","- Mo3 O12 Y2 -","- Mo6 O24 Y4 -","2","0.25","","Laufer, Sonja; Strobel, Sabine; Schleid, Thomas; Cybinska, Joanna; Mudring, Anja-Verena; Hartenbach, Ingo","Yttrium(iii) oxomolybdates(vi) as potential host materials for luminescence applications: an investigation of Eu3±doped Y2[MoO4]3 and Y2[MoO4]2[Mo2O7]","New Journal of Chemistry","2013","37","7","1919","","10.1039/c3nj00166k","","","0.71073","MoKα","","0.0252","0.0221","","","0.0431","0.0439","","","","","","1.058","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054115","15.7778","0.0004","14.6264","0.0004","29.5827","0.0007","90","","97.554","0.001","90","","6767.6","0.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H25 Cd0.5 N6 O7 S -","- C24 H25 Cd0.5 N6 O7 S -","- C192 H200 Cd4 N48 O56 S8 -","8","1","","Lee, Hyo Hee; Jung, Sung Ho; Park, Sunhong; Park, Ki-Min; Jung, Jong Hwa","A metal‒organic framework gel with Cd2+ derived from only coordination bonds without intermolecular interactions and its catalytic ability","New Journal of Chemistry","2013","37","8","2330","","10.1039/c3nj00164d","","","0.71073","MoKα","","0.0366","0.0322","","","0.0845","0.0865","","","","","","1.099","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054116","11.497","0.002","11.542","0.002","12.417","0.003","113.9","0.03","106.8","0.03","99.11","0.03","1368.9","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H52 Br2 N10 O8 S2 -","- C56 H52 Br2 N10 O8 S2 -","- C56 H52 Br2 N10 O8 S2 -","1","0.5","","Sun, Hubin; Liu, Lang; Wu, Dongling; Jia, Dianzeng; Guo, Jixi","Synthesis, photochromic properties and thermal bleaching kinetics of pyrazolone phenylsemicarbazones containing a thiophene ring","New Journal of Chemistry","2013","37","8","2351","","10.1039/c3nj00241a","","","0.71073","MoKα","","0.0705","0.0404","","","0.0983","0.1405","","","","","","1.08","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054117","12.38","0.003","11.605","0.002","19.026","0.004","90","","104.66","0.03","90","","2644.5","1","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H22 Cl N5 O3 S -","- C27 H22 Cl N5 O3 S -","- C108 H88 Cl4 N20 O12 S4 -","4","1","","Sun, Hubin; Liu, Lang; Wu, Dongling; Jia, Dianzeng; Guo, Jixi","Synthesis, photochromic properties and thermal bleaching kinetics of pyrazolone phenylsemicarbazones containing a thiophene ring","New Journal of Chemistry","2013","37","8","2351","","10.1039/c3nj00241a","","","0.71073","MoKα","","0.1096","0.067","","","0.1671","0.1844","","","","","","1.057","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054118","16.558","0.005","11.363","0.004","17.351","0.004","90","","119.49","0.02","90","","2841.6","1.6","293","2","293","2","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 N2 O3 -","- C16 H14 N2 O3 -","- C128 H112 N16 O24 -","8","2","","Gupta, Puneet K.; Hussain, Mohd. Kamil; Asad, Mohd.; Kant, Ruchir; Mahar, Rohit; Shukla, Sanjeev K.; Hajela, Kanchan","A metal-free tandem approach to prepare structurally diverse N-heterocycles: synthesis of 1,2,4-oxadiazoles and pyrimidinones","New Journal of Chemistry","2014","38","7","3062","","10.1039/c4nj00361f","","","0.71075","MoKα","","0.0663","0.0479","","","0.1361","0.1663","","","","","","1.131","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054119","8.0476","0.0007","11.4511","0.001","16.8556","0.0014","90","","90","","90","","1553.3","0.2","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 Cl Mo N2 O2 -","- C15 H13 Cl Mo N2 O2 -","- C60 H52 Cl4 Mo4 N8 O8 -","4","1","","Bruno, Sofia M.; Gomes, Ana C.; Gamelas, Carla A.; Abrantes, Marta; Oliveira, M. Conceição; Valente, Anabela A.; Almeida Paz, Filipe A.; Pillinger, Martyn; Romão, Carlos C.; Gonçalves, Isabel S.","Application of an indenyl molybdenum dicarbonyl complex in the isomerisation of α-pinene oxide to campholenic aldehyde","New Journal of Chemistry","2014","38","7","3172","","10.1039/c4nj00371c","","","0.71073","MoKα","","0.0271","0.0233","","","0.0446","0.0457","","","","","","1.044","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054124","20.874","0.013","20.426","0.012","4.638","0.003","90","","90","","90","","1978","2","297","2","297","2","","","","","","","","5","P n a 21","P 2c -2n","33","3-chloro-lawsone oxime","","","- C10 H7 Cl N O3.5 -","- C10 H7 Cl N O3.5 -","- C80 H56 Cl8 N8 O28 -","8","2","","Zaware, Santosh B.; Gonnade, Rajesh G.; Srinivas, Darbha; Khan, Ayesha; Rane, Sandhya Y.","Antioxidant and anticancer activities of supramolecularly controlled magnetostructural halo-oximes of lawsone","New Journal of Chemistry","2011","35","8","1615","","10.1039/c1nj20176j","","","0.71073","MoKα","","0.1048","0.0808","","","0.1479","0.158","","","","","","1.16","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054125","21.092","0.006","20.588","0.006","4.6388","0.0013","90","","90","","90","","2014.4","1","297","2","297","2","","","","","","","","5","P n a 21","P 2c -2n","33","3-bromo-lawsone oxime","","","- C10 H6 Br N O3.63 -","- C10 H6 Br N O3.625 -","- C80 H48 Br8 N8 O29 -","8","2","","Zaware, Santosh B.; Gonnade, Rajesh G.; Srinivas, Darbha; Khan, Ayesha; Rane, Sandhya Y.","Antioxidant and anticancer activities of supramolecularly controlled magnetostructural halo-oximes of lawsone","New Journal of Chemistry","2011","35","8","1615","","10.1039/c1nj20176j","","","0.71073","MoKα","","0.0543","0.0425","","","0.0962","0.1019","","","","","","1.04","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054126","15.892","0.003","4.5575","0.0009","18.335","0.004","90","","110.667","0.003","90","","1242.5","0.4","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3-iodo-lawsone oxime","","","- C10 H10 I N O5 -","- C10 H10 I N O5 -","- C40 H40 I4 N4 O20 -","4","1","","Zaware, Santosh B.; Gonnade, Rajesh G.; Srinivas, Darbha; Khan, Ayesha; Rane, Sandhya Y.","Antioxidant and anticancer activities of supramolecularly controlled magnetostructural halo-oximes of lawsone","New Journal of Chemistry","2011","35","8","1615","","10.1039/c1nj20176j","","","0.71073","MoKα","","0.0283","0.0258","","","0.0645","0.066","","","","","","1.048","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054127","9.131","0.003","12.369","0.004","9.87","0.004","90","","117.337","0.013","90","","990.2","0.6","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","compound_1","","","- C12 H32 Co N6 O7 -","- C12 H32 Co N6 O7 -","- C24 H64 Co2 N12 O14 -","2","1","","Piñero Cruz, Dalice M.; Woodruff, Daniel N.; Jeon, Ie-Rang; Bhowmick, Indrani; Secu, Mihail; Hillard, Elizabeth A.; Dechambenoit, Pierre; Clérac, Rodolphe","Switching off the single-molecule magnet properties of the [CoII(Me6tren)(OH2)]2+module by complexation with trans-[RuIII(salen)(CN)2]−","New Journal of Chemistry","2014","38","8","3443","","10.1039/C4NJ00452C","","","0.71073","MoKα","","0.0615","0.0414","","","0.096","0.1185","","","","","","1.099","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054128","19.577","0.002","33.296","0.003","9.372","0.001","90","","103.641","0.003","90","","5936.7","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H85 Co2 N18 O12 Ru -","- C48 H83 Co2 N18 O12 Ru -","- C192 H332 Co8 N72 O48 Ru4 -","4","1","","Piñero Cruz, Dalice M.; Woodruff, Daniel N.; Jeon, Ie-Rang; Bhowmick, Indrani; Secu, Mihail; Hillard, Elizabeth A.; Dechambenoit, Pierre; Clérac, Rodolphe","Switching off the single-molecule magnet properties of the [CoII(Me6tren)(OH2)]2+module by complexation with trans-[RuIII(salen)(CN)2]−","New Journal of Chemistry","2014","38","8","3443","","10.1039/C4NJ00452C","","","0.71073","MoKα","","0.0706","0.0549","","","0.1568","0.1673","","","","","","1.133","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054131","13.3567","0.0007","20.1482","0.0007","26.9262","0.001","69.49","0.002","88.66","0.002","74.205","0.003","6509.7","0.5","123","0.1","123","0.1","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C123.5 H142 Cu2 F12 N8 O17 P2 Si2 -","- C123.5 H142 Cu2 F12 N8 O16.5 P2 Si2 -","- C247 H284 Cu4 F24 N16 O33 P4 Si4 -","2","1","","Collin, Jean-Paul; Sauvage, Jean-Pierre; Trolez, Yann; Rissanen, Kari","[3]Rotaxanes and [3]pseudorotaxanes with a rigid two-bidentate chelate axle threaded through two coordinating rings","New Journal of Chemistry","2009","33","10","2148","","10.1039/b9nj00278b","","x-ray","0.71073","MoKα","","0.218","0.1327","","","0.3318","0.379","","","","","","1.148","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054132","8.2379","0.0003","10.9417","0.0004","15.6797","0.0004","90","","93.2076","0.0008","90","","1411.1","0.08","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H15 F O -","- C19 H15 F O -","- C76 H60 F4 O4 -","4","1","","Takemura, Hiroyuki; Kaneko, Megumi; Sako, Katsuya; Iwanaga, Tetsuo","The intramolecular C‒F⋯HO hydrogen bond of 2-fluorophenyldiphenylmethanol","New Journal of Chemistry","2009","33","10","2004","","10.1039/b902203a","","","0.71069","MoKα","","0.0614","0.0544","","","0.1797","0.1831","","","","","","1.409","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054133","20.1947","0.0008","14.0122","0.0008","9.4085","0.0005","90","","96.926","0.004","90","","2642.9","0.2","123","","123","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C32 H34 Cu N2 O4 -","- C32 H34 Cu N2 O4 -","- C128 H136 Cu4 N8 O16 -","4","1","","Constable, Edwin C.; Zhang, Guoqi; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Woggon, Wolf-D.; Zampese, Jennifer A.","Enantioselective catalysts for the Henry reaction: fine-tuning the catalytic components","New Journal of Chemistry","2009","33","10","2166","","10.1039/b9nj00243j","","","0.71073","MoKα","","0.0403","0.0266","","0.0359","0.0281","0.0265","","","","","","1.069","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054134","20.412","0.004","13.926","0.003","9.4341","0.0019","90","","97.94","0.03","90","","2656","1","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C64 H69.34 Cu1.33 N4 O8 -","- C64 H69.34 Cu1.33 N4 O8 -","- C128 H138.68 Cu2.66 N8 O16 -","2","0.5","","Constable, Edwin C.; Zhang, Guoqi; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Woggon, Wolf-D.; Zampese, Jennifer A.","Enantioselective catalysts for the Henry reaction: fine-tuning the catalytic components","New Journal of Chemistry","2009","33","10","2166","","10.1039/b9nj00243j","","","0.71073","MoKα","","0.0397","0.0396","","","0.1288","0.1289","","","","","","1.127","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054135","8.4552","0.0002","17.3368","0.0004","10.8328","0.0002","90","","95.462","0.001","90","","1580.73","0.06","123","","123","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H20 Cu2 I3 N -","- C8 H20 Cu2 I3 N -","- C32 H80 Cu8 I12 N4 -","4","1","","Constable, Edwin C.; Zhang, Guoqi; Housecroft, Catherine E.; Neuburger, Markus; Schaffner, Silvia; Woggon, Wolf-D.; Zampese, Jennifer A.","Enantioselective catalysts for the Henry reaction: fine-tuning the catalytic components","New Journal of Chemistry","2009","33","10","2166","","10.1039/b9nj00243j","","","0.71073","MoKα","","0.0271","0.0178","","0.0276","0.0167","0.0162","","","","","","1.0936","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054136","10.267","0.005","13.751","0.006","29.045","0.013","90","","95.637","0.003","90","","4081","3","113","2","113","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C37.35 H26.01 Cl3 Fe Mn N8.67 O4.5 -","- C37.34 H23 Cl3 Fe Mn N8.67 O4.5 -","- C149.36 H92 Cl12 Fe4 Mn4 N34.68 O18 -","4","1","","Kou, Hui-Zhong; Ni, Zhong-Hai; Liu, Cai-Ming; Zhang, De-Qing; Cui, Ai-Li","Cyanide-bridged 1D Mn(iii)‒Fe(iii) bimetallic complexes: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2009","33","11","2296","","10.1039/b9nj00316a","","","0.7107","MoKα","","0.0931","0.0775","","","0.2129","0.2284","","","","","","1.079","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054137","11.013","0.002","15.613","0.003","20.586","0.004","91.74","0.03","92.56","0.03","90.89","0.03","3534","1.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H29 Cl2 Fe Mn N8 O5.5 -","- C37 H24 Cl2 Fe Mn N8 O5.5 -","- C148 H96 Cl8 Fe4 Mn4 N32 O22 -","4","2","","Kou, Hui-Zhong; Ni, Zhong-Hai; Liu, Cai-Ming; Zhang, De-Qing; Cui, Ai-Li","Cyanide-bridged 1D Mn(iii)‒Fe(iii) bimetallic complexes: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2009","33","11","2296","","10.1039/b9nj00316a","","","0.71073","MoKα","","0.1364","0.1031","","","0.2791","0.326","","","","","","1.133","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054138","11.1567","0.0009","15.4314","0.0013","20.8618","0.0017","91.765","0.002","92.646","0.002","91.871","0.002","3584","0.5","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H29 Br2 Fe Mn N8 O5.5 -","- C37 H24 Br2 Fe Mn N8 O5.5 -","- C148 H96 Br8 Fe4 Mn4 N32 O22 -","4","2","","Kou, Hui-Zhong; Ni, Zhong-Hai; Liu, Cai-Ming; Zhang, De-Qing; Cui, Ai-Li","Cyanide-bridged 1D Mn(iii)‒Fe(iii) bimetallic complexes: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2009","33","11","2296","","10.1039/b9nj00316a","","","0.71073","MoKα","","0.0869","0.0499","","","0.1127","0.1214","","","","","","1.059","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054139","11.292","0.0013","15.495","0.0017","20.801","0.003","92.693","0.007","93.138","0.006","92.065","0.0013","3627.4","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H35 Fe Mn N8 O5.5 -","- C39 H30 Fe Mn N8 O5.5 -","- C156 H120 Fe4 Mn4 N32 O22 -","4","2","","Kou, Hui-Zhong; Ni, Zhong-Hai; Liu, Cai-Ming; Zhang, De-Qing; Cui, Ai-Li","Cyanide-bridged 1D Mn(iii)‒Fe(iii) bimetallic complexes: synthesis, crystal structure and magnetic properties","New Journal of Chemistry","2009","33","11","2296","","10.1039/b9nj00316a","","","0.71073","MoKα","","0.088","0.07","","","0.1767","0.1925","","","","","","1.02","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054140","5.4823","0.0009","12.217","0.002","15.168","0.003","90","","90","","90","","1015.9","0.3","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H6 B F3 N2 O3 -","- C9 H6 B F3 N2 O3 -","- C36 H24 B4 F12 N8 O12 -","4","1","","Nizhnik, Yakov P.; Lu, Jianjiang; Rosokha, Sergiy V.; Kochi, Jay K.","Lewis acid effects on donor‒acceptor associations and redox reactions: ternary complexes of heteroaromatic N-oxides with boron trifluoride and organic donors","New Journal of Chemistry","2009","33","11","2317","","10.1039/b9nj00205g","","","0.71073","MoKα","","0.0663","0.0444","","","0.0904","0.0999","","","","","","1.026","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054141","14.799","0.003","8.197","0.0014","25.036","0.005","90","","90.744","0.005","90","","3036.8","1","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C41 H26 B F3 N2 O3 -","- C41 H26 B F3 N2 O3 -","- C164 H104 B4 F12 N8 O12 -","4","2","","Nizhnik, Yakov P.; Lu, Jianjiang; Rosokha, Sergiy V.; Kochi, Jay K.","Lewis acid effects on donor‒acceptor associations and redox reactions: ternary complexes of heteroaromatic N-oxides with boron trifluoride and organic donors","New Journal of Chemistry","2009","33","11","2317","","10.1039/b9nj00205g","","","0.71073","MoKα","","0.1589","0.0802","","","0.1716","0.2143","","","","","","1.057","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054142","7.0332","0.0014","10.3535","0.0019","29.588","0.006","90","","91.623","0.005","90","","2153.7","0.7","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 B Cl2 F3 N2 O3 -","- C22 H16 B Cl2 F3 N2 O3 -","- C88 H64 B4 Cl8 F12 N8 O12 -","4","1","","Nizhnik, Yakov P.; Lu, Jianjiang; Rosokha, Sergiy V.; Kochi, Jay K.","Lewis acid effects on donor‒acceptor associations and redox reactions: ternary complexes of heteroaromatic N-oxides with boron trifluoride and organic donors","New Journal of Chemistry","2009","33","11","2317","","10.1039/b9nj00205g","","","0.71073","MoKα","","0.1556","0.0784","","","0.1912","0.2358","","","","","","1.028","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054143","11.996","0.003","6.0475","0.0013","11.156","0.002","90","","90","","90","","809.3","0.3","173","2","173","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C5 H4 B F3 N2 O3 -","- C5 H4 B F3 N2 O3 -","- C20 H16 B4 F12 N8 O12 -","4","1","","Nizhnik, Yakov P.; Lu, Jianjiang; Rosokha, Sergiy V.; Kochi, Jay K.","Lewis acid effects on donor‒acceptor associations and redox reactions: ternary complexes of heteroaromatic N-oxides with boron trifluoride and organic donors","New Journal of Chemistry","2009","33","11","2317","","10.1039/b9nj00205g","","","0.71073","MoKα","","0.0798","0.0493","","","0.0919","0.1057","","","","","","1.004","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054144","8.1578","0.0016","8.203","0.0016","10.141","0.002","89.462","0.004","76.889","0.004","80.215","0.004","651","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C37 H24 N2 O3 -","- C37 H20 N2 O3 -","- C37 H20 N2 O3 -","1","0.5","","Nizhnik, Yakov P.; Lu, Jianjiang; Rosokha, Sergiy V.; Kochi, Jay K.","Lewis acid effects on donor‒acceptor associations and redox reactions: ternary complexes of heteroaromatic N-oxides with boron trifluoride and organic donors","New Journal of Chemistry","2009","33","11","2317","","10.1039/b9nj00205g","","","0.71073","MoKα","","0.1022","0.0648","","","0.1606","0.1877","","","","","","1.022","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054145","8.177","0.0002","14.841","0.0005","10.595","0.0003","90","","94.839","0.001","90","","1281.17","0.06","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C33 H30 B N O3 -","- C33 H30 B N O3 -","- C66 H60 B2 N2 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New Journal of Chemistry","2009","33","1","181","","10.1039/b815138e","","","0.71073","MoKα","","0.0681","0.0514","","","0.1221","0.1329","","","","","","1.031","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054146","12.827","0.0002","9.1145","0.0002","13.5149","0.0003","90","","90.4398","0.001","90","","1580","0.06","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C26 H32 B2 Cl6 N2 O3 -","- C26 H32 B2 Cl6 N2 O3 -","- C52 H64 B4 Cl12 N4 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New Journal of Chemistry","2009","33","1","181","","10.1039/b815138e","","","0.71073","MoKα","","0.0475","0.0437","","","0.1027","0.1059","","","","","","1.038","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054147","9.9035","0.0001","12.138","0.0002","13.9067","0.0002","78.842","0.001","72.3618","0.001","83.1794","0.001","1559.77","0.04","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H24 B2 Cl6 N2 O3 -","- C30 H24 B2 Cl6 N2 O3 -","- C60 H48 B4 Cl12 N4 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New Journal of Chemistry","2009","33","1","181","","10.1039/b815138e","","","0.71073","MoKα","","0.0829","0.0504","","","0.1244","0.1427","","","","","","1.026","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054148","10.523","0.0002","11.62","0.0003","13.052","0.0004","99.138","0.001","110.461","0.001","106.631","0.001","1371.87","0.06","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H31 B2 Cl3 N2 O3 -","- C27 H31 B2 Cl3 N2 O3 -","- C54 H62 B4 Cl6 N4 O6 -","2","1","","Galbraith, Ewan; Kelly, Andrew M.; Fossey, John S.; Kociok-Köhn, Gabriele; Davidson, Matthew G.; Bull, Steven D.; James, Tony D.","Dynamic covalent self-assembled macrocycles prepared from 2-formyl-aryl-boronic acids and 1,2-amino alcohols","New Journal of Chemistry","2009","33","1","181","","10.1039/b815138e","","","0.71073","MoKα","","0.067","0.0495","","","0.1125","0.1229","","","","","","1.027","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054149","7.5342","0.0003","11.7086","0.0005","12.0149","0.0005","103.096","0.001","91.041","0.001","104.119","0.001","998.11","0.07","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H34 Au Cl3 N4 O3 -","- C12 H34 Au Cl3 N4 O3 -","- C24 H68 Au2 Cl6 N8 O6 -","2","1","","Al-Jaroudi, Said S.; Monim-ul-Mehboob, M.; Altaf, Muhammad; Fettouhi, Mohammed; Wazeer, Mohammed I. M.; Altuwaijri, Saleh; Isab, Anvarhusein A.","Synthesis, spectroscopic characterization, X-ray structure and electrochemistry of new bis(1,2-diaminocyclohexane)gold(iii) chloride compounds and their anticancer activities against PC3 and SGC7901 cancer cell lines","New Journal of Chemistry","2014","38","7","3199","","10.1039/c3nj01624b","","","0.71073","MoKα","","0.0198","0.016","","","0.0405","0.0421","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054150","7.3996","0.0013","20.65","0.004","10.5543","0.0019","90","","93.558","0.003","90","","1609.6","0.5","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H46 Au2 Cl6 N6 O2 -","- C18 H46 Au2 Cl6 N6 O2 -","- C36 H92 Au4 Cl12 N12 O4 -","2","1","","Al-Jaroudi, Said S.; Monim-ul-Mehboob, M.; Altaf, Muhammad; Fettouhi, Mohammed; Wazeer, Mohammed I. M.; Altuwaijri, Saleh; Isab, Anvarhusein A.","Synthesis, spectroscopic characterization, X-ray structure and electrochemistry of new bis(1,2-diaminocyclohexane)gold(iii) chloride compounds and their anticancer activities against PC3 and SGC7901 cancer cell lines","New Journal of Chemistry","2014","38","7","3199","","10.1039/c3nj01624b","","","0.71073","MoKα","","0.0336","0.0294","","","0.0704","0.0718","","","","","","1.011","","","","has coordinates","188927","2020-10-21","18:00:00",""
"7054151","10.1962","0.0011","5.984","0.0004","15.6595","0.0016","90","","96.232","0.01","90","","949.8","0.16","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","4-methyl-2-[({[(4-methylphenyl)sulfonyl]amino}acetyl)amino]pentanoic acid hydrate","4-methyl-2-[({[(4-methylphenyl)sulfonyl]amino}acetyl)amino]pentanoic acid hydrate","","- C15 H24 N2 O6 S -","- C15 H24 N2 O6 S -","- C30 H48 N4 O12 S2 -","2","1","","Blatova, Olga A.; Asiri, Abdullah M.; Al-amshany, Zahra M.; Arshad, Muhammad Nadeem; Blatov, Vladislav A.","Molecular packings and specific-bonding patterns in sulfonamides","New Journal of Chemistry","2014","38","9","4099","","10.1039/C4NJ00392F","","","1.54184","CuKα","","0.0661","0.0435","","","0.0977","0.1177","","","","","","1.105","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054152","8.0437","0.0003","9.7182","0.0002","19.7716","0.0006","90","","90","","90","","1545.55","0.08","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","<i>N</i>'-[(1<i>E</i>)-1-(3-methoxyphenyl)ethylidene]benzenesulfonohydrazide","<i>N</i>'-[(1<i>E</i>)-1-(3-methoxyphenyl)ethylidene]benzenesulfonohydrazide","","- C15 H16 N2 O3 S -","- C15 H16 N2 O3 S -","- C60 H64 N8 O12 S4 -","4","1","","Blatova, Olga A.; Asiri, Abdullah M.; Al-amshany, Zahra M.; Arshad, Muhammad Nadeem; Blatov, Vladislav A.","Molecular packings and specific-bonding patterns in sulfonamides","New Journal of Chemistry","2014","38","9","4099","","10.1039/C4NJ00392F","","","1.54184","CuKα","","0.0321","0.0297","","","0.0744","0.0763","","","","","","1.065","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054153","8.3535","0.0002","15.3411","0.0003","17.7711","0.0005","90","","98.086","0.002","90","","2254.76","0.09","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","<i>N</i>'-[(1<i>E</i>,2<i>E</i>)-1-(4-bromophenyl)-3-(3,4-dimethoxyphenyl) prop-2-en-1-ylidene]benzenesulfonohydrazide","<i>N</i>'-[(1<i>E</i>,2<i>E</i>)-1-(4-bromophenyl)-3-(3,4-dimethoxyphenyl) prop-2-en-1-ylidene]benzenesulfonohydrazide","","- C23 H21 Br N2 O4 S -","- C23 H21 Br N2 O4 S -","- C92 H84 Br4 N8 O16 S4 -","4","1","","Blatova, Olga A.; Asiri, Abdullah M.; Al-amshany, Zahra M.; Arshad, Muhammad Nadeem; Blatov, Vladislav A.","Molecular packings and specific-bonding patterns in sulfonamides","New Journal of Chemistry","2014","38","9","4099","","10.1039/C4NJ00392F","","","1.54184","CuKα","","0.0462","0.042","","","0.1085","0.1117","","","","","","1.042","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054154","7.968","0.004","8.368","0.005","12.57","0.007","90","","90","","90","","838.1","0.8","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","\1","(2Z)-3-carboxy-1-hydroxy-2-pyridinium-1-ylprop-2-1-olate","","- C9 H7 N O4 -","- C9 H7 N O4 -","- C36 H28 N4 O16 -","4","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0371","0.0347","","","0.0841","0.0855","","","","","","1.056","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054155","11.119","0.003","8.057","0.002","12.839","0.003","90","","113.549","0.003","90","","1054.4","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","\2","(2Z)-3-carboxy-1-hydroxy-2-isoquinolinium-2-ylprop-2-en-1-olate","","- C13 H9 N O4 -","- C13 H9 N O4 -","- C52 H36 N4 O16 -","4","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0501","0.0409","","","0.1107","0.1174","","","","","","1.052","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054156","10.444","0.003","8.094","0.002","12.306","0.004","90","","110.376","0.006","90","","975.2","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","\3","(2Z)-3-carboxy-1-hydroxy-2-(3-hydroxypyridinium-1-yl)prop-2-en-1-olate","","- C9 H9 N O6 -","- C9 H9 N O6 -","- C36 H36 N4 O24 -","4","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0739","0.0519","","","0.1301","0.1392","","","","","","1.065","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054157","7.097","0.003","19.995","0.008","7.478","0.003","90","","112.227","0.005","90","","982.3","0.7","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","\4","(2Z)-3-carboxy-2-(4-cyanopyridinium-1-yl)-1-hydroxyprop-2-en-1-olate","","- C10 H6 N2 O4 -","- C10 H6 N2 O4 -","- C40 H24 N8 O16 -","4","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0524","0.0411","","","0.1028","0.1104","","","","","","1.055","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054158","7.189","0.005","7.5","0.005","9.557","0.007","82.788","0.007","87.499","0.007","64.972","0.007","463.2","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","\5","(2Z)-3-carboxy-2-(4-carboxypyridinium-1-yl)-1-hydroxyprop-2-en-1-olate","","- C10 H7 N O6 -","- C10 H7 N O6 -","- C20 H14 N2 O12 -","2","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0321","0.0311","","","0.0841","0.0851","","","","","","1.046","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7054159","7.344","0.005","7.851","0.005","9.78","0.006","91.428","0.007","94.012","0.007","106.401","0.007","539","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","\5a","4-carboxypyridinium, carboxy-propynoate hydrate","","- C10 H9 N O7 -","- C10 H9 N O7 -","- C20 H18 N2 O14 -","2","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0488","0.0421","","","0.1152","0.1187","","","","","","1.087","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054160","13.856","0.006","8.011","0.003","25.655","0.011","90","","92.488","0.007","90","","2845","2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","\6~H2O~","(2Z)-3-carboxy-1-hydroxy-2-(4-phenylpyridinium-1-yl)prop-2-en-1-olate hydrate","","- C15 H14.42 N O5.71 -","- C15 H14.418 N O5.709 -","- C120 H115.344 N8 O45.672 -","8","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0884","0.0472","","","0.1037","0.1236","","","","","","1.008","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054161","13.746","0.005","7.408","0.002","14.216","0.005","90","","90.223","0.004","90","","1447.6","0.8","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","\6~MeOH~","(2Z)-3-carboxy-1-hydroxy-2-(4-phenylpyridinium-1-yl)prop-2-en-1-olate methanol solvate","","- C16 H15 N O5 -","- C16 H15 N O5 -","- C64 H60 N4 O20 -","4","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.0495","0.0363","","","0.0882","0.0957","","","","","","1.037","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054162","16.831","0.007","7.267","0.003","20.065","0.008","90","","110.56","0.006","90","","2297.8","1.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","\6a","bis(4-phenylpyridinium) carboxy-propynoate methanol solvate","","- C27 H24 N2 O5 -","- C27 H24 N2 O5 -","- C108 H96 N8 O20 -","4","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.1013","0.0532","","","0.1166","0.1408","","","","","","0.976","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054163","15.1432","0.0011","7.6866","0.0005","22.3032","0.0016","90","","90","","90","","2596.1","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","\7","(2Z)-2-(4-benzylpyridinium-1-yl-3-carboxy-1-hydroxyprop-2-en-1-olate","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C128 H104 N8 O32 -","8","1","","Loots, Leigh; Haynes, Delia A.; Roex, Tanya le","Synthesis and solid-state supramolecular chemistry of a series of pyridinium-derived zwitterions","New Journal of Chemistry","2014","38","7","2778","","10.1039/c4nj00281d","","","0.71073","MoKα","","0.043","0.0379","","","0.0973","0.1011","","","","","","1.019","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054164","3.2689","0.0002","3.2689","0.0002","9.4008","0.0012","90","","90","","120","","86.996","0.013","293","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Iron(II) cyanamide","","- C Fe N2 -","- C Fe N2 -","- C2 Fe2 N4 -","2","0.0833333","","Herlitschke, M.; Tchougréeff, A. L.; Soudackov, A. V.; Klobes, B.; Stork, L.; Dronskowski, R.; Hermann, R. P.","Magnetism and lattice dynamics of FeNCN compared to FeO","New J. Chem.","2014","38","10","4670","","10.1039/C4NJ00097H","","","","","","0.0545","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054165","12.261","0.005","13.887","0.006","20.738","0.008","89.996","0.007","88.163","0.007","85.016","0.007","3516","2","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H69 Cl2 N4 O21.5 Zn4 -","- C54 H69 Cl2 N4 O21.5 Zn4 -","- C108 H138 Cl4 N8 O43 Zn8 -","2","1","","Chen, Zhanfen; Wang, Xiaoyong; Chen, Jingwen; Yang, Xiaoliang; Li, Yizhi; Guo, Zijian","Selective sensing of dihydrogen phosphate anion by a fluorescent tetranuclear pentacoordinated zinc(ii) complex","New Journal of Chemistry","2007","31","3","357","","10.1039/b616451j","","","0.71073","MoKα","","0.0884","0.061","","","0.1207","0.1268","","","","","","1.047","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054166","8.7192","0.0007","26.3","0.001","15.251","0.002","90","0.005","91.521","0.006","90","0.004","3496.1","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","awc8040_KS","","","- C64 H56 Br8 O9 -","- C64 H56 Br8 O9 -","- C128 H112 Br16 O18 -","2","0.5","","Perret, Florent; Suwinska, Kinga; Bertino Ghera, Bernard; Parrot-Lopez, Hélène; Coleman, Anthony W.","Synthesis, solid state structures and interfacial properties of new para-phosphonato-O-alkoxy-calix[8]arene derivatives","New Journal of Chemistry","2007","31","6","893","900","10.1039/b616480n","","","0.71073","MoKα","","0.147","0.085","","","0.237","0.2693","","","","","","1.032","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054167","15.8507","0.0003","16.6896","0.0003","18.4507","0.0004","107.079","0.001","90.82","0.001","114.725","0.001","4184.8","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","awc8044","","","- C88 H104 Br8 O8 -","- C88 H104 Br8 O8 -","- C176 H208 Br16 O16 -","2","1","","Perret, Florent; Suwinska, Kinga; Bertino Ghera, Bernard; Parrot-Lopez, Hélène; Coleman, Anthony W.","Synthesis, solid state structures and interfacial properties of new para-phosphonato-O-alkoxy-calix[8]arene derivatives","New Journal of Chemistry","2007","31","6","893","900","10.1039/b616480n","","","0.71073","MoKα","","0.119","0.079","","","0.164","0.181","","","","","","1.07","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054168","14.752","0.001","5.7461","0.0002","17.339","0.001","90","","90.87","0.01","90","","1469.6","0.14","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-bis(phenylethynyl)thiophene","","- C20 H12 S -","- C20 H12 S -","- C80 H48 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.1032","0.0497","","","0.1042","0.1272","","","","","","1.01","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054169","16.0717","0.0015","5.0902","0.0005","21.2336","0.0019","90","","112.217","0.01","90","","1608.1","0.3","120","2","120","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,5-bis(p-methylphenylethynyl)thiophene","","- C22 H16 S -","- C22 H16 S -","- C88 H64 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0688","0.0464","","","0.1001","0.1087","","","","","","1.022","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054170","7.1798","0.0008","45.453","0.004","5.8879","0.0004","90","","90","","90","","1921.5","0.3","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","2,5-bis(p-carbomethoxyphenylethynyl)thiophene","","- C24 H16 O4 S -","- C24 H16 O4 S -","- C96 H64 O16 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0504","0.0463","","","0.1135","0.1159","","","","","","1.039","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054171","4.9212","0.0007","31.274","0.004","11.3413","0.0015","90","","101.83","0.01","90","","1708.4","0.4","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,5-bis(pentafluorophenylethynyl)thiophene","","- C20 H2 F10 S -","- C20 H2 F10 S -","- C80 H8 F40 S4 -","4","1","","Siddle, Jamie S.; Ward, Richard M.; Collings, Jonathan C.; Rutter, Simon R.; Porrés, Laurent; Applegarth, Lucas; Beeby, Andrew; Batsanov, Andrei S.; Thompson, Amber L.; Howard, Judith A. K.; Boucekkine, Abdou; Costuas, Karine; Halet, Jean-François; Marder, Todd B.","Synthesis, photophysics and molecular structures of luminescent 2,5-bis(phenylethynyl)thiophenes (BPETs)","New Journal of Chemistry","2007","31","6","841","851","10.1039/b701172e","","","0.71073","MoKα","","0.0652","0.0474","","","0.1028","0.11","","","","","","1.099","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054172","14.566","0.002","25.954","0.003","25.644","0.003","90","","99.295","0.002","90","","9567","2","153","2","153","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C76 H115 O44 P2 S4 Yb -","- C76 H59 O44.01 P2 S4 Yb -","- C304 H236 O176.04 P8 S16 Yb4 -","4","2","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.1869","0.1476","","","0.3611","0.3923","","","","","","1.113","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054173","32.032","0.005","11.43","0.002","50.944","0.007","90","","91.744","0.002","90","","18643","5","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C156 H180 Cl Gd2.67 Na2 O78 P3 S12 -","- C156 H120 Cl Gd2.66 Na2 O78 P3 S12 -","- C624 H480 Cl4 Gd10.64 Na8 O312 P12 S48 -","4","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.2607","0.1206","","","0.2897","0.3779","","","","","","1.063","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054174","14.624","0.001","19.987","0.002","25.192","0.002","67.801","0.001","74.982","0.001","89.74","0.001","6548.7","1","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C217 H314 Cl Gd5.33 O132 P4 S16 -","- C217 H188 Cl Gd5.34 O132 P4 S16 -","- C217 H188 Cl Gd5.34 O132 P4 S16 -","1","0.5","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.0874","0.0699","","","0.1794","0.195","","","","","","1.048","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054175","12.6687","0.0008","14.9526","0.0009","18.497","0.002","96.405","0.007","100.594","0.008","107.678","0.006","3228.7","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H59.5 O33.5 P S4 Yb -","- C53 H42 O33.5 P S4 Yb -","- C106 H84 O67 P2 S8 Yb2 -","2","1","","Makha, Mohamed; Alias, Yatimah; Raston, Colin L.; Sobolev, Alexandre N.","Controlling the interplay of large organic ions: para-sulfonato-calix[4]arene and phosphonium cations","New Journal of Chemistry","2007","31","5","662","","10.1039/b615639h","","","0.71073","MoKα","","0.0835","0.0556","","","0.1384","0.1498","","","","","","1.007","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054176","10.747","0.0002","13.1706","0.0002","18.122","0.0004","90","","90","","90","","2565.07","0.08","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Catena-[tris(5-tertbutylpyrazole)sulfatocobalt(II)]","","- C21 H36 Co N6 O4 S -","- C21 H36 Co N6 O4 S -","- C84 H144 Co4 N24 O16 S4 -","4","1","","Jones, Leigh F.; Kilner, Colin A.; Halcrow, Malcolm A.","A comparison of different methods for fitting susceptibility data of cobalt(ii) coordination polymers in a new cobalt(ii)/sulfate 1-D chain","New Journal of Chemistry","2007","31","8","1530","","10.1039/b700987a","","","0.71073","MoKα","","0.0363","0.0314","","","0.0743","0.077","","","","","","1.028","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054177","7.7471","0.0009","11.7596","0.0015","19.604","0.002","90","","90.778","0.005","90","","1785.8","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 Fe2 N O6 S2 -","- C13 H13 Fe2 N O6 S2 -","- C52 H52 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.048","","","0.0928","0.1028","","","","","","1.084","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054178","9.6577","0.0002","13.0873","0.0001","14.9696","0.0002","90","","92.793","0.001","90","","1889.81","0.05","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Fe2 N O6 S2 -","- C14 H15 Fe2 N O6 S2 -","- C56 H60 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0521","","","0.1259","0.1328","","","","","","1.024","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054179","10.604","0.003","12.035","0.004","15.428","0.004","90","","92.439","0.006","90","","1967.1","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 Fe2 N O6 S2 -","- C15 H17 Fe2 N O6 S2 -","- C60 H68 Fe8 N4 O24 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.031","","","0.0894","0.1074","","","","","","1.097","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054180","12.4237","0.0005","14.1988","0.0006","14.6021","0.0006","98.333","0.001","91.911","0.001","94.471","0.001","2538.28","0.18","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H31 Fe2 N O4 P2 S2 -","- C17 H31 Fe2 N O4 P2 S2 -","- C68 H124 Fe8 N4 O16 P8 S8 -","4","2","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0785","","","0.2815","0.3076","","","","","","0.992","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054181","22.819","0.005","10.912","0.002","23.588","0.005","90","","118.581","0.002","90","","5157.7","1.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 Fe2 N O4 P2 S2 -","- C18 H33 Fe2 N O4 P2 S2 -","- C144 H264 Fe16 N8 O32 P16 S16 -","8","2","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.0568","","","0.0973","0.1064","","","","","","1.108","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054182","11.0584","0.0006","22.4454","0.001","11.6423","0.0006","90","","113.615","0.002","90","","2647.7","0.2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H35 Fe2 N O4 P2 S2 -","- C19 H35 Fe2 N O4 P2 S2 -","- C76 H140 Fe8 N4 O16 P8 S8 -","4","1","","Si, Youtao; Ma, Chengbing; Hu, Mingqiang; Chen, Hui; Chen, Changneng; Liu, Qiutian","(N-CnH2n‒1)-1,3-Azapropanedithiolate (n = 5, 6, 7)-bridged diiron complexes as mimics for the active site of [FeFe]-hydrogenases: the influence of the bridge on the diiron complex","New Journal of Chemistry","2007","31","8","1448","","10.1039/b616236c","","","0.71073","MoKα","","","0.041","","","0.1335","0.1394","","","","","","1.071","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054183","9.9882","0.0004","14.1537","0.0005","14.7208","0.0008","64.158","0.002","86.751","0.003","70.732","0.003","1758.73","0.14","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H39 N9 O7 S2 -","- C33 H39 N9 O7 S2 -","- C66 H78 N18 O14 S4 -","2","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.0976","0.0561","","","0.1274","0.1467","","","","","","1.023","","","","has coordinates,has disorder","180095","2020-10-21","18:00:00",""
"7054184","19.3932","0.0004","5.8774","0.0001","19.4872","0.0004","90","","102.842","0.001","90","","2165.62","0.07","120","2","120","2","","","","","","","Matthew Fisher","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 N7 O3 S -","- C23 H21 N7 O3 S -","- C92 H84 N28 O12 S4 -","4","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.0681","0.0505","","","0.1252","0.1377","","","","","","1.082","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054185","10.5481","0.0003","13.6951","0.0004","16.4507","0.0006","87.777","0.002","80.974","0.002","77.225","0.002","2288.88","0.13","120","2","120","2","","","","","","","Matthew Fisher","4","P -1","-P 1","2","","","","- C49 H49.67 N15 O7.34 -","- C49 H49.66 N15 O7.33 -","- C98 H99.32 N30 O14.66 -","2","1","","Fisher, Matthew G.; Gale, Philip A.; Light, Mark E.","A simple benzimidazole-based receptor for barbiturate and urea neutral guests that functions in polar solvent mixtures","New Journal of Chemistry","2007","31","9","1583","","10.1039/b705854c","","","0.71073","MoKα","","0.1353","0.097","","","0.2437","0.2727","","","","","","1.064","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054186","8.6717","0.0002","9.0238","0.0002","9.3952","0.0003","90","","94.504","0.003","90","","732.92","0.03","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N10 Ni -","- C12 H16 N10 Ni -","- C24 H32 N20 Ni2 -","2","0.5","","Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal","Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide","New Journal of Chemistry","2014","38","8","3529","","10.1039/C4NJ00374H","","","0.71073","MoKα","","0.027","0.0226","","","0.0561","0.0584","","","","","","1.052","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054187","6.9212","0.0005","8.2733","0.0005","9.9826","0.0006","67.059","0.006","72.775","0.006","65.514","0.006","472.84","0.06","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C6 H8 Cu N8 -","- C6 H8 Cu N8 -","- C12 H16 Cu2 N16 -","2","1","","Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal","Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide","New Journal of Chemistry","2014","38","8","3529","","10.1039/C4NJ00374H","","","0.71073","MoKα","","0.0302","0.0251","","","0.0623","0.0646","","","","","","1.045","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054188","8.6111","0.0002","9.1061","0.0002","9.3794","0.0002","90","","93.735","0.002","90","","733.91","0.03","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 Cu N10 -","- C12 H16 Cu N10 -","- C24 H32 Cu2 N20 -","2","0.5","","Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal","Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide","New Journal of Chemistry","2014","38","8","3529","","10.1039/C4NJ00374H","","","0.71073","MoKα","","0.0311","0.0248","","","0.0688","0.0717","","","","","","1.197","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054189","7.4717","0.0015","8.9361","0.0018","9.391","0.002","76.781","0.018","75.283","0.018","71","0.019","566.1","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H16 Cu3 N22 -","- C12 H16 Cu3 N22 -","- C12 H16 Cu3 N22 -","1","0.5","","Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal","Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide","New Journal of Chemistry","2014","38","8","3529","","10.1039/C4NJ00374H","","","0.71073","MoKα","","0.0903","0.0646","","","0.1653","0.1958","","","","","","1.038","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054190","8.752","0.003","9.098","0.003","9.408","0.003","90","","94.347","0.006","90","","747","0.4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 N10 Zn -","- C12 H16 N10 Zn -","- C24 H32 N20 Zn2 -","2","0.5","","Sunkari, Sailaja S.; Kharediya, Bhagwan; Saha, Satyen; Elrez, Bahjat; Sutter, Jean-Pascal","Chain of dimers to assembly of trimers: temperature and ligand influenced formation of novel supramolecular assemblies of Cu(ii) with isomeric (aminomethyl) pyridines and azide","New Journal of Chemistry","2014","38","8","3529","","10.1039/C4NJ00374H","","","0.71073","MoKα","","0.0228","0.0217","","","0.0613","0.0622","","","","","","1.082","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054191","5.9271","0.0015","12.79","0.003","12.361","0.003","90","","100.163","0.013","90","","922.4","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 N S -","- C9 H11 N S -","- C36 H44 N4 S4 -","4","1","","Basu, Basudeb; Kundu, Samir","Unprecedented amidation of ‘transient’ aryl thioaldehydes by N,N-dimethylformamide under basic conditions","New Journal of Chemistry","2014","38","8","3367","","10.1039/C4NJ00480A","","","0.71073","MoKα","","0.0609","0.0419","","","0.1287","0.1447","","","","","","0.935","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054192","10.1194","0.0003","14.4115","0.0004","7.3274","0.0002","90","","106.198","0.002","90","","1026.18","0.05","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H10 Cl N S -","- C9 H10 Cl N S -","- C36 H40 Cl4 N4 S4 -","4","1","","Basu, Basudeb; Kundu, Samir","Unprecedented amidation of ‘transient’ aryl thioaldehydes by N,N-dimethylformamide under basic conditions","New Journal of Chemistry","2014","38","8","3367","","10.1039/C4NJ00480A","","","0.71073","MoKα","","0.0715","0.0465","","","0.131","0.1418","","","","","","0.935","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054193","9.5997","0.0012","10.9697","0.0015","15.236","0.002","99.118","0.002","96.954","0.002","94.303","0.002","1565.2","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H56 Ag2 N18 O16 -","- C62 H56 Ag2 N18 O16 -","- C62 H56 Ag2 N18 O16 -","1","0.5","","Wu, Huilu; Zhang, Yanhui; Chen, Chengyong; Zhang, Jiawen; Bai, Yuchen; Shi, Furong; Wang, Xiaoli","DNA-binding studies and antioxidant activities of two-, three- and four-coordinate silver(i) complexes containing bis(2-benzimidazolyl)aniline derivatives","New Journal of Chemistry","2014","38","8","3688","","10.1039/C4NJ00503A","","","0.71073","MoKα","","0.04","0.0359","","","0.0984","0.1053","","","","","","1.096","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054194","14.0351","0.0016","15.1423","0.0012","15.6532","0.0018","106.739","0.008","116.252","0.001","98.591","0.007","2704.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H58 Ag N13 O8 -","- C58 H58 Ag N13 O8 -","- C116 H116 Ag2 N26 O16 -","2","1","","Wu, Huilu; Zhang, Yanhui; Chen, Chengyong; Zhang, Jiawen; Bai, Yuchen; Shi, Furong; Wang, Xiaoli","DNA-binding studies and antioxidant activities of two-, three- and four-coordinate silver(i) complexes containing bis(2-benzimidazolyl)aniline derivatives","New Journal of Chemistry","2014","38","8","3688","","10.1039/C4NJ00503A","","","0.71073","MoKα","","0.0478","0.037","","","0.0985","0.106","","","","","","1.038","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054195","6.951","0.004","17.701","0.009","24.901","0.013","90","","90","","90","","3064","3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H29 Ag N8 O7 -","- C32 H29 Ag N8 O7 -","- C128 H116 Ag4 N32 O28 -","4","1","","Wu, Huilu; Zhang, Yanhui; Chen, Chengyong; Zhang, Jiawen; Bai, Yuchen; Shi, Furong; Wang, Xiaoli","DNA-binding studies and antioxidant activities of two-, three- and four-coordinate silver(i) complexes containing bis(2-benzimidazolyl)aniline derivatives","New Journal of Chemistry","2014","38","8","3688","","10.1039/C4NJ00503A","","","0.71073","MoKα","","0.0401","0.033","","","0.0721","0.0756","","","","","","1.053","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054196","7.932","0.006","10.674","0.008","10.901","0.009","91.188","0.012","106.211","0.011","90.163","0.012","886","1.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H15 Br3 S2 -","- C16 H15 Br3 S2 -","- C32 H30 Br6 S4 -","2","1","","Cauteruccio, Silvia; Dova, Davide; Graiff, Claudia; Carrara, Claudio; Doulcet, Julien; Stephenson, G. Richard; Licandro, Emanuela","A non-photochemical route to synthesize simple benzo[1,2-b:4,3-b′]dithiophenes: FeCl3-mediated cyclization of dithienyl ethenes","New Journal of Chemistry","2014","38","6","2241","","10.1039/c3nj01567j","","","0.71073","MoKα","","0.1213","0.0463","","","0.0885","0.1103","","","","","","0.948","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054197","26.9821","0.0016","6.2025","0.0003","18.9375","0.0011","90","","103.184","0.002","90","","3085.8","0.3","100","","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H46 S2 Si2 -","- C28 H46 S2 Si2 -","- C112 H184 S8 Si8 -","4","0.5","","Glöcklhofer, Florian; Lumpi, Daniel; Stöger, Berthold; Fröhlich, Johannes","Multigram synthesis of bis[(trimethylsilyl)ethynyl]benzenes suitable for post-polymerization modification","New Journal of Chemistry","2014","38","6","2229","","10.1039/c4nj00011k","","x-ray","0.71073","MoKα","","0.0513","0.0335","","","0.0362","0.0375","","","","1.94","1.94","1.76","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054198","27.0042","0.0005","6.2978","0.0016","19.0383","0.0012","90","","102.186","0.0014","90","","3164.8","0.8","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H46 Se2 Si2 -","- C28 H46 Se2 Si2 -","- C112 H184 Se8 Si8 -","4","0.5","","Glöcklhofer, Florian; Lumpi, Daniel; Stöger, Berthold; Fröhlich, Johannes","Multigram synthesis of bis[(trimethylsilyl)ethynyl]benzenes suitable for post-polymerization modification","New Journal of Chemistry","2014","38","6","2229","","10.1039/c4nj00011k","","x-ray","0.71073","MoKα","","0.0743","0.0396","","","0.041","0.0436","","","","2","2","1.74","","","","has coordinates","180095","2020-10-21","18:00:00",""
"7054199","10.4283","0.0008","10.1568","0.0009","16.254","0.0014","90","","100.454","0.003","90","","1693","0.2","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H46 O4 S2 Si2 -","- C28 H46 O4 S2 Si2 -","- C56 H92 O8 S4 Si4 -","2","0.5","","Glöcklhofer, Florian; Lumpi, Daniel; Stöger, Berthold; Fröhlich, Johannes","Multigram synthesis of bis[(trimethylsilyl)ethynyl]benzenes suitable for post-polymerization modification","New Journal of Chemistry","2014","38","6","2229","","10.1039/c4nj00011k","","x-ray","0.71073","MoKα","","0.0747","0.0543","","","0.0712","0.0722","","","","4.53","4.53","4.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054200","10.5718","0.0004","11.4215","0.0005","15.7806","0.0007","79.158","0.002","81.398","0.002","80.819","0.002","1833.35","0.13","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","[Pd2Hg4Cl6(Te(2,6-OCH3)2C6H3)6].2DMF","","- C27 H34 Cl3 Hg2 N O7 Pd Te3 -","- C27 H34 Cl3 Hg2 N O7 Pd Te3 -","- C54 H68 Cl6 Hg4 N2 O14 Pd2 Te6 -","2","1","","Tirloni, Barbara; Lang, Ernesto Schulz; de Oliveira, Gelson Manzoni; Piquini, Paulo; Hörner, Manfredo","Synthesis, crystal structure, and optical characteristics of [Pd2Hg4Cl6{Te(DMB)}6]·2DMF, [HgClTe(DMB)]4, and the ring-forming cluster [Pd12(TePh)24]·2DMF","New Journal of Chemistry","2014","38","6","2394","","10.1039/c3nj01455j","","","0.71073","MoKα","","0.0706","0.0408","","","0.1024","0.1298","","","","","","1.09","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054201","35.392","0.003","19.4685","0.0017","25.583","0.002","90","","92.237","0.006","90","","17614","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","[Pd12(TePh)24].2DMF","","- C75 H67 N O Pd6 Te12 -","- C75 H67 N O Pd6 Te12 -","- C600 H536 N8 O8 Pd48 Te96 -","8","1","","Tirloni, Barbara; Lang, Ernesto Schulz; de Oliveira, Gelson Manzoni; Piquini, Paulo; Hörner, Manfredo","Synthesis, crystal structure, and optical characteristics of [Pd2Hg4Cl6{Te(DMB)}6]·2DMF, [HgClTe(DMB)]4, and the ring-forming cluster [Pd12(TePh)24]·2DMF","New Journal of Chemistry","2014","38","6","2394","","10.1039/c3nj01455j","","","0.71073","MoKα","","0.1618","0.075","","","0.1662","0.2025","","","","","","1.027","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054202","13.6219","0.0001","12.3303","0.0001","14.266","0.0001","90","","114.291","0.001","90","","2184.01","0.03","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[Hg4Cl4(Te(2,6-OCH3)2C6H3)4]","","- C16 H18 Cl2 Hg2 O4 Te2 -","- C16 H18 Cl2 Hg2 O4 Te2 -","- C64 H72 Cl8 Hg8 O16 Te8 -","4","1","","Tirloni, Barbara; Lang, Ernesto Schulz; de Oliveira, Gelson Manzoni; Piquini, Paulo; Hörner, Manfredo","Synthesis, crystal structure, and optical characteristics of [Pd2Hg4Cl6{Te(DMB)}6]·2DMF, [HgClTe(DMB)]4, and the ring-forming cluster [Pd12(TePh)24]·2DMF","New Journal of Chemistry","2014","38","6","2394","","10.1039/c3nj01455j","","","0.71073","MoKα","","0.0299","0.0199","","","0.0385","0.0413","","","","","","1.039","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054203","12.8104","0.0004","9.7998","0.0002","15.3326","0.0004","90","","113.436","0.003","90","","1766.05","0.09","150","","150.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 N6 O -","- C21 H20 N6 O -","- C84 H80 N24 O4 -","4","1","","Sathyanarayana, Arruri; Prabusankar, Ganesan","Facile access to imidazole and imidazolium substituted dibenzo-diazocines","New Journal of Chemistry","2014","38","8","3613","","10.1039/C4NJ00351A","","","1.54184","","","0.044808","0.040048","","","","0.107918","","","","","","1.0528","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054204","12.936","0.0005","9.8962","0.0003","15.4643","0.0005","90","","113.922","0.004","90","","1809.64","0.12","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H20 N6 O -","- C21 H20 N6 O -","- C84 H80 N24 O4 -","4","1","","Sathyanarayana, Arruri; Prabusankar, Ganesan","Facile access to imidazole and imidazolium substituted dibenzo-diazocines","New Journal of Chemistry","2014","38","8","3613","","10.1039/C4NJ00351A","","","1.5418","CuKα","","0.065177","0.057767","","","","0.15714","","","","","","1.04393","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054205","25.14","0.004","5.5409","0.0005","13.9897","0.0017","90","","122.157","0.019","90","","1649.8","0.5","150","","150","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C21 H18 N6 -","- C21 H18 N6 -","- C84 H72 N24 -","4","0.5","","Sathyanarayana, Arruri; Prabusankar, Ganesan","Facile access to imidazole and imidazolium substituted dibenzo-diazocines","New Journal of Chemistry","2014","38","8","3613","","10.1039/C4NJ00351A","","","1.54184","","","0.0514","0.041","","","","0.1152","","","","","","1.0401","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054206","10.93","0.0002","16.8443","0.0003","14.0472","0.0003","90","","107.695","0.003","90","","2463.85","0.09","298","","298.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 I2 N6 -","- C23 H24 I2 N6 -","- C92 H96 I8 N24 -","4","1","","Sathyanarayana, Arruri; Prabusankar, Ganesan","Facile access to imidazole and imidazolium substituted dibenzo-diazocines","New Journal of Chemistry","2014","38","8","3613","","10.1039/C4NJ00351A","","","1.5418","CuKα","","0.060348","0.05204","","","","0.142201","","","","","","1.04529","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054207","10.1807","0.0005","13.9648","0.0007","20.5397","0.0009","90","","101.629","0.005","90","","2860.2","0.2","150","","150","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C27 H32 I2 N6 -","- C27 H32 I2 N6 -","- C108 H128 I8 N24 -","4","0.5","","Sathyanarayana, Arruri; Prabusankar, Ganesan","Facile access to imidazole and imidazolium substituted dibenzo-diazocines","New Journal of Chemistry","2014","38","8","3613","","10.1039/C4NJ00351A","","","1.54184","","","0.041248","0.032518","","","","0.083808","","","","","","1.02054","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054208","8.3442","0.001","12.5633","0.0012","15.0779","0.0016","84.154","0.008","79.178","0.01","87.113","0.009","1543.7","0.3","150","","153","","","","","","","","","5","P -1","-P 1","2","","","","- C33 H32 Cl2 N8 O -","- C33 H30 Cl2 N8 O -","- C66 H60 Cl4 N16 O2 -","2","1","","Sathyanarayana, Arruri; Prabusankar, Ganesan","Facile access to imidazole and imidazolium substituted dibenzo-diazocines","New Journal of Chemistry","2014","38","8","3613","","10.1039/C4NJ00351A","","","1.5418","CuKα","","0.114942","0.072302","","","","0.224077","","","","","","1.08965","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054209","13.236","0.005","13.934","0.005","18.545","0.005","102.109","0.005","90.215","0.005","112.416","0.005","3078.2","1.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","di-naphtalen-boron-substituted Bodipy","","","- C38 H39 B N2 -","- C38 H39 B N2 -","- C152 H156 B4 N8 -","4","2","","Ulrich, Gilles; Goze, Christine; Goeb, Sébastien; Retailleau, Pascal; Ziessel, Raymond","New fluorescent aryl- or ethynylaryl-boron-substituted indacenes as promising dyes","New Journal of Chemistry","2006","30","7","982","986","10.1039/b604830g","","","0.71069","MoKα","","0.0881","0.0587","","","0.1565","0.1809","","","","","","1.028","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054210","24.3724","0.0009","22.2422","0.0008","23.34","0.001","90","0.002","119.279","0.002","90","0.003","11036.1","0.8","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","para-sulfonatocalix(8)arene / 1,4-hexanediammonium cation complex","","","- C69 H64 N6 O35 S8 -","- C69 H64 N6 O35 S8 -","- C276 H256 N24 O140 S32 -","4","0.5","","Perret, Florent; Bonnard, Vanessa; Danylyuk, Oksana; Suwinska, Kinga; Coleman, Anthony W.","Conformational extremes in the supramolecular assemblies of para-sulfonato-calix[8]arene","New Journal of Chemistry","2006","30","7","987","","10.1039/b604349f","","","0.71073","MoKα","","0.2058","0.1892","","","0.4826","0.4992","","","","","","2.196","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054211","12.5225","0.0001","25.6792","0.0003","14.5478","0.0002","90","0.001","102.421","0.001","90","0.001","4568.61","0.09","100","2","100","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","para-sulfonatocalix(8)arene / 1,2-cis-cyclohexanediammonium cation","","","- C80 H104 N8 O40 S8 -","- C80 H104 N8 O40 S8 -","- C160 H208 N16 O80 S16 -","2","0.5","","Perret, Florent; Bonnard, Vanessa; Danylyuk, Oksana; Suwinska, Kinga; Coleman, Anthony W.","Conformational extremes in the supramolecular assemblies of para-sulfonato-calix[8]arene","New Journal of Chemistry","2006","30","7","987","","10.1039/b604349f","","","0.71073","MoKα","","0.2641","0.235","","","0.6173","0.6225","","","","","","2.689","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054212","8.7347","0.0007","11.5839","0.0009","14.6847","0.0011","90","","90.829","0.001","90","","1485.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 Cr N O3 -","- C17 H13 Cr N O3 -","- C68 H52 Cr4 N4 O12 -","4","1","","Che, Yanchao; Tian, Xiaohui; Chen, Hui; Tang, Zhenyu; Lin, Jiaping","Syntheses and third-order NLO properties of ?6 complexes of N-ethylcarbazole with Cr(CO)3 and Cr(CO)2PPh3 moieties","New Journal of Chemistry","2006","30","6","883","","10.1039/b518346d","","","0.71073","MoKα","","0.0469","0.0402","","","0.1098","0.1141","","","","","","1.021","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054213","10.0091","0.0009","10.7369","0.001","14.6282","0.0014","90.88","0.002","90.925","0.002","101.742","0.002","1538.7","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H30 Cl2 Cr N O2 P -","- C35 H30 Cl2 Cr N O2 P -","- C70 H60 Cl4 Cr2 N2 O4 P2 -","2","1","","Che, Yanchao; Tian, Xiaohui; Chen, Hui; Tang, Zhenyu; Lin, Jiaping","Syntheses and third-order NLO properties of ?6 complexes of N-ethylcarbazole with Cr(CO)3 and Cr(CO)2PPh3 moieties","New Journal of Chemistry","2006","30","6","883","","10.1039/b518346d","","","0.71073","MoKα","","0.0851","0.0699","","","0.2109","0.2249","","","","","","1.112","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054214","17.511","0.0005","6.5385","0.0002","17.3475","0.0004","90","","108.249","0.003","90","","1886.32","0.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Dimethylglycinium hydrogen squarate","Dimethylglycine-squaric acid","","- C16 H22 N2 O12 -","- C16 H22 N2 O12 -","- C64 H88 N8 O48 -","4","1","","Anioła, Michalina; Dega-Szafran, Zofia; Katrusiak, Andrzej; Szafran, Mirosław","NH⋯O and OH⋯O interactions of glycine derivatives with squaric acid","New Journal of Chemistry","2014","38","8","3556","","10.1039/C4NJ00212A","","","0.71073","MoKα","","0.061","0.0386","","","0.097","0.1042","","","","","","0.968","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054215","16.8392","0.0003","8.3163","0.0002","15.8267","0.0003","90","","100.063","0.002","90","","2182.27","0.08","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Diglycinium squarate","","","- C8 H12 N2 O8 -","- C8 H12 N2 O8 -","- C64 H96 N16 O64 -","8","1","","Anioła, Michalina; Dega-Szafran, Zofia; Katrusiak, Andrzej; Szafran, Mirosław","NH⋯O and OH⋯O interactions of glycine derivatives with squaric acid","New Journal of Chemistry","2014","38","8","3556","","10.1039/C4NJ00212A","","","0.71073","MoKα","","0.042","0.0382","","","0.1098","0.1159","","","","","","0.697","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054216","16.6068","0.0002","7.21436","0.00008","15.4441","0.00017","90","","97.0249","0.0011","90","","1836.43","0.04","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Sarcosinium hydrogen squarate semihydrate","","","- C7 H10 N O6.5 -","- C7 H10 N O6.5 -","- C56 H80 N8 O52 -","8","1","","Anioła, Michalina; Dega-Szafran, Zofia; Katrusiak, Andrzej; Szafran, Mirosław","NH⋯O and OH⋯O interactions of glycine derivatives with squaric acid","New Journal of Chemistry","2014","38","8","3556","","10.1039/C4NJ00212A","","","1.54184","CuKα","","0.0337","0.0331","","","0.1013","0.102","","","","","","0.807","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7054218","22.2718","0.0014","6.0451","0.0003","16.2765","0.0008","90","","90","","90","","2191.4","0.2","296","2","296","2","","","","","","","","4","P c a 21","P 2c -2ac","29","Betainium hydrogen squarate","Betainium hydrogen squarate","","- C9 H13 N O6 -","- C9 H13 N O6 -","- C72 H104 N8 O48 -","8","2","","Anioła, Michalina; Dega-Szafran, Zofia; Katrusiak, Andrzej; Szafran, Mirosław","NH⋯O and OH⋯O interactions of glycine derivatives with squaric acid","New Journal of Chemistry","2014","38","8","3556","","10.1039/C4NJ00212A","","","0.71073","MoKα","","0.0942","0.04","","","0.0891","0.1069","","","","","","0.766","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054219","11.3826","0.0005","23.7917","0.0006","11.395","0.0004","90","","98.948","0.004","90","","3048.34","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 Hg N4 O4 S4 -","- C30 H26 Hg N4 O4 S4 -","- C120 H104 Hg4 N16 O16 S16 -","4","1","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.1257","0.0633","","","0.1348","0.1574","","","","","","1.007","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054220","9.4813","0.0007","9.88","0.0007","11.0632","0.001","92.892","0.006","95.604","0.007","109.777","0.006","966.69","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H18 Hg N4 S4 -","- C16 H18 Hg N4 S4 -","- C32 H36 Hg2 N8 S8 -","2","1","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.0726","0.0463","","","0.0967","0.1073","","","","","","1.013","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054221","23.103","0.002","6.2441","0.0015","18.0358","0.0015","90","","94.053","0.009","90","","2595.3","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 Hg N4 O2 S4 -","- C24 H22 Hg N4 O2 S4 -","- C96 H88 Hg4 N16 O8 S16 -","4","0.5","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.0635","0.0421","","","0.0774","0.0854","","","","","","0.989","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054222","8.401","0.0019","12.5882","0.0019","16.095","0.002","82.07","0.013","89.048","0.015","86.522","0.015","1682.7","0.5","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C60 H60 Hg2 N8 S8 -","- C60 H60 Hg2 N8 S8 -","- C60 H60 Hg2 N8 S8 -","1","1","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.081","0.0622","","","0.1644","0.1809","","","","","","1.021","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054224","33.117","0.004","4.6178","0.001","19.233","0.003","90","","109.774","0.016","90","","2767.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H22 Hg N4 S4 -","- C28 H22 Hg N4 S4 -","- C112 H88 Hg4 N16 S16 -","4","0.5","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.0932","0.0569","","","0.1196","0.1376","","","","","","0.992","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054225","6.9071","0.0012","13.1487","0.0019","26.875","0.004","90","","90","","90","","2440.8","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H12 N2 S -","- C14 H12 N2 S -","- C112 H96 N16 S8 -","8","1","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.1023","0.0517","","","0.1079","0.1254","","","","","","0.965","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054226","9.194","0.002","12.569","0.003","13.936","0.003","78.93","0.02","89.934","0.018","87.58","0.02","1579","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H58 N8 O S8 Zn2 -","- C58 H58 N8 O S8 Zn2 -","- C58 H58 N8 O S8 Zn2 -","1","0.5","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.1943","0.0887","","","0.2075","0.2586","","","","","","0.929","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054227","9.5002","0.0005","10.9038","0.0006","12.1293","0.0009","81.21","0.005","72.113","0.006","81.781","0.004","1175.5","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H56 N4 O8 S8 Zn2 -","- C36 H56 N4 O8 S8 Zn2 -","- C36 H56 N4 O8 S8 Zn2 -","1","0.5","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.1173","0.0591","","","0.1039","0.1278","","","","","","0.965","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054228","10.751","0.002","7.834","0.003","18.396","0.003","67.026","0.016","81.671","0.017","84.999","0.015","1410.6","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H30 N4 S4 Zn -","- C28 H30 N4 S4 Zn -","- C56 H60 N8 S8 Zn2 -","2","1","","Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai","Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer","New Journal of Chemistry","2014","38","8","3737","","10.1039/C4NJ00435C","","","0.71073","MoKα","","0.1156","0.0815","","","0.2214","0.2441","","","","","","1.048","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054229","20.803","0.003","6.3637","0.0008","25.24","0.003","90","","99.136","0.002","90","","3299","0.7","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H33 N3 Pd S4 -","- C35 H33 N3 Pd S4 -","- C140 H132 N12 Pd4 S16 -","4","0.5","","Ehsan, Muhammad Ali; Ming, Huang Nay; McKee, Vickie; Peiris, Thalge Anton Nirmal; Wijayantha-Kahagala-Gamage, Upul; Arifin, Zainudin; Mazhar, Muhammad","Vysotskite structured photoactive palladium sulphide thin films from dithiocarbamate derivatives","New Journal of Chemistry","2014","38","9","4083","","10.1039/C4NJ00564C","","","0.71073","MoKα","","0.0378","0.0283","","","0.0606","0.064","","","","","","1.049","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054230","9.961","0.0013","14.0277","0.0019","12.1552","0.0016","90","","104.023","0.002","90","","1647.8","0.4","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H49 N3 Pd S4 -","- C31 H49 N3 Pd S4 -","- C62 H98 N6 Pd2 S8 -","2","0.5","","Ehsan, Muhammad Ali; Ming, Huang Nay; McKee, Vickie; Peiris, Thalge Anton Nirmal; Wijayantha-Kahagala-Gamage, Upul; Arifin, Zainudin; Mazhar, Muhammad","Vysotskite structured photoactive palladium sulphide thin films from dithiocarbamate derivatives","New Journal of Chemistry","2014","38","9","4083","","10.1039/C4NJ00564C","","","0.71073","MoKα","","0.0519","0.0348","","","0.0773","0.0832","","","","","","0.999","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054231","12.3351","0.0011","20.5728","0.0019","25.918","0.002","90","","90","","90","","6577.1","1","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H52 N2 Pd S4 -","- C26 H52 N2 Pd S4 -","- C208 H416 N16 Pd8 S32 -","8","1","","Ehsan, Muhammad Ali; Ming, Huang Nay; McKee, Vickie; Peiris, Thalge Anton Nirmal; Wijayantha-Kahagala-Gamage, Upul; Arifin, Zainudin; Mazhar, Muhammad","Vysotskite structured photoactive palladium sulphide thin films from dithiocarbamate derivatives","New Journal of Chemistry","2014","38","9","4083","","10.1039/C4NJ00564C","","","0.71073","MoKα","","0.0731","0.0375","","","0.0817","0.0955","","","","","","1.01","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054232","9.9199","0.0007","11.0292","0.0007","10.1444","0.0007","90","","114.696","0.001","90","","1008.37","0.12","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H28 N2 Pd S4 -","- C16 H28 N2 Pd S4 -","- C32 H56 N4 Pd2 S8 -","2","0.5","","Ehsan, Muhammad Ali; Ming, Huang Nay; McKee, Vickie; Peiris, Thalge Anton Nirmal; Wijayantha-Kahagala-Gamage, Upul; Arifin, Zainudin; Mazhar, Muhammad","Vysotskite structured photoactive palladium sulphide thin films from dithiocarbamate derivatives","New Journal of Chemistry","2014","38","9","4083","","10.1039/C4NJ00564C","","","0.71073","MoKα","","0.0327","0.0262","","","0.0623","0.0651","","","","","","1.063","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054233","13.6795","0.0005","14.0922","0.0006","15.6687","0.0007","90","","90","","90","","3020.5","0.2","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H28 N7 O4 S3 Y -","- C25 H28 N7 O4 S3 Y -","- C100 H112 N28 O16 S12 Y4 -","4","1","","Petrosyants, Svetlana; Dobrokhotova, Zhanna; Ilyukhin, Andrey; Novotortsev, Vladimir","Supramolecular aggregation of yttrium thiocyanate with 4,4′-bipyridine","New Journal of Chemistry","2014","38","8","3803","","10.1039/C4NJ00598H","","","0.71073","MoKα","","0.0937","0.0465","","","0.0756","0.0897","","","","","","0.955","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054234","15.0003","0.0012","15.3686","0.0009","15.1311","0.0008","90","","112.679","0.002","90","","3218.5","0.4","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H60 N14 O8 S6 Y2 -","- C52 H60 N14 O8 S6 Y2 -","- C104 H120 N28 O16 S12 Y4 -","2","0.5","","Petrosyants, Svetlana; Dobrokhotova, Zhanna; Ilyukhin, Andrey; Novotortsev, Vladimir","Supramolecular aggregation of yttrium thiocyanate with 4,4′-bipyridine","New Journal of Chemistry","2014","38","8","3803","","10.1039/C4NJ00598H","","","0.71073","MoKα","","0.1045","0.0637","","","0.1332","0.1552","","","","","","0.968","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054235","13.995","0.004","15.465","0.004","15.478","0.004","90","","114.419","0.004","90","","3050.3","1.4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H46 N16 O6 S8 Y2 -","- C48 H46 N16 O6 S8 Y2 -","- C96 H92 N32 O12 S16 Y4 -","2","0.5","","Petrosyants, Svetlana; Dobrokhotova, Zhanna; Ilyukhin, Andrey; Novotortsev, Vladimir","Supramolecular aggregation of yttrium thiocyanate with 4,4′-bipyridine","New Journal of Chemistry","2014","38","8","3803","","10.1039/C4NJ00598H","","","0.71073","MoKα","","0.0784","0.0457","","","0.1333","0.1575","","","","","","1.062","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054236","11.8885","0.0006","15.5251","0.0009","22.7683","0.0011","90","","102.245","0.002","90","","4106.7","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H35 N10 O5 S4 Y -","- C34 H33 N10 O5 S4 Y -","- C136 H132 N40 O20 S16 Y4 -","4","1","","Petrosyants, Svetlana; Dobrokhotova, Zhanna; Ilyukhin, Andrey; Novotortsev, Vladimir","Supramolecular aggregation of yttrium thiocyanate with 4,4′-bipyridine","New Journal of Chemistry","2014","38","8","3803","","10.1039/C4NJ00598H","","","0.71073","MoKα","","0.1064","0.0447","","","0.0939","0.1179","","","","","","0.937","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054237","10.922","0.005","17.836","0.011","28.622","0.018","90","","98.157","0.018","90","","5519","5","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C47 H44 N15 O4 S7 Y -","- C47 H40.5 N15 O4 S7 Y -","- C188 H162 N60 O16 S28 Y4 -","4","2","","Petrosyants, Svetlana; Dobrokhotova, Zhanna; Ilyukhin, Andrey; Novotortsev, Vladimir","Supramolecular aggregation of yttrium thiocyanate with 4,4′-bipyridine","New Journal of Chemistry","2014","38","8","3803","","10.1039/C4NJ00598H","","","0.71073","MoKα","","0.2513","0.0889","","","0.1724","0.2255","","","","","","0.884","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054238","14.789","0.0009","18.1748","0.0012","19.6738","0.0012","90","","106.229","0.002","90","","5077.3","0.6","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H37 N14 O S6 Y -","- C46 H37 N14 O S6 Y -","- C184 H148 N56 O4 S24 Y4 -","4","1","","Petrosyants, Svetlana; Dobrokhotova, Zhanna; Ilyukhin, Andrey; Novotortsev, Vladimir","Supramolecular aggregation of yttrium thiocyanate with 4,4′-bipyridine","New Journal of Chemistry","2014","38","8","3803","","10.1039/C4NJ00598H","","","0.71073","MoKα","","0.0872","0.0408","","","0.0875","0.1039","","","","","","0.989","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054239","9.362","0.01","21.55","0.02","19.379","0.016","90","","98.64","0.02","90","","3865","6","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H29 N10 O2 S4 Y -","- C34 H29 N10 O2 S4 Y -","- C136 H116 N40 O8 S16 Y4 -","4","1","","Petrosyants, Svetlana; Dobrokhotova, Zhanna; Ilyukhin, Andrey; Novotortsev, Vladimir","Supramolecular aggregation of yttrium thiocyanate with 4,4′-bipyridine","New Journal of Chemistry","2014","38","8","3803","","10.1039/C4NJ00598H","","","0.71073","MoKα","","0.1759","0.1286","","","0.286","0.3007","","","","","","1.517","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054240","9.735","0.001","12.588","0.003","12.131","0.002","90","","112.65","0.01","90","","1371.9","0.4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis[isopropoxy(thiocarbonyl)]disulfane","","- C8 H14 O2 S4 -","- C8 H14 O2 S4 -","- C32 H56 O8 S16 -","4","1","","Juncal, Luciana C.; Tobón, Yeny A.; Piro, Oscar E.; Della Védova, Carlos O.; Romano, Rosana M.","Structural, spectroscopic and theoretical studies on dixanthogens: (ROC(S)S)2, with R = n-propyl and isopropyl","New Journal of Chemistry","2014","38","8","3708","","10.1039/C4NJ00708E","","","1.54184","CuKα","","0.0806","0.072","","","0.1911","0.2066","","","","","","1.065","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054241","18.949","0.002","18.949","0.002","18.949","0.002","117.25","0.02","117.25","0.02","117.25","0.02","2879","6","","","293","2","","","","","","","","4","R -3 :R","-P 3*","148","N-(2'-Methylphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12- dicarboximide","N-(2'-Methylphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboximide","","- C25 H19 N O2 -","- C25 H19 N O2 -","- C150 H114 N6 O12 -","6","1","","Seisenbaeva, Gulaim A.; Gohil, Suresh; Jansson, Kjell; Herbst, Konrad; Brorson, Michael; Kessler, Vadim G.","Solution interaction of O-donor ligand metal complexes with thiocarbonyl compounds?a new general route to metal sulfide materials","New Journal of Chemistry","2003","27","7","1059","","10.1039/b300398c","","","1.54178","CuKα","","0.0486","0.0436","","0.1172","","0.1124","","","","","","1.122","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054242","10.489","0.003","10.626","0.002","17.737","0.003","79.166","0.014","79.92","0.02","89.27","0.02","1911.3","0.7","","","293","2","","","","","","","","4","P -1","-P 1","2","N-(2'-Methoxyphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12- dicarboximide","N-(2'-Methoxyphenyl)-9,10-dihydro-9,10- ethanoanthracene-11,12-dicarboximide","","- C25 H19 N O3 -","- C25 H19 N O3 -","- C100 H76 N4 O12 -","4","2","","Seisenbaeva, Gulaim A.; Gohil, Suresh; Jansson, Kjell; Herbst, Konrad; Brorson, Michael; Kessler, Vadim G.","Solution interaction of O-donor ligand metal complexes with thiocarbonyl compounds?a new general route to metal sulfide materials","New Journal of Chemistry","2003","27","7","1059","","10.1039/b300398c","","","1.54178","CuKα","","0.0521","0.0463","","0.1408","","0.1338","","","","","","1.085","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054243","10.9","0.002","12.637","0.003","15.214","0.004","90","","108.16","0.02","90","","1991.2","0.8","","","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N-(2'-Ethoxyphenyl)-9,10-dihydro-9,10-ethanoanthracene-11,12- dicarboximide","N-(2'-Ethoxyphenyl)-9,10-dihydro-9,10- ethanoanthracene-11,12-dicarboximide","","- C26 H21 N O3 -","- C26 H21 N O3 -","- C104 H84 N4 O12 -","4","1","","Seisenbaeva, Gulaim A.; Gohil, Suresh; Jansson, Kjell; Herbst, Konrad; Brorson, Michael; Kessler, Vadim G.","Solution interaction of O-donor ligand metal complexes with thiocarbonyl compounds?a new general route to metal sulfide materials","New Journal of Chemistry","2003","27","7","1059","","10.1039/b300398c","","","1.54178","CuKα","","0.0481","0.044","","0.1254","","0.1207","","","","","","1.064","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054244","6.07446","0.00013","8.98778","0.00019","24.241","0.0006","90","","90","","90","","1323.46","0.05","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(R)-2,3,3,3-Tetrafluoro-N-methyl-N-((R)-1-phenylethyl)propanamide","","- C12 H13 F4 N O -","- C12 H13 F4 N O -","- C48 H52 F16 N4 O4 -","4","1","","Bilska-Markowska, Monika; Rapp, Magdalena; Siodła, Tomasz; Katrusiak, Andrzej; Hoffmann, Marcin; Koroniak, Henryk","Tri- and tetrafluoropropionamides derived from chiral secondary amines ‒ synthesis and the conformational studies","New Journal of Chemistry","2014","38","8","3819","","10.1039/C4NJ00317A","","","1.54184","CuKα","","0.047","0.0441","","","0.1384","0.1423","","","","","","1.106","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054245","8.2841","0.0004","8.9822","0.0004","9.6248","0.0004","86.725","0.003","82.846","0.002","81.578","0.002","702.39","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H26 Cu2 N6 O8 -","- C28 H26 Cu2 N6 O8 -","- C28 H26 Cu2 N6 O8 -","1","0.5","","Jena, Himanshu Sekhar","Effect of non-covalent interaction on the diastereoselective self-assembly of Cu(ii) complexes containing a racemic Schiff base in a chiral self-discriminating process","New Journal of Chemistry","2014","38","6","2486","","10.1039/c3nj01547e","","","0.71073","MoKα","","0.0131","0.013","","","0.1081","0.1082","","","","","","1.057","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054246","23.672","0.002","8.6741","0.0007","27.466","0.003","90","","139.368","0.005","90","","3672.6","0.7","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H15 Cl Cu N2 O6 -","- C14 H15 Cl Cu N2 O6 -","- C112 H120 Cl8 Cu8 N16 O48 -","8","1","","Jena, Himanshu Sekhar","Effect of non-covalent interaction on the diastereoselective self-assembly of Cu(ii) complexes containing a racemic Schiff base in a chiral self-discriminating process","New Journal of Chemistry","2014","38","6","2486","","10.1039/c3nj01547e","","","0.71073","MoKα","","0.0525","0.0525","","","0.1845","0.1845","","","","","","1.006","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054247","20.096","0.0016","7.3459","0.0005","23.542","0.002","90","","127.245","0.006","90","","2766.6","0.4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H26 Cu2 N10 O2 -","- C28 H26 Cu2 N10 O2 -","- C112 H104 Cu8 N40 O8 -","4","0.5","","Jena, Himanshu Sekhar","Effect of non-covalent interaction on the diastereoselective self-assembly of Cu(ii) complexes containing a racemic Schiff base in a chiral self-discriminating process","New Journal of Chemistry","2014","38","6","2486","","10.1039/c3nj01547e","","","0.71073","MoKα","","0.0566","0.0457","","","0.1285","0.1383","","","","","","1.009","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054248","7.539","0.0004","18.0643","0.0009","11.6901","0.0006","90","","109.23","0.003","90","","1503.21","0.14","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 Cu2 N6 O2 S2 -","- C30 H26 Cu2 N6 O2 S2 -","- C60 H52 Cu4 N12 O4 S4 -","2","0.5","","Jena, Himanshu Sekhar","Effect of non-covalent interaction on the diastereoselective self-assembly of Cu(ii) complexes containing a racemic Schiff base in a chiral self-discriminating process","New Journal of Chemistry","2014","38","6","2486","","10.1039/c3nj01547e","","","0.71073","MoKα","","0.1618","0.0425","","","0.0755","0.0925","","","","","","1.004","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054249","7.9869","0.0004","16.1585","0.0007","10.9541","0.0005","90","","99.58","0.002","90","","1393.98","0.11","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 Cu N3 O2 -","- C15 H13 Cu N3 O2 -","- C60 H52 Cu4 N12 O8 -","4","1","","Jena, Himanshu Sekhar","Effect of non-covalent interaction on the diastereoselective self-assembly of Cu(ii) complexes containing a racemic Schiff base in a chiral self-discriminating process","New Journal of Chemistry","2014","38","6","2486","","10.1039/c3nj01547e","","","0.71073","MoKα","","0.043","0.0305","","","0.0833","0.09","","","","","","1.045","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054250","13.7348","0.001","11.2507","0.0007","34.837","0.003","90","","91.443","0.004","90","","5381.5","0.7","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H80 Co2 N16 O22 S3 -","- C24 H80 Co2 N16 O22 S3 -","- C96 H320 Co8 N64 O88 S12 -","4","0.5","","Ribeiro, Susana; Cunha-Silva, Luís; Balula, Salete S.; Gago, Sandra","Cobalt(iii) sepulchrate complexes: application as sustainable oxidative catalysts","New Journal of Chemistry","2014","38","6","2500","","10.1039/c4nj00120f","","","0.71073","MoKα","","0.0604","0.0492","","","0.1116","0.1165","","","","","","1.055","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054251","27.553","0.003","7.7658","0.0008","17.6413","0.0018","90","","110.441","0.002","90","","3537","0.6","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 F3 N O2 -","- C20 H16 F3 N O2 -","- C160 H128 F24 N8 O16 -","8","1","","Li, Bao-Le; Zhang, Mo; Hu, Hai-Chuan; Du, Xia; Zhang, Zhan-Hui","Nano-CoFe2O4 supported molybdenum as an efficient and magnetically recoverable catalyst for a one-pot, four-component synthesis of functionalized pyrroles","New Journal of Chemistry","2014","38","6","2435","","10.1039/c3nj01368e","","","0.71073","MoKα","","0.0746","0.061","","","0.1761","0.1926","","","","","","1.045","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054252","12.439","0.0007","12.439","0.0007","5.599","0.0009","90","","90","","120","","750.26","0.13","180","2","180","","","","","","","","synthesis as described","4","P 32","P 32","145","","","","- C9 H F9 N2 -","- C9 H F9 N2 -","- C27 H3 F27 N6 -","3","1","","Muñoz, Bianca K.; Ojo, Wilfried-Solo; Jacob, Kane; Romero, Nuria; Vendier, Laure; Despagnet-Ayoub, Emmanuelle; Etienne, Michel","Perfluorinated 1H-indazoles and hydrotris(indazol-1-yl)borates. Supramolecular organization and a new synthetic procedure to form scorpionate ligands","New Journal of Chemistry","2014","38","6","2451","","10.1039/c4nj00136b","","","0.71073","MoKα","","0.0649","0.0637","","","0.1567","0.1579","","","","","","1.091","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054253","5.1335","0.0003","9.1624","0.0005","24.825","0.0015","90","","90","","90","","1167.65","0.12","180","2","180","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H F11 N2 -","- C10 H F11 N2 -","- C40 H4 F44 N8 -","4","1","","Muñoz, Bianca K.; Ojo, Wilfried-Solo; Jacob, Kane; Romero, Nuria; Vendier, Laure; Despagnet-Ayoub, Emmanuelle; Etienne, Michel","Perfluorinated 1H-indazoles and hydrotris(indazol-1-yl)borates. Supramolecular organization and a new synthetic procedure to form scorpionate ligands","New Journal of Chemistry","2014","38","6","2451","","10.1039/c4nj00136b","","","0.71073","MoKα","","0.0478","0.0362","","","0.0907","0.0978","","","","","","1.099","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054254","9.3577","0.0005","5.1436","0.0002","27.2757","0.0012","90","","99.507","0.005","90","","1294.81","0.1","180","2","180","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H F13 N2 -","- C11 H F13 N2 -","- C44 H4 F52 N8 -","4","1","","Muñoz, Bianca K.; Ojo, Wilfried-Solo; Jacob, Kane; Romero, Nuria; Vendier, Laure; Despagnet-Ayoub, Emmanuelle; Etienne, Michel","Perfluorinated 1H-indazoles and hydrotris(indazol-1-yl)borates. Supramolecular organization and a new synthetic procedure to form scorpionate ligands","New Journal of Chemistry","2014","38","6","2451","","10.1039/c4nj00136b","","x-ray","0.71073","MoKα","","0.0508","0.0416","","","0.1087","0.1137","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054255","14.1749","0.0009","6.3085","0.0005","18.2579","0.0016","90","","99.598","0.008","90","","1609.8","0.2","180","2","180","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H F17 N2 -","- C13 H F17 N2 -","- C52 H4 F68 N8 -","4","1","","Muñoz, Bianca K.; Ojo, Wilfried-Solo; Jacob, Kane; Romero, Nuria; Vendier, Laure; Despagnet-Ayoub, Emmanuelle; Etienne, Michel","Perfluorinated 1H-indazoles and hydrotris(indazol-1-yl)borates. Supramolecular organization and a new synthetic procedure to form scorpionate ligands","New Journal of Chemistry","2014","38","6","2451","","10.1039/c4nj00136b","","x-ray","0.71073","MoKα","","0.1125","0.0517","","","0.1237","0.1395","","","","","","0.863","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054256","12.749","0.0012","13.03","0.0011","14.409","0.0013","97.161","0.004","114.95","0.004","111.09","0.004","1913.7","0.3","180","2","180","","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C61 H4 B2 Cl2 F66 N12 Tl2 -","- C61 H4 B2 Cl2 F66 N12 Tl2 -","- C61 H4 B2 Cl2 F66 N12 Tl2 -","1","0.5","","Muñoz, Bianca K.; Ojo, Wilfried-Solo; Jacob, Kane; Romero, Nuria; Vendier, Laure; Despagnet-Ayoub, Emmanuelle; Etienne, Michel","Perfluorinated 1H-indazoles and hydrotris(indazol-1-yl)borates. Supramolecular organization and a new synthetic procedure to form scorpionate ligands","New Journal of Chemistry","2014","38","6","2451","","10.1039/c4nj00136b","","","0.71073","MoKα","","0.0668","0.038","","","0.0876","0.1252","","","","","","1.172","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054257","22.126","0.004","22.126","0.004","6.012","0.002","90","","90","","90","","2943.2","1.2","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C14 H13 Ag N2 S2 -","- C14 H13 Ag N2 S2 -","- C112 H104 Ag8 N16 S16 -","8","1","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Influence of ligand environment on the structure and properties of silver(i) dithiocarbamate cluster-based coordination polymers and dimers","New Journal of Chemistry","2014","38","9","4478","","10.1039/C4NJ00580E","","","0.71073","MoKα","","0.173","0.0921","","","0.243","0.3107","","","","","","0.867","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054258","22.201","0.004","22.201","0.004","5.971","0.002","90","","90","","90","","2943","1.2","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C13 H12 Ag N3 S2 -","- C13 H12 Ag N3 S2 -","- C104 H96 Ag8 N24 S16 -","8","1","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Influence of ligand environment on the structure and properties of silver(i) dithiocarbamate cluster-based coordination polymers and dimers","New Journal of Chemistry","2014","38","9","4478","","10.1039/C4NJ00580E","","","0.71073","MoKα","","0.1559","0.0802","","","0.1912","0.2383","","","","","","1.009","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054259","9.3502","0.0005","17.4738","0.001","17.3742","0.0011","90","","90.395","0.005","90","","2838.6","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H56 Ag2 N4 P2 S4 -","- C64 H56 Ag2 N4 P2 S4 -","- C128 H112 Ag4 N8 P4 S8 -","2","0.5","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Influence of ligand environment on the structure and properties of silver(i) dithiocarbamate cluster-based coordination polymers and dimers","New Journal of Chemistry","2014","38","9","4478","","10.1039/C4NJ00580E","","","0.71073","MoKα","","0.0694","0.0461","","","0.0846","0.092","","","","","","1.016","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054260","9.3011","0.0003","17.7718","0.0007","17.3865","0.0007","90","","90.886","0.003","90","","2873.6","0.19","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H54 Ag2 N6 P2 S4 -","- C62 H54 Ag2 N6 P2 S4 -","- C124 H108 Ag4 N12 P4 S8 -","2","0.5","","Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Manar, Krishna K.; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Influence of ligand environment on the structure and properties of silver(i) dithiocarbamate cluster-based coordination polymers and dimers","New Journal of Chemistry","2014","38","9","4478","","10.1039/C4NJ00580E","","","0.71073","MoKα","","0.1006","0.055","","","0.0911","0.1023","","","","","","1.014","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054261","15.996","0.003","14.115","0.003","16.603","0.003","90","","113.26","0.03","90","","3444","1.4","113","","113","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H22 F18 Gd N2 O9 -","- C25 H22 F18 Gd N2 O9 -","- C100 H88 F72 Gd4 N8 O36 -","4","1","","Hu, Peng; Sun, Zan; Wang, Xiufeng; Li, Licun; Liao, Daizheng; Luneau, Dominique","Magnetic relaxation in mononuclear Tb complex involving a nitronyl nitroxide ligand","New J. Chem.","2014","38","10","4716","","10.1039/C4NJ00627E","","","0.71073","MoKα","","0.0295","0.026","","","0.062","0.0636","","","","","","1.064","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054262","15.978","0.003","14.13","0.003","16.588","0.003","90","","113.08","0.03","90","","3445.3","1.4","113","","113","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H22 F18 N2 O9 Tb -","- C25 H22 F18 N2 O9 Tb -","- C100 H88 F72 N8 O36 Tb4 -","4","1","","Hu, Peng; Sun, Zan; Wang, Xiufeng; Li, Licun; Liao, Daizheng; Luneau, Dominique","Magnetic relaxation in mononuclear Tb complex involving a nitronyl nitroxide ligand","New J. Chem.","2014","38","10","4716","","10.1039/C4NJ00627E","","","0.71073","MoKα","","0.0263","0.0238","","","0.0583","0.0596","","","","","","0.996","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054263","9.3542","0.0014","11.1933","0.0016","11.963","0.0018","62.314","0.011","68.905","0.012","73.544","0.011","1024.6","0.3","170","2","170","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H17 N5 O7 Pb -","- C18 H15 N5 O7 Pb -","- C36 H30 N10 O14 Pb2 -","2","1","","Hashemi, Lida; Morsali, Ali; Marandi, Farzin; Pantenburg, Ingo; Azhdari Tehrani, Alireza","Dynamic crystal-to-crystal transformation of 1D to 2D lead(ii) coordination polymers by de- and rehydration with no change in the morphology of nano-particles","New Journal of Chemistry","2014","38","8","3375","","10.1039/C4NJ00096J","","","0.71073","MoKα","","0.0569","0.0484","","","0.1311","0.1403","","","","","","1.088","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054272","7.806","0.0004","12.1582","0.0006","20.5067","0.001","90.072","0.004","91.404","0.004","108.25","0.004","1847.69","0.16","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H28 N12 O6 Pb2 S2 -","- C30 H28 N12 O6 Pb2 S2 -","- C60 H56 N24 O12 Pb4 S4 -","2","1","","Hashemi, Lida; Morsali, Ali; Büyükgüngor, Orhan","Anion influence on transformations of a nonporous 3D to porous 3D coordination polymer","New Journal of Chemistry","2014","","","","","10.1039/c4nj00175c","","","0.71073","MoKα","","0.0381","0.0278","","","0.0626","0.0658","","","","","","1.009","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054273","16.3972","0.0005","14.1233","0.0003","20.3576","0.0006","90","","109.2","0.002","90","","4452.2","0.2","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H28 N12 Pb2 S4 -","- C32 H28 N12 Pb2 S4 -","- C128 H112 N48 Pb8 S16 -","4","1","","Hashemi, Lida; Morsali, Ali; Büyükgüngor, Orhan","Anion influence on transformations of a nonporous 3D to porous 3D coordination polymer","New Journal of Chemistry","2014","","","","","10.1039/c4nj00175c","","","0.71073","MoKα","","0.0774","0.0548","","","0.1058","0.113","","","","","","1.128","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054274","12.1441","0.0007","13.9323","0.0008","14.4271","0.0008","90","","113.548","0.003","90","","2237.7","0.2","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H40 Mn2 N14 O5 -","- C50 H40 Mn2 N14 O5 -","- C100 H80 Mn4 N28 O10 -","2","0.5","","Das, Sudipta; Banerjee, Arnab; Lohar, Sisir; Sarkar, Bidisha; Mukhopadhyay, Subhra Kanti; Matalobos, Jesús Sanmartín; Sahana, Animesh; Das, Debasis","2-(2-Pyridyl) benzimidazole-based ternary Mn(ii) complex as an arsenate selective turn-on fluorescence probe: ppb level determination and cell imaging studies","New Journal of Chemistry","2014","38","7","2744","","10.1039/c3nj01514a","","x-ray","0.7107","MoKα","","0.0995","0.0596","","","0.1197","0.1377","","","","","","1.019","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054275","11.1735","0.0015","11.7304","0.0013","17.822","0.003","100.46","0.008","99.693","0.009","107.086","0.006","2133.8","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C101 H97 Cl3 N6 O8 -","- C101 H93 Cl3 N6 O8 -","- C101 H93 Cl3 N6 O8 -","1","0.5","","Collins, Carleton G.; Johnson, Andrew T.; Connell, Richard D.; Nelson, Ruth A.; Murgu, Ivan; Oliver, Allen G.; Smith, Bradley D.","Effect of 1,3-adamantane bridging units within the surrounding macrocycle of squaraine rotaxanes","New Journal of Chemistry","2014","38","8","3992","","10.1039/C4NJ00726C","","","0.7749","synchrotron","","0.1785","0.122","","","0.3117","0.349","","","","","","1.087","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054276","7.3552","0.0005","18.8781","0.0008","21.2531","0.0015","90","","90","","90","","2951","0.3","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C13 H15 Br2 N2 O2 -","- C13 H15 Br2 N2 O2 -","- C104 H120 Br16 N16 O16 -","8","2","","Önal, Emel; Yerli, Yusuf; Cosut, Bunyemin; Pilet, Guillaume; Ahsen, Vefa; Luneau, Dominique; Hirel, Catherine","Nitronyl and imino nitroxide free radicals as precursors of magnetic phthalocyanine and porphyrin building blocks","New Journal of Chemistry","2014","38","9","4440","","10.1039/C4NJ00574K","","","0.71073","MoKα","","0.0356","0.0334","","","0.0784","0.0791","","","","","","1.01","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054277","7.306","0.0004","18.7395","0.0009","20.9306","0.0011","90","","90","","90","","2865.6","0.3","150","2","150","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C13 H15 Br2 N2 O -","- C13 H15 Br2 N2 O -","- C104 H120 Br16 N16 O8 -","8","2","","Önal, Emel; Yerli, Yusuf; Cosut, Bunyemin; Pilet, Guillaume; Ahsen, Vefa; Luneau, Dominique; Hirel, Catherine","Nitronyl and imino nitroxide free radicals as precursors of magnetic phthalocyanine and porphyrin building blocks","New Journal of Chemistry","2014","38","9","4440","","10.1039/C4NJ00574K","","","0.71073","MoKα","","0.051","0.0366","","","0.0784","0.0838","","","","","","1.02","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054278","7.4256","0.001","16.678","0.003","11.512","0.002","90","","101.259","0.003","90","","1398.3","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 Br N3 O2 -","- C14 H15 Br N3 O2 -","- C56 H60 Br4 N12 O8 -","4","1","","Önal, Emel; Yerli, Yusuf; Cosut, Bunyemin; Pilet, Guillaume; Ahsen, Vefa; Luneau, Dominique; Hirel, Catherine","Nitronyl and imino nitroxide free radicals as precursors of magnetic phthalocyanine and porphyrin building blocks","New Journal of Chemistry","2014","38","9","4440","","10.1039/C4NJ00574K","","","0.71073","MoKα","","0.0434","0.0365","","","0.0909","0.0944","","","","","","1.047","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054279","6.177","0.005","13.704","0.005","21.888","0.005","90","0.005","94.245","0.005","90","0.005","1847.7","1.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H27 N2 O3 -","- C19 H27 N2 O3 -","- C76 H108 N8 O12 -","4","1","","Önal, Emel; Yerli, Yusuf; Cosut, Bunyemin; Pilet, Guillaume; Ahsen, Vefa; Luneau, Dominique; Hirel, Catherine","Nitronyl and imino nitroxide free radicals as precursors of magnetic phthalocyanine and porphyrin building blocks","New Journal of Chemistry","2014","38","9","4440","","10.1039/C4NJ00574K","","","0.71073","MoKα","","0.0879","0.0657","","","0.1676","0.1876","","","","","","0.988","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054280","20.3823","0.0013","10.5171","0.0004","15.1002","0.0009","90","","120.961","0.008","90","","2775.7","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H20 Cu4 N9 -","- C25 H20 Cu4 N9 -","- C100 H80 Cu16 N36 -","4","0.5","","Trivedi, Manoj; Ujjain, Sanjeev kumar; Sharma, Raj Kishore; Singh, Gurmeet; Kumar, Abhinav; Rath, Nigam P.","A cyano-bridged copper(ii)‒copper(i) mixed-valence coordination polymer as a source of copper oxide nanoparticles with catalytic activity in C‒N, C‒O and C‒S cross-coupling reactions","New Journal of Chemistry","2014","38","9","4267","","10.1039/C4NJ00829D","","","0.71073","MoKα","","0.0419","0.0333","","","0.0796","0.0839","","","","","","1.064","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054281","11.2558","0.0007","11.4911","0.0007","15.6438","0.0009","70.633","0.001","82.699","0.001","64.073","0.001","1716.39","0.18","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C39 H36 F6 N2 O S2 -","- C39 H36 F6 N2 O S2 -","- C78 H72 F12 N4 O2 S4 -","2","1","","Tatsumi, Yuto; Fujinaga, Noriko; Kasuno, Megumi; Morimoto, Masakazu; Yokojima, Satoshi; Nakamura, Shinichiro; Uchida, Kingo","A photo- and halochromic multicolor switching system consisting of diarylethene and malachite green moieties","New J. Chem.","2014","38","12","5706","","10.1039/C4NJ00434E","","","0.71073","MoKα","","0.0637","0.054","","","0.1186","0.1239","","","","","","1.108","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054282","19.644","0.004","14.872","0.002","14.938","0.002","90","","110.31","0.02","90","","4092.7","1.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74.6 H76.4 Fe Mn4 N14 O13.6 -","- C74.6 H69.8 Fe Mn4 N14 O13.6 -","- C149.2 H139.6 Fe2 Mn8 N28 O27.2 -","2","0.5","","Kopotkov, Vyacheslav A.; Yagubskii, Eduard B.; Simonov, Sergey V.; Zorina, Leokadiya V.; Starichenko, Denis V.; Korolyov, Alexander V.; Ustinov, Vladimir V.; Shvachko, Yuri N.","Heterometallic complexes combining [MnIII(salpn)]+and [Fe(CN)6]4−units as the products of reactions between [MnIII(salpn)(H2O)C(CN)3] and [Fe(CN)6]3−/4−","New Journal of Chemistry","2014","38","9","4167","","10.1039/C4NJ00427B","","","0.71073","MoKα","","0.1349","0.0722","","","0.1455","0.1695","","","","","","1.004","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054283","13.392","0.004","17.417","0.006","24.344","0.007","90","","102.555","0.007","90","","5542","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C116 H108 Fe Mn6 N24 O18 -","- C116 H108 Fe Mn6 N24 O18 -","- C232 H216 Fe2 Mn12 N48 O36 -","2","0.5","","Kopotkov, Vyacheslav A.; Yagubskii, Eduard B.; Simonov, Sergey V.; Zorina, Leokadiya V.; Starichenko, Denis V.; Korolyov, Alexander V.; Ustinov, Vladimir V.; Shvachko, Yuri N.","Heterometallic complexes combining [MnIII(salpn)]+and [Fe(CN)6]4−units as the products of reactions between [MnIII(salpn)(H2O)C(CN)3] and [Fe(CN)6]3−/4−","New Journal of Chemistry","2014","38","9","4167","","10.1039/C4NJ00427B","","","0.71073","MoKα","","0.1179","0.0491","","","0.102","0.132","","","","","","1.011","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054284","22.9655","0.0004","22.9655","0.0004","22.9655","0.0004","90","","90","","90","","12112.3","0.4","120","2","120","2","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C112 H132 Cl2 Fe Mn6 N18 O34 -","- C112.02 H126.06 Cl2 Fe Mn6 N18 O33.98 -","- C448.08 H504.24 Cl8 Fe4 Mn24 N72 O135.92 -","4","0.166667","","Kopotkov, Vyacheslav A.; Yagubskii, Eduard B.; Simonov, Sergey V.; Zorina, Leokadiya V.; Starichenko, Denis V.; Korolyov, Alexander V.; Ustinov, Vladimir V.; Shvachko, Yuri N.","Heterometallic complexes combining [MnIII(salpn)]+and [Fe(CN)6]4−units as the products of reactions between [MnIII(salpn)(H2O)C(CN)3] and [Fe(CN)6]3−/4−","New Journal of Chemistry","2014","38","9","4167","","10.1039/C4NJ00427B","","","0.71073","MoKα","","0.0467","0.0394","","","0.1044","0.1091","","","","","","1.008","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054285","11.2004","0.0012","11.8057","0.0013","11.9727","0.0013","90","","107.72","0.002","90","","1508","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H23 N2 P S2 -","- C11 H23 N2 P S2 -","- C44 H92 N8 P4 S8 -","4","1","","Rojas-Montoya, Iván D.; Santana-Silva, Alicia; García-Montalvo, Verónica; Muñoz-Hernández, Miguel-Ángel; Rivera, Margarita","N-(Chalcogen)phosphorylated (chalcogen)ureas of zinc and cadmium(ii): SSPs for group 12‒16 thin films","New J. Chem.","2014","38","10","4702","","10.1039/C4NJ00482E","","","0.71073","MoKα","","0.0427","0.0373","","","0.1032","0.1063","","","","","","1","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054286","15.324","0.003","15.069","0.003","13.756","0.003","90","","101.624","0.004","90","","3111.4","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H44 N4 P2 S4 Zn -","- C22 H44 N4 P2 S4 Zn -","- C88 H176 N16 P8 S16 Zn4 -","4","1","","Rojas-Montoya, Iván D.; Santana-Silva, Alicia; García-Montalvo, Verónica; Muñoz-Hernández, Miguel-Ángel; Rivera, Margarita","N-(Chalcogen)phosphorylated (chalcogen)ureas of zinc and cadmium(ii): SSPs for group 12‒16 thin films","New J. Chem.","2014","38","10","4702","","10.1039/C4NJ00482E","","","0.71073","MoKα","","0.0704","0.0459","","","0.0945","0.0986","","","","","","0.988","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054287","10.3217","0.0019","11.081","0.002","13.944","0.003","79.689","0.003","86.905","0.003","64.54","0.003","1416.2","0.5","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H44 N4 O2 P2 S2 Zn -","- C22 H44 N4 O2 P2 S2 Zn -","- C44 H88 N8 O4 P4 S4 Zn2 -","2","1","","Rojas-Montoya, Iván D.; Santana-Silva, Alicia; García-Montalvo, Verónica; Muñoz-Hernández, Miguel-Ángel; Rivera, Margarita","N-(Chalcogen)phosphorylated (chalcogen)ureas of zinc and cadmium(ii): SSPs for group 12‒16 thin films","New J. Chem.","2014","38","10","4702","","10.1039/C4NJ00482E","","","0.71073","MoKα","","0.0441","0.0413","","","0.1076","0.1092","","","","","","1.076","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054288","10.5894","0.0014","13.785","0.0019","16.051","0.002","64.633","0.002","73.929","0.002","68.548","0.002","1950.3","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H40 N4 P2 S4 Zn -","- C36 H40 N4 P2 S4 Zn -","- C72 H80 N8 P4 S8 Zn2 -","2","1","","Rojas-Montoya, Iván D.; Santana-Silva, Alicia; García-Montalvo, Verónica; Muñoz-Hernández, Miguel-Ángel; Rivera, Margarita","N-(Chalcogen)phosphorylated (chalcogen)ureas of zinc and cadmium(ii): SSPs for group 12‒16 thin films","New J. Chem.","2014","38","10","4702","","10.1039/C4NJ00482E","","","0.71073","MoKα","","0.0614","0.0365","","","0.0694","0.0741","","","","","","0.841","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054289","9.689","0.003","10.542","0.003","16.813","0.005","102.528","0.005","102.781","0.005","101.233","0.005","1580.8","0.8","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C22 H44 Cd N4 P2 S2 Se2 -","- C22 H44 Cd N4 P2 S2 Se2 -","- C44 H88 Cd2 N8 P4 S4 Se4 -","2","1","","Rojas-Montoya, Iván D.; Santana-Silva, Alicia; García-Montalvo, Verónica; Muñoz-Hernández, Miguel-Ángel; Rivera, Margarita","N-(Chalcogen)phosphorylated (chalcogen)ureas of zinc and cadmium(ii): SSPs for group 12‒16 thin films","New J. Chem.","2014","38","10","4702","","10.1039/C4NJ00482E","","","0.71073","MoKα","","0.055","0.0384","","","0.0804","0.092","","","","","","0.995","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054290","15.304","0.004","15.485","0.004","16.753","0.004","95.535","0.003","96.166","0.003","90.366","0.003","3928.2","1.7","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C80 H108 O18 S2 -","- C80 H108 O18 S2 -","- C160 H216 O36 S4 -","2","1","","Shamsutdinova, Nataliya A.; Podyachev, Sergey N.; Sudakova, Svetlana N.; Mustafina, Asiya R.; Zairov, Rustem R.; Burilov, Vladimir A.; Nizameev, Irek R.; Rizvanov, Ildar Kh.; Syakaev, Victor V.; Gabidullin, Bulat M.; Katsuba, Sergey A.; Gubaidullin, Aidar T.; Safiullin, Georgy M.; Dehaen, Wim","A facile synthetic route to convert Tb(iii) complexes of novel tetra-1,3-diketone calix[4]resorcinarene into hydrophilic luminescent colloids","New Journal of Chemistry","2014","38","9","4130","","10.1039/C4NJ00637B","","","0.71073","MoKα","","0.1671","0.0974","","","0.3062","0.3688","","","","","","1.177","","","","has coordinates,has disorder","180096","2020-10-21","18:00:00",""
"7054291","9.443","0.005","12.262","0.007","14.799","0.008","90","","106.506","0.014","90","","1643","1.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H8 Ag Cl N6 O4 S2 -","- C12 H8 Ag Cl N6 O4 S2 -","- C48 H32 Ag4 Cl4 N24 O16 S8 -","4","1","","Wang, Han; Yang, Jin; Mak, Thomas C. W.","Supramolecular silver(i) coordination isomers of different dimensionalities assembled using a conformationally flexible multidentate oligo-α-sulfanylpyrazinyl ligand","New J. Chem.","2014","38","10","4690","","10.1039/C4NJ00836G","","","0.71073","MoKα","","0.0743","0.0504","","","0.115","0.127","","","","","","1.05","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054292","8.6058","0.0017","13.283","0.003","14.427","0.003","90","","90","","90","","1649.2","0.6","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C12 H8 Ag Cl N6 O4 S2 -","- C12 H8 Ag Cl N6 O4 S2 -","- C48 H32 Ag4 Cl4 N24 O16 S8 -","4","1","","Wang, Han; Yang, Jin; Mak, Thomas C. W.","Supramolecular silver(i) coordination isomers of different dimensionalities assembled using a conformationally flexible multidentate oligo-α-sulfanylpyrazinyl ligand","New J. Chem.","2014","38","10","4690","","10.1039/C4NJ00836G","","","0.71073","MoKα","","0.0241","0.0226","","","0.0631","0.0653","","","","","","1.01","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054293","7.4609","0.0005","13.3836","0.001","16.1104","0.0012","90","","90","","90","","1608.7","0.2","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C12 H8 Ag Cl N6 O4 S2 -","- C12 H8 Ag Cl N6 O4 S2 -","- C48 H32 Ag4 Cl4 N24 O16 S8 -","4","1","","Wang, Han; Yang, Jin; Mak, Thomas C. W.","Supramolecular silver(i) coordination isomers of different dimensionalities assembled using a conformationally flexible multidentate oligo-α-sulfanylpyrazinyl ligand","New J. Chem.","2014","38","10","4690","","10.1039/C4NJ00836G","","","0.71073","MoKα","","0.0548","0.0461","","","0.1104","0.1163","","","","","","0.991","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054294","17.3212","0.0008","8.3276","0.0004","17.9892","0.0009","90","","111.922","0.001","90","","2407.2","0.2","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C36 H28 Ag2 Cl2 N18 O10 S6 -","- C36 H28 Ag2 Cl2 N18 O10 S6 -","- C72 H56 Ag4 Cl4 N36 O20 S12 -","2","1","","Wang, Han; Yang, Jin; Mak, Thomas C. W.","Supramolecular silver(i) coordination isomers of different dimensionalities assembled using a conformationally flexible multidentate oligo-α-sulfanylpyrazinyl ligand","New J. Chem.","2014","38","10","4690","","10.1039/C4NJ00836G","","","0.71073","MoKα","","0.0906","0.0652","","","0.1515","0.1753","","","","","","1.046","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054295","12.929","0.006","13.466","0.006","15.957","0.007","90","","99.945","0.008","90","","2736","2","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 Cl Cu2 N7 O5 S2 -","- C20 H28 Cl Cu2 N7 O5 S2 -","- C80 H112 Cl4 Cu8 N28 O20 S8 -","4","1","","Zheng, Kang; Liu, Fang; Xu, Xiao-Mei; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei","Synthesis, structure and molecular docking studies of dicopper(ii) complexes bridged by N-phenolato-N′-[2-(dimethylamino)ethyl]oxamide: the influence of terminal ligands on cytotoxicity and reactivity towards DNA and protein BSA","New Journal of Chemistry","2014","38","7","2964","","10.1039/c4nj00092g","","","0.71073","MoKα","","0.1033","0.0464","","","0.0956","0.1132","","","","","","0.995","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054296","11.93","0.003","15.205","0.004","20.892","0.006","99.53","0.03","95.53","0.03","111.98","0.03","3413.4","1.9","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C37.25 H76 Cl3 Co4 Gd N16 O30.75 -","- C36 H68 Cl3 Co4 Gd N16 O28 -","- C72 H136 Cl6 Co8 Gd2 N32 O56 -","2","1","","Premužić, Dejan; Muche, Simon; Hołyńska, Małgorzata","Unprecedented non-cytotoxic [CoIII4LnIII]-core complexes with a tripodal oxime ligand ‒ synthesis, structure, properties and potential applications","New Journal of Chemistry","2014","38","7","2894","","10.1039/c4nj00194j","","","0.71073","MoKα","","0.1863","0.0791","","","0.1122","0.1315","","","","","","0.892","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7054297","12.073","0.003","15.138","0.004","20.883","0.005","99.85","0.03","94.4","0.03","111.71","0.03","3452.5","1.8","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C37.2 H74.6 Cl4 Co4 N16 O33.6 Sm -","- C36 H69 Cl4 Co4 N16 O32 Sm -","- C72 H138 Cl8 Co8 N32 O64 Sm2 -","2","1","","Premužić, Dejan; Muche, Simon; Hołyńska, Małgorzata","Unprecedented non-cytotoxic [CoIII4LnIII]-core complexes with a tripodal oxime ligand ‒ synthesis, structure, properties and potential applications","New Journal of Chemistry","2014","38","7","2894","","10.1039/c4nj00194j","","","0.71073","MoKα","","0.1736","0.0627","","","0.0997","0.118","","","","","","0.687","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7054298","7.7031","0.0007","17.8226","0.0019","16.0433","0.0016","90","","90.717","0.006","90","","2202.4","0.4","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H24 N4 O3 S -","- C23 H24 N4 O3 S -","- C92 H96 N16 O12 S4 -","4","1","","Luxami, Vijay; Gupta, Akul Sen; Paul, Kamaldeep","Dansyl‒antipyrine dyad as a fluorescent sensor for Cu2+ and F−: sequential XNOR logic operation","New Journal of Chemistry","2014","38","7","2841","","10.1039/c4nj00060a","","","0.71073","MoKα","","0.0788","0.0429","","","0.1019","0.1196","","","","","","0.971","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054299","14.799","0.002","21.032","0.003","32.997","0.005","90","","92.249","0.01","90","","10262","3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C86 H64 Gd4 N20 O20 -","- C86 H64 Gd4 N20 O20 -","- C344 H256 Gd16 N80 O80 -","4","1","","Sheikh, Javeed Ahmad; Adhikary, Amit; Konar, Sanjit","Magnetic refrigeration and slow magnetic relaxation in tetranuclear lanthanide cages (Ln = Gd, Dy) with in situ ligand transformation","New Journal of Chemistry","2014","38","7","3006","","10.1039/c4nj00349g","","","0.71073","MoKα","","0.1276","0.0741","","","0.1763","0.196","","","","","","1.023","","","","has coordinates","180096","2020-10-21","18:00:00",""
"7054300","14.645","0.003","21.095","0.004","35.775","0.008","90","","112.012","0.015","90","","10247","4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C84 H58 Dy4 N20 O20 -","- C84 H58 Dy4 N20 O20 -","- C336 H232 Dy16 N80 O80 -","4","1","","Sheikh, Javeed Ahmad; Adhikary, Amit; Konar, Sanjit","Magnetic refrigeration and slow magnetic relaxation in tetranuclear lanthanide cages (Ln = Gd, Dy) with in situ ligand transformation","New Journal of Chemistry","2014","38","7","3006","","10.1039/c4nj00349g","","","0.71073","MoKα","","0.1224","0.076","","","0.1836","0.2041","","","","","","1.193","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054301","13.605","0.003","20.387","0.005","21.6","0.005","75.167","0.006","88.823","0.006","88.595","0.006","5789","2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H46 Dy4 N10 O18 -","- C51 H46 Dy4 N10 O18 -","- C204 H184 Dy16 N40 O72 -","4","2","","Sheikh, Javeed Ahmad; Adhikary, Amit; Konar, Sanjit","Magnetic refrigeration and slow magnetic relaxation in tetranuclear lanthanide cages (Ln = Gd, Dy) with in situ ligand transformation","New Journal of Chemistry","2014","38","7","3006","","10.1039/c4nj00349g","","","0.71073","MoKα","","0.1351","0.0709","","","0.159","0.1923","","","","","","1.061","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054302","15.7839","0.0002","12.0002","0.0002","15.8813","0.0004","90","","96.187","0.01","90","","2990.56","0.11","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 Ag4 Cd2 N12 O2 -","- C16 H24 Ag4 Cd2 N12 O2 -","- C64 H96 Ag16 Cd8 N48 O8 -","4","1","","Korkmaz, Nesrin; Karadağ, Ahmet; Aydın, Ali; Yanar, Yusuf; Karaman, İsa; Tekin, Şaban","Synthesis and characterization of two novel dicyanidoargentate(i) complexes containing N-(2-hydroxyethyl)ethylenediamine exhibiting significant biological activity","New J. Chem.","2014","38","10","4760","","10.1039/C4NJ00851K","","x-ray","0.71073","MoKα","","0.0604","0.0482","","","0.1271","0.1381","","","","","","1.095","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054303","5.079","0.0004","12.8141","0.001","13.2671","0.0009","70.308","0.005","80.767","0.005","88.005","0.005","802.26","0.11","100","0.5","100","0.5","","","","","","","","4","P -1","-P 1","2","","","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C38 H38 N6 O6 -","2","1","","Davis, Aaron B.; Lambert, Rachel E.; Fronczek, Frank R.; Cragg, Peter J.; Wallace, Karl J.","An activated coumarin-enamine Michael acceptor for CN−","New J. Chem.","2014","38","10","4678","","10.1039/C4NJ00862F","","","1.54184","CuKα","","0.0545","0.0454","","","0.1301","0.141","","","","","","1.1","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054304","10.5271","0.0009","10.7784","0.0009","10.9396","0.0009","68.855","0.004","65.795","0.004","78.787","0.005","1054.33","0.16","100","1","100","1","","","","","","","","6","P -1","-P 1","2","","","","- C14 H20 Cl2 Cu2 N4 S4 -","- C14 H20 Cl2 Cu2 N4 S4 -","- C28 H40 Cl4 Cu4 N8 S8 -","2","1","","Mondal, Gopinath; Bera, Pradip; Santra, Ananyakumari; Jana, Sumanta; Mandal, Tarak Nath; Mondal, Anup; Seok, Sang Il; Bera, Pulakesh","Precursor-driven selective synthesis of hexagonal chalcocite (Cu2S) nanocrystals: structural, optical, electrical and photocatalytic properties","New J. Chem.","2014","38","10","4774","","10.1039/C4NJ00584H","","","0.71073","MoKα","","0.0599","0.0526","","","0.1342","0.142","","","","","","1.03","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054305","9.2506","0.0005","9.0398","0.0006","11.4008","0.0009","90","","111.656","0.005","90","","886.08","0.11","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H17 Cl O S2 -","- C20 H17 Cl O S2 -","- C40 H34 Cl2 O2 S4 -","2","1","","Nell, Peter G.","Generation of a highly enantioenriched α-phenylthio-substituted Grignard-reagent","New Journal of Chemistry","1999","23","10","973","","10.1039/a906179g","","","1.54178","CuKα","","0.0489","0.0486","","","0.1332","0.1336","","","","","","1.061","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054306","14.257","0.002","16.101","0.002","19.044","0.003","104.391","0.002","102.766","0.002","111.467","0.002","3697.2","0.9","100","2","100","2","","","","","","","","7","P 1","P 1","1","","","","- C14 H12 Cl18 Mn N9 O S -","- C14 H12 Cl18 Mn N9 O S -","- C56 H48 Cl72 Mn4 N36 O4 S4 -","4","4","","Shixaliyev, Namiq Q.; Gurbanov, Atash V.; Maharramov, Abel M.; Mahmudov, Kamran T.; Kopylovich, Maximilian N.; Martins, Luísa M. D. R. S.; Muzalevskiy, Vasily M.; Nenajdenko, Valentine G.; Pombeiro, Armando J. L.","Halogen-bonded tris(2,4-bis(trichloromethyl)-1,3,5-triazapentadienato)-M(iii) [M = Mn, Fe, Co] complexes and their catalytic activity in the peroxidative oxidation of 1-phenylethanol to acetophenone","New J. Chem.","2014","38","10","4807","","10.1039/C4NJ00797B","","","0.71073","MoKα","","0.1573","0.0722","","","0.1074","0.122","","","","","","1.002","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054307","10.0591","0.0004","13.5688","0.0005","16.6349","0.0006","79.467","0.001","76.064","0.001","75.132","0.001","2112.09","0.14","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H18 Cl18 Fe N9 O2 S2 -","- C16 H18 Cl18 Fe N9 O2 S2 -","- C32 H36 Cl36 Fe2 N18 O4 S4 -","2","1","","Shixaliyev, Namiq Q.; Gurbanov, Atash V.; Maharramov, Abel M.; Mahmudov, Kamran T.; Kopylovich, Maximilian N.; Martins, Luísa M. D. R. S.; Muzalevskiy, Vasily M.; Nenajdenko, Valentine G.; Pombeiro, Armando J. L.","Halogen-bonded tris(2,4-bis(trichloromethyl)-1,3,5-triazapentadienato)-M(iii) [M = Mn, Fe, Co] complexes and their catalytic activity in the peroxidative oxidation of 1-phenylethanol to acetophenone","New J. Chem.","2014","38","10","4807","","10.1039/C4NJ00797B","","","0.71073","MoKα","","0.0993","0.0749","","","0.1718","0.1888","","","","","","1.005","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054308","10.171","0.003","13.499","0.004","16.468","0.005","79.309","0.006","76.007","0.006","74.967","0.006","2100.6","1.1","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H18 Cl18 Co N9 O2 S2 -","- C16 H18 Cl18 Co N9 O2 S2 -","- C32 H36 Cl36 Co2 N18 O4 S4 -","2","1","","Shixaliyev, Namiq Q.; Gurbanov, Atash V.; Maharramov, Abel M.; Mahmudov, Kamran T.; Kopylovich, Maximilian N.; Martins, Luísa M. D. R. S.; Muzalevskiy, Vasily M.; Nenajdenko, Valentine G.; Pombeiro, Armando J. L.","Halogen-bonded tris(2,4-bis(trichloromethyl)-1,3,5-triazapentadienato)-M(iii) [M = Mn, Fe, Co] complexes and their catalytic activity in the peroxidative oxidation of 1-phenylethanol to acetophenone","New J. Chem.","2014","38","10","4807","","10.1039/C4NJ00797B","","","0.71073","MoKα","","0.1234","0.077","","","0.1981","0.2395","","","","","","1.004","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054309","7.558","0.001","9.2626","0.0013","10.536","0.0014","104.104","0.004","90.218","0.004","96.517","0.005","710.35","0.17","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H15 Cu N O9 -","- C10 H15 Cu N O9 -","- C20 H30 Cu2 N2 O18 -","2","1","","Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Synthesis, structure and catalytic applications of amidoterephthalate copper complexes in the diastereoselective Henry reaction in aqueous medium","New J. Chem.","2014","38","10","4837","","10.1039/C4NJ00878B","","","0.71073","MoKα","","0.0415","0.0386","","","0.1043","0.1095","","","","","","1.126","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054310","7.8968","0.0015","8.8683","0.0018","16.015","0.003","99.775","0.007","98.719","0.007","111.79","0.007","997.7","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H25 N3 O7 -","- C17 H25 N3 O7 -","- C34 H50 N6 O14 -","2","1","","Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Synthesis, structure and catalytic applications of amidoterephthalate copper complexes in the diastereoselective Henry reaction in aqueous medium","New J. Chem.","2014","38","10","4837","","10.1039/C4NJ00878B","","","0.71073","MoKα","","0.1473","0.0832","","","0.2266","0.2831","","","","","","1.011","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054311","8.2402","0.0004","15.2755","0.0008","9.6698","0.0005","90","","98.276","0.002","90","","1204.49","0.11","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 N O6 -","- C11 H13 N O6 -","- C44 H52 N4 O24 -","4","1","","Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Synthesis, structure and catalytic applications of amidoterephthalate copper complexes in the diastereoselective Henry reaction in aqueous medium","New J. Chem.","2014","38","10","4837","","10.1039/C4NJ00878B","","","0.71073","MoKα","","0.0778","0.0497","","","0.1254","0.1419","","","","","","1.017","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054312","7.4875","0.0003","9.4303","0.0003","10.4406","0.0004","78.225","0.002","84.542","0.003","83.261","0.002","714.78","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H17 Cu N O9 -","- C11 H17 Cu N O9 -","- C22 H34 Cu2 N2 O18 -","2","1","","Karmakar, Anirban; Hazra, Susanta; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","Synthesis, structure and catalytic applications of amidoterephthalate copper complexes in the diastereoselective Henry reaction in aqueous medium","New J. Chem.","2014","38","10","4837","","10.1039/C4NJ00878B","","","0.71073","MoKα","","0.0553","0.0439","","","0.1047","0.1114","","","","","","1.059","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054313","7.3355","0.0005","9.7607","0.0007","19.5372","0.0014","97.873","0.005","94.801","0.004","104.46","0.004","1331.6","0.17","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H42 N2 O2 -","- C31 H42 N2 O2 -","- C62 H84 N4 O4 -","2","1","","N., Ahipa T.; Adhikari, Airody Vasudeva","2-Methoxypyridine derivatives: synthesis, liquid crystalline and photo-physical properties","New J. Chem.","2014","38","10","5018","","10.1039/C4NJ00911H","","","0.71073","MoKα","","0.1121","0.0588","","","0.1533","0.1736","","","","","","0.987","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054314","14.8343","0.0005","44.69","0.002","7.3614","0.0003","90","","90","","90","","4880.2","0.3","100","2","100","2","","","","","","","see text","5","A b a 2","A 2 -2ab","41","","","","- C48 H51 N4 O4 S2 -","- C48 H51 N4 O4 S2 -","- C192 H204 N16 O16 S8 -","4","","","N., Ahipa T.; Adhikari, Airody Vasudeva","2-Methoxypyridine derivatives: synthesis, liquid crystalline and photo-physical properties","New J. Chem.","2014","38","10","5018","","10.1039/C4NJ00911H","","x-ray","0.71073","MoKα","","0.1039","0.0844","","","0.2355","0.2599","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054315","11.8408","0.0014","12.4848","0.0015","12.5343","0.0015","61.61","0.002","71.862","0.002","70.647","0.002","1511.4","0.3","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H32 Cu5 N12 O44 P W12 -","- C24 H24 Cu5 N12 O44 P W12 -","- C24 H24 Cu5 N12 O44 P W12 -","1","0.5","","Li, Shaobin; Ma, Huiyuan; Pang, Haijun; Zhang, Li; Zhang, Zhuanfang","A novel Cu12(pz)12loop-based coordination polymer templated by double-Keggin anions","New J. Chem.","2014","38","10","4963","","10.1039/C4NJ00867G","","","0.71073","MoKα","","0.0868","0.0819","","","0.219","0.2215","","","","","","1.177","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054316","11.763","0.002","12.496","0.003","23.866","0.005","90","","90","","90","","3508.1","1.3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C27 H33 Br3 Cl N9 Ni2 O7 -","- C27 H33 Br3 Cl N9 Ni2 O7 -","- C108 H132 Br12 Cl4 N36 Ni8 O28 -","4","1","","An, Guang-Yu; Wang, Hong-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Ferromagnetic versus antiferromagnetic exchange in oximato-bridged nickel(ii) complexes","New J. Chem.","2014","38","10","5037","","10.1039/C4NJ01055H","","","0.71073","MoKα","","0.0626","0.0372","","","0.0827","0.1109","","","","","","1.074","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054317","12.518","0.003","12.124","0.002","22.749","0.005","90","","93.34","0.03","90","","3446.7","1.3","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 B Br3 F4 N9 Ni2 O3 -","- C27 H33 B Br3 F4 N9 Ni2 O3 -","- C108 H132 B4 Br12 F16 N36 Ni8 O12 -","4","1","","An, Guang-Yu; Wang, Hong-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Ferromagnetic versus antiferromagnetic exchange in oximato-bridged nickel(ii) complexes","New J. Chem.","2014","38","10","5037","","10.1039/C4NJ01055H","","","0.71073","MoKα","","0.0951","0.0682","","","0.1986","0.2188","","","","","","1.128","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054318","9.1157","0.0018","30.055","0.006","21.282","0.004","90","","93.25","0.03","90","","5821","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H71 B N12 Ni2 O6 -","- C54 H71 B N12 Ni2 O6 -","- C216 H284 B4 N48 Ni8 O24 -","4","1","","An, Guang-Yu; Wang, Hong-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Ferromagnetic versus antiferromagnetic exchange in oximato-bridged nickel(ii) complexes","New J. Chem.","2014","38","10","5037","","10.1039/C4NJ01055H","","","0.71073","MoKα","","0.0862","0.0561","","","0.1593","0.1804","","","","","","1.051","","","","has coordinates","198676","2020-10-21","18:00:00",""
"7054319","18.717","0.006","25.333","0.008","17.423","0.005","90","","99.435","0.006","90","","8149","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H76 Cl2 N26 Ni5 O19 -","- C52 H64 Cl2 N26 Ni5 O19 -","- C208 H256 Cl8 N104 Ni20 O76 -","4","0.5","","An, Guang-Yu; Wang, Hong-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Ferromagnetic versus antiferromagnetic exchange in oximato-bridged nickel(ii) complexes","New J. Chem.","2014","38","10","5037","","10.1039/C4NJ01055H","","","0.71073","MoKα","","0.112","0.0762","","","0.2229","0.269","","","","","","1.023","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054320","12.5179","0.0004","12.1239","0.0004","22.749","0.0007","90","","93.339","0.001","90","","3446.66","0.19","153","2","153","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C27 H34 B Br3 F4 N9 Ni2 O3 -","- C27 H34 B Br3 F4 N9 Ni2 O3 -","- C108 H136 B4 Br12 F16 N36 Ni8 O12 -","4","1","","An, Guang-Yu; Wang, Hong-Bo; Cui, Ai-Li; Kou, Hui-Zhong","Ferromagnetic versus antiferromagnetic exchange in oximato-bridged nickel(ii) complexes","New J. Chem.","2014","38","10","5037","","10.1039/C4NJ01055H","","","0.71073","MoKα","","0.0457","0.0357","","","0.0857","0.0912","","","","","","1.012","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7054342","16.0555","0.0006","24.2744","0.0009","25.2143","0.0012","90","","90","","90","","9827","0.7","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Bis(n-tetrabutylammonium)bis(tribenzonitrilesilver)decatungstate","Bis(n-tetrabutylammonium)bis(tribenzonitrilesilver)di-mu5-oxo -icosa-mu-oxo-decaoxodecatungstate","","- C74 H102 Ag2 N8 O32 W10 -","- C74 H102 Ag2 N8 O32 W10 -","- C296 H408 Ag8 N32 O128 W40 -","4","0.5","","Kulikov, Vladislav; Meyer, Gerd","Organoamine silver(i) decatungstate structures: remarkable chemoselectivity and the exploration of the intramolecular redox reaction upon thermolysis","New Journal of Chemistry","2014","38","8","3408","","10.1039/C4NJ00172A","","","0.71073","MoKα","","0.062","0.0463","","","0.1177","0.1291","","","","","","1.074","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054343","11.0972","0.0004","13.397","0.0005","13.9852","0.0007","104.717","0.004","113.242","0.003","94.594","0.003","1809.31","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Tetrakis(dibenzonitrilesiver(I))decatungstate","Tetrakis(dibenzonitrilesiver(I))di-mu5-oxo-icosa-mu-oxo-decaoxodecatungstate","","- C56 H40 Ag4 N8 O32 W10 -","- C56 H40 Ag4 N8 O32 W10 -","- C56 H40 Ag4 N8 O32 W10 -","1","0.5","","Kulikov, Vladislav; Meyer, Gerd","Organoamine silver(i) decatungstate structures: remarkable chemoselectivity and the exploration of the intramolecular redox reaction upon thermolysis","New Journal of Chemistry","2014","38","8","3408","","10.1039/C4NJ00172A","","","0.71073","MoKα","","0.0345","0.0301","","","0.0742","0.0767","","","","","","1.114","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054344","10.7971","0.0005","14.5","0.0006","20.1073","0.0008","97.929","0.003","93.069","0.003","110.612","0.003","2900.5","0.2","170","2","170","2","","","","","","","","6","P -1","-P 1","2","Tetrakis(dibenzonitriletheobrominesilver(I))decatungstate benzonitrile","Tetrakis(dibenzonitriletheobrominesilver(I))di-mu5-oxo-icosa- mu-oxo-decaoxodecatungstate benzonitrile","","- C91 H77 Ag4 N25 O40 W10 -","- C91 H76 Ag4 N25 O40 W10 -","- C91 H76 Ag4 N25 O40 W10 -","1","0.5","","Kulikov, Vladislav; Meyer, Gerd","Organoamine silver(i) decatungstate structures: remarkable chemoselectivity and the exploration of the intramolecular redox reaction upon thermolysis","New Journal of Chemistry","2014","38","8","3408","","10.1039/C4NJ00172A","","","0.71073","MoKα","","0.095","0.044","","","0.0845","0.099","","","","","","0.846","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054371","22.468","0.002","22.468","0.002","13.1835","0.0015","90","","90","","90","","6655.2","1.1","296","2","296","2","","","","","","","","4","I 41/a :2","-I 4ad","88","DMBBTS","","","- C18 H14 S2 Si -","- C18 H14 S2 Si -","- C288 H224 S32 Si16 -","16","1","","Zhao, Yunfang; Hao, Wanglong; Ma, Wangjing; Zang, Zhanzhan; Zhang, Huarong; Liu, Xiaoxia; Zou, Sufen; Zhang, Haixia; Liu, Weichao; Gao, Jianhua","Easily-soluble heteroacene bis(benzothieno)silole derivatives for sensing of nitro explosives","New J. Chem.","2014","38","12","5754","","10.1039/C4NJ00913D","","","0.71073","MoKα","","0.0647","0.0468","","","0.1211","0.1369","","","","","","1.053","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054372","15.5429","0.0017","13.1602","0.0015","7.4458","0.0009","90","","90","","90","","1523","0.3","296","2","296","2","","","","","","","","4","C m c 21","C 2c -2","36","MDBTS","","","- C8.5 H5.5 S Si0.5 -","- C8.5 H6 S Si0.5 -","- C68 H48 S8 Si4 -","8","1","","Zhao, Yunfang; Hao, Wanglong; Ma, Wangjing; Zang, Zhanzhan; Zhang, Huarong; Liu, Xiaoxia; Zou, Sufen; Zhang, Haixia; Liu, Weichao; Gao, Jianhua","Easily-soluble heteroacene bis(benzothieno)silole derivatives for sensing of nitro explosives","New J. Chem.","2014","38","12","5754","","10.1039/C4NJ00913D","","","0.71073","MoKα","","0.0375","0.0342","","","0.097","0.1008","","","","","","1.109","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054373","9.2863","0.0004","20.6105","0.001","16.7211","0.0007","90","","116.179","0.003","90","","2872","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H37 Co Cu2 N10 O7 -","- C18 H37 Co Cu2 N10 O7 -","- C72 H148 Co4 Cu8 N40 O28 -","4","1","","Korkmaz, Şengül Aslan; Karadağ, Ahmet; Yerli, Yusuf; Soylu, Mustafa Serkan","Synthesis and characterization of new heterometallic cyanido complexes based on [Co(CN)6]3−building blocks: crystal structure of [Cu2(N-bishydeten)2Co(CN)6]·3H2O having a strong antiferromagnetic exchange","New J. Chem.","2014","38","11","5402","","10.1039/C4NJ00737A","","","0.71073","MoKα","","0.0419","0.0304","","","0.073","0.0768","","","","","","1.017","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054374","19.708","0.003","19.708","0.003","30.193","0.004","90","","90","","120","","10156","3","100","2","100","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C144 H126.12 Mn6 N12 O54.12 -","- C144 H120.624 Mn6 N12 O50.114 -","- C432 H361.872 Mn18 N36 O150.342 -","3","0.166667","","Najafpour, Mohammad Mahdi; Amini, Mojtaba; Hołyńska, Małgorzata; Zare, Maryam; Amini, Emad","A hexanuclear manganese(ii) complex: synthesis, characterization and catalytic activity toward organic sulfide oxidation","New J. Chem.","2014","38","10","5069","","10.1039/C4NJ01159G","","","0.71073","MoKα","","0.0576","0.0293","","","0.0395","0.041","","","","","","1.002","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054375","22.436","0.006","8.563","0.002","13.95","0.004","90","","104.135","0.004","90","","2598.9","1.2","200","","200","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H35 N O Ru -","- C30 H24 N O Ru -","- C120 H96 N4 O4 Ru4 -","4","1","","Hirano, Masafumi; Okamoto, Takuya; Komine, Nobuyuki; Komiya, Sanshiro","Stoichiometric formation of conjugated dienyl ketones from 1,3-dienes and ketenes at a ruthenium(0) centre","New J. Chem.","2014","38","10","5052","","10.1039/C4NJ01001A","","","0.71075","MoKa","","","0.0549","","","","0.1513","","","","","","1.07","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054376","9.387","0.005","10.408","0.006","12.422","0.007","92.956","0.01","95.117","0.011","108.356","0.011","1143.2","1.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H66 Co2 N2 O13 -","- C43 H66 Co2 N2 O13 -","- C43 H66 Co2 N2 O13 -","1","0.5","","Dey, Suman Kr; Mukherjee, Arindam","The synthesis, characterization and catecholase activity of dinuclear cobalt(ii/iii) complexes of an O-donor rich Schiff base ligand","New J. Chem.","2014","38","10","4985","","10.1039/C4NJ00715H","","","0.71073","MoKα","","0.0949","0.0598","","","0.1512","0.1711","","","","","","1.046","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054377","10.6122","0.0006","10.7435","0.0005","20.9793","0.0013","85.602","0.004","76.259","0.005","86.473","0.004","2314.3","0.2","99.9","0.2","99.9","0.2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H71 Co2 N2 O13 -","- C42 H71 Co2 N2 O13 -","- C84 H142 Co4 N4 O26 -","2","1","","Dey, Suman Kr; Mukherjee, Arindam","The synthesis, characterization and catecholase activity of dinuclear cobalt(ii/iii) complexes of an O-donor rich Schiff base ligand","New J. Chem.","2014","38","10","4985","","10.1039/C4NJ00715H","","x-ray","0.71073","MoKα","","0.1096","0.0929","","","0.2303","0.2388","","","","","","1.205","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054378","22.455","0.002","18.5888","0.0018","11.7828","0.0011","90","","92.547","0.002","90","","4913.4","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H74 Cl Co2 N4 O13 -","- C42 H66 Cl Co2 N4 O13 -","- C168 H264 Cl4 Co8 N16 O52 -","4","1","","Dey, Suman Kr; Mukherjee, Arindam","The synthesis, characterization and catecholase activity of dinuclear cobalt(ii/iii) complexes of an O-donor rich Schiff base ligand","New J. Chem.","2014","38","10","4985","","10.1039/C4NJ00715H","","","0.71073","MoKα","","0.0985","0.0575","","","0.1623","0.1798","","","","","","1.052","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054379","9.117","0.002","9.526","0.002","13.852","0.004","75.04","0.004","82.077","0.005","88.665","0.003","1151.1","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H14 Br2 Fe K N6 O4 -","- C20 H14 Br2 Fe K N6 O4 -","- C40 H28 Br4 Fe2 K2 N12 O8 -","2","1","","Zhang, Daopeng; Zhuo, Shuping; Wang, Ping; Chen, Xia; Jiang, Jianzhuang","A new series of cyanide-bridged heterobimetallic FeIII‒FeIII/MnIII/CuIIone-dimensional complexes: synthesis, crystal structures, and magnetic properties","New J. Chem.","2014","38","11","5470","","10.1039/C4NJ00743C","","","0.71073","MoKα","","0.0611","0.0462","","","0.1317","0.1395","","","","","","1.071","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054380","10.253","0.002","10.435","0.003","20.21","0.005","90","","90","","90","","2162.3","0.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H14 Br2 Fe N5 O3 -","- C20 H14 Br2 Fe N5 O3 -","- C80 H56 Br8 Fe4 N20 O12 -","4","1","","Zhang, Daopeng; Zhuo, Shuping; Wang, Ping; Chen, Xia; Jiang, Jianzhuang","A new series of cyanide-bridged heterobimetallic FeIII‒FeIII/MnIII/CuIIone-dimensional complexes: synthesis, crystal structures, and magnetic properties","New J. Chem.","2014","38","11","5470","","10.1039/C4NJ00743C","","","0.71073","MoKα","","0.1106","0.0703","","","0.162","0.1847","","","","","","1.06","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054381","10.512","0.002","11.55","0.003","18.177","0.004","105.308","0.003","102.816","0.004","101.004","0.003","2001.3","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H27 Br4 Fe Mn N8 O6 -","- C37 H23 Br4 Fe Mn N8 O6 -","- C74 H46 Br8 Fe2 Mn2 N16 O12 -","2","1","","Zhang, Daopeng; Zhuo, Shuping; Wang, Ping; Chen, Xia; Jiang, Jianzhuang","A new series of cyanide-bridged heterobimetallic FeIII‒FeIII/MnIII/CuIIone-dimensional complexes: synthesis, crystal structures, and magnetic properties","New J. Chem.","2014","38","11","5470","","10.1039/C4NJ00743C","","","0.71073","MoKα","","0.065","0.0478","","","0.1265","0.1383","","","","","","1.03","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054382","10.3171","0.0007","11.5913","0.0007","17.773","0.0016","102.52","0.001","102.07","0.001","104.978","0.001","1923.6","0.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C39 H27 Br2 Cl2 Fe Mn N9 O4 -","- C39 H27 Br2 Cl2 Fe Mn N9 O4 -","- C78 H54 Br4 Cl4 Fe2 Mn2 N18 O8 -","2","1","","Zhang, Daopeng; Zhuo, Shuping; Wang, Ping; Chen, Xia; Jiang, Jianzhuang","A new series of cyanide-bridged heterobimetallic FeIII‒FeIII/MnIII/CuIIone-dimensional complexes: synthesis, crystal structures, and magnetic properties","New J. Chem.","2014","38","11","5470","","10.1039/C4NJ00743C","","","0.71073","MoKα","","0.047","0.0344","","","0.0897","0.0963","","","","","","1.049","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054383","10.8178","0.0014","13.1598","0.0017","14.3844","0.0018","78.246","0.002","71.433","0.002","86.186","0.002","1900.5","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C31 H38 Br2 Cl Cu Fe N10 O7 -","- C31 H38 Br2 Cl Cu Fe N10 O7 -","- C62 H76 Br4 Cl2 Cu2 Fe2 N20 O14 -","2","1","","Zhang, Daopeng; Zhuo, Shuping; Wang, Ping; Chen, Xia; Jiang, Jianzhuang","A new series of cyanide-bridged heterobimetallic FeIII‒FeIII/MnIII/CuIIone-dimensional complexes: synthesis, crystal structures, and magnetic properties","New J. Chem.","2014","38","11","5470","","10.1039/C4NJ00743C","","","0.71073","MoKα","","0.0566","0.0395","","","0.1029","0.1127","","","","","","1.022","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054384","22.0227","0.0005","5.5302","0.0002","15.8613","0.0004","90","","102.984","0.002","90","","1882.36","0.09","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 N2 O -","- C23 H22 N2 O -","- C92 H88 N8 O4 -","4","1","","Anum, Faiza; Abbas, Asghar; Lo, Kong Mun; Rehman, Zia ur; Hameed, Shahid; Naseer, Muhammad Moazzam","Homologous 1,3,5-triarylpyrazolines: Synthesis, CH•••π interactions guided self-assembly and effect of alkyloxy chain length on DNA binding properties","New J. Chem.","2014","","","","","10.1039/C4NJ00938J","","","0.71073","MoKα","","0.1548","0.062","","","0.1215","0.1737","","","","","","1.021","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054385","16.417","0.003","5.4987","0.0009","9.0065","0.0016","90","","105.664","0.007","90","","782.8","0.2","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","3,3'-(ethane-1,2-diyl)bis(2,2-difluoro-2H-benzo[e][1,3,2]oxazaborinin-3-ium-2-uide)","","- C16 H14 B2 F4 N2 O2 -","- C16 H14 B2 F4 N2 O2 -","- C32 H28 B4 F8 N4 O4 -","2","0.5","","Guieu, Samuel; Cardona, Francisco; Rocha, João; Silva, Artur M. S.","Luminescent bi-metallic fluoroborate derivatives of bulky salen ligands","New J. Chem.","2014","38","11","5411","","10.1039/C4NJ00941J","","","0.71073","MoKα","","0.0614","0.047","","","0.1072","0.1182","","","","","","1.068","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054386","11.8811","0.0013","8.5426","0.0008","16.4812","0.0016","90","","106.687","0.004","90","","1602.3","0.3","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,2'-((1E,1'E)-(ethane-1,2-diylbis(azanylylidene))bis(methanylylidene))bis(4-benzhydrylphenol)","","- C42 H36 N2 O2 -","- C42 H36 N2 O2 -","- C84 H72 N4 O4 -","2","0.5","","Guieu, Samuel; Cardona, Francisco; Rocha, João; Silva, Artur M. S.","Luminescent bi-metallic fluoroborate derivatives of bulky salen ligands","New J. Chem.","2014","38","11","5411","","10.1039/C4NJ00941J","","","0.71073","MoKα","","0.1137","0.0622","","","0.1418","0.1672","","","","","","1.018","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054387","6.9487","0.0012","12.624","0.002","11.3238","0.0015","90","","93.457","0.007","90","","991.5","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,2-difluoro-3-propyl-2H-benzo[e][1,3,2]oxazaborinin-3-ium-2-uide","","- C10 H12 B F2 N O -","- C10 H12 B F2 N O -","- C40 H48 B4 F8 N4 O4 -","4","1","","Guieu, Samuel; Cardona, Francisco; Rocha, João; Silva, Artur M. S.","Luminescent bi-metallic fluoroborate derivatives of bulky salen ligands","New J. Chem.","2014","38","11","5411","","10.1039/C4NJ00941J","","","0.71073","MoKα","","0.0781","0.0603","","","0.1432","0.1552","","","","","","1.178","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054388","10.9905","0.0003","22.1006","0.0005","13.0545","0.0004","90","","109.689","0.002","90","","2985.51","0.14","293","","293","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C33 H27 Cl N3 Ni O P S -","- C33 H27 Cl N3 Ni O P S -","- C132 H108 Cl4 N12 Ni4 O4 P4 S4 -","4","1","","Güveli, Şükriye; Koca, Atıf; Özdemir, Namık; Bal-Demirci, Tülay; Ülküseven, Bahri","Electrochemistry and structural properties of new mixed ligand nickel(ii) complexes based on thiosemicarbazone","New J. Chem.","2014","38","11","5582","","10.1039/C4NJ00556B","","","0.71073","MoKα","","0.0965","0.0952","","","0.2489","0.25","","","","","","1.082","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054389","16.6948","0.0003","10.9984","0.0002","16.9011","0.0004","90","","92.44","0.002","90","","3100.5","0.11","293","","293","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","","- C35 H29 Cl N3 Ni O P S -","- C35 H29 Cl N3 Ni O P S -","- C140 H116 Cl4 N12 Ni4 O4 P4 S4 -","4","1","","Güveli, Şükriye; Koca, Atıf; Özdemir, Namık; Bal-Demirci, Tülay; Ülküseven, Bahri","Electrochemistry and structural properties of new mixed ligand nickel(ii) complexes based on thiosemicarbazone","New J. Chem.","2014","38","11","5582","","10.1039/C4NJ00556B","","","0.71073","MoKα","","0.041","0.0402","","","0.118","0.1191","","","","","","1.054","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054390","8.9069","0.0004","14.7753","0.0006","12.3744","0.0005","90","","102.793","0.004","90","","1588.07","0.12","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 Cl2 Co N3 S -","- C14 H13 Cl2 Co N3 S -","- C56 H52 Cl8 Co4 N12 S4 -","4","1","","Sobiesiak, Marta; Muzioł, Tadeusz; Rozalski, Marek; Krajewska, Urszula; Budzisz, Elzbieta","Co(ii), Ni(ii) and Cu(ii) complexes with phenylthiazole and thiosemicarbazone-derived ligands: synthesis, structure and cytotoxic effects","New J. Chem.","2014","38","11","5349","","10.1039/C4NJ00977K","","x-ray","0.71073","MoKα","","0.0403","0.032","","","0.092","0.0963","","","","","","0.873","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054391","24.0372","0.001","9.6174","0.0003","16.0976","0.0007","90","","113.255","0.005","90","","3419","0.3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H30 Cl2 N6 Ni O10 S2 -","- C28 H30 Cl2 N6 Ni O10 S2 -","- C112 H120 Cl8 N24 Ni4 O40 S8 -","4","0.5","","Sobiesiak, Marta; Muzioł, Tadeusz; Rozalski, Marek; Krajewska, Urszula; Budzisz, Elzbieta","Co(ii), Ni(ii) and Cu(ii) complexes with phenylthiazole and thiosemicarbazone-derived ligands: synthesis, structure and cytotoxic effects","New J. Chem.","2014","38","11","5349","","10.1039/C4NJ00977K","","x-ray","0.71073","MoKα","","0.0528","0.0458","","","0.1279","0.132","","","","","","1.068","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054392","19.8159","0.0006","13.1908","0.0006","25.0863","0.0009","90","","90","","90","","6557.2","0.4","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C56 H52 Cu3 N18 O18 S4 -","- C56 H52 Cu3 N18 O18 S4 -","- C224 H208 Cu12 N72 O72 S16 -","4","0.5","","Sobiesiak, Marta; Muzioł, Tadeusz; Rozalski, Marek; Krajewska, Urszula; Budzisz, Elzbieta","Co(ii), Ni(ii) and Cu(ii) complexes with phenylthiazole and thiosemicarbazone-derived ligands: synthesis, structure and cytotoxic effects","New J. Chem.","2014","38","11","5349","","10.1039/C4NJ00977K","","x-ray","0.71073","MoKα","","0.101","0.0459","","","0.1021","0.123","","","","","","0.943","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054393","16.6552","0.0006","14.1497","0.0005","23.1221","0.001","90","","104.258","0.004","90","","5281.2","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15.6 H27.8 N8 Ni O7.3 S2 -","- C15.6 H27 N8 Ni O7.3 S2 -","- C124.8 H216 N64 Ni8 O58.4 S16 -","8","2","","Sobiesiak, Marta; Muzioł, Tadeusz; Rozalski, Marek; Krajewska, Urszula; Budzisz, Elzbieta","Co(ii), Ni(ii) and Cu(ii) complexes with phenylthiazole and thiosemicarbazone-derived ligands: synthesis, structure and cytotoxic effects","New J. Chem.","2014","38","11","5349","","10.1039/C4NJ00977K","","x-ray","0.71073","MoKα","","0.1445","0.072","","","0.2057","0.2381","","","","","","1.042","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054394","7.473","0.0007","13.8023","0.0013","14.6537","0.0014","65.559","0.003","80.509","0.003","85.41","0.003","1357.1","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H16 O2 S -","- C15 H16 O2 S -","- C60 H64 O8 S4 -","4","2","","Parumala, Santosh Kumar Reddy; Surasani, Seshi Reddy; Peddinti, Rama Krishna","S-Arylation of thiols with masked o-benzoquinones: synthesis of alkyl aryl/diaryl sulfides","New J. Chem.","2014","38","11","5268","","10.1039/C4NJ01381F","","","0.71073","MoKα","","0.1095","0.0911","","","0.3144","0.3255","","","","","","1.079","","","","has coordinates","180097","2020-10-21","18:00:00",""
"7054395","19.829","0.0002","14.321","0.0002","28.6903","0.0003","90","","91.055","0.001","90","","8145.84","0.16","120.01","0.1","120.01","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C68 H69.69 N24.33 Ni5 O13 -","- C68.01 H69.69 N24.33 Ni5 O13 -","- C272.04 H278.76 N97.32 Ni20 O52 -","4","1","","Tan, Yan-Xi; Zhang, Ying; He, Yan-Ping; Zheng, Yan-Jun","Microporous metal‒organic layer built from pentanuclear tetrahedral units: gas sorption and magnetism","New J. Chem.","2014","38","11","5272","","10.1039/C4NJ00517A","","","1.5418","CuKα","","0.0761","0.0716","","","0.2109","0.2165","","","","","","1.044","","","","has coordinates,has disorder","180097","2020-10-21","18:00:00",""
"7054424","10.173","0.003","12.359","0.004","13.936","0.005","98.604","0.006","96.093","0.006","91.034","0.003","1721.6","1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C36 H33 B Cl4 F2 N4 O Ru -","- C36 H33 B Cl4 F2 N4 O Ru -","- C72 H66 B2 Cl8 F4 N8 O2 Ru2 -","2","1","","Madhu, Sheri; Kumar, Sunit; Chatterjee, Tamal; Ravikanth, Mangalampalli","Synthesis, X-ray structure, spectral and electrochemical properties of a β-meso covalently linked BODIPY‒Ru(ii) dipyrrin complex","New J. Chem.","2014","38","11","5551","","10.1039/C4NJ01114G","","","0.7107","MoKα","","0.06","0.0502","","","0.1184","0.1255","","","","","","1.063","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054425","16.624","0.004","7.8685","0.0014","28.101","0.005","90","","102.325","0.007","90","","3591.1","1.3","293","2","293","2","","","","","","","synthesis as described","5","C 1 2 1","C 2y","5","","","","- C30 H38 N3 Ni S8 -","- C30 H38 N3 Ni S8 -","- C120 H152 N12 Ni4 S32 -","4","1","","Le Gal, Yann; Vacher, Antoine; Dorcet, Vincent; Fourmigué, Marc; Crassous, Jeanne; Lorcy, Dominique","The near infra red (NIR) chiroptical properties of nickel dithiolene complexes","New J. Chem.","2015","39","1","122","","10.1039/C4NJ01244E","","x-ray","0.71073","MoKα","","0.125","0.0635","","","0.1283","0.156","","","","","","0.996","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054426","8.5565","0.0003","11.6085","0.0003","37.5518","0.001","90","","90","","90","","3729.95","0.19","150","2","150","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H17 N3 S4 -","- C17 H17 N3 S4 -","- C136 H136 N24 S32 -","8","2","","Le Gal, Yann; Vacher, Antoine; Dorcet, Vincent; Fourmigué, Marc; Crassous, Jeanne; Lorcy, Dominique","The near infra red (NIR) chiroptical properties of nickel dithiolene complexes","New J. Chem.","2015","39","1","122","","10.1039/C4NJ01244E","","x-ray","0.71073","MoKα","","0.042","0.0365","","","0.0756","0.078","","","","","","1.026","","","","has coordinates","183084","2020-10-21","18:00:00",""
"7054427","21.9907","0.0009","27.7429","0.0014","29.1299","0.0012","90","","95.471","0.003","90","","17690.8","1.4","100","2","100.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C62 H88 O9 S2 -","- C61.7767 H71.3607 O8.66667 S2 -","- C741.32 H856.328 O104 S24 -","12","3","","Valluru, Gopikishore; Rahman, Shofiur; Georghiou, Paris E.; Dawe, Louise N.; Alodhayb, Abdullah N.; Beaulieu, Luc Y.","Synthesis of a cone-conformer bimodal calix[4]arene-crown-5 which forms a sensitive cesium ion sensing layer on gold-coated microcantilevers","New J. Chem.","2014","38","12","5868","","10.1039/C4NJ01213E","","","1.54178","CuKα","","0.2306","0.1519","","","0.398","0.4584","","","","","","1.595","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054428","11.933","0.003","14.282","0.003","22.324","0.004","90","","94.29","0.05","90","","3794","1.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37.43 H35.15 Fe Mn N9.72 O7 -","- C37.43 H35.145 Fe Mn N9.715 O7 -","- C149.72 H140.58 Fe4 Mn4 N38.86 O28 -","4","1","","Zhou, Hongbo; Wang, Yingying; Mou, Fangyou; Shen, Xiaoping; Liu, Yashu","Crystal structures and magneto-structural correlation analysis for several cyano-bridged bimetallic complexes based on MnIII‒FeIIIsystems","New J. Chem.","2014","38","12","5925","","10.1039/C4NJ01157K","","","0.71073","MoKα","","0.0986","0.0684","","","0.155","0.168","","","","","","1.077","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054429","11.985","0.003","14.249","0.004","22.419","0.006","90","","95.528","0.004","90","","3810.8","1.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H33 Fe Mn N9 O6 -","- C37 H33 Fe Mn N9 O6 -","- C148 H132 Fe4 Mn4 N36 O24 -","4","1","","Zhou, Hongbo; Wang, Yingying; Mou, Fangyou; Shen, Xiaoping; Liu, Yashu","Crystal structures and magneto-structural correlation analysis for several cyano-bridged bimetallic complexes based on MnIII‒FeIIIsystems","New J. Chem.","2014","38","12","5925","","10.1039/C4NJ01157K","","","0.71073","MoKα","","0.1026","0.0516","","","0.1132","0.1271","","","","","","0.978","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054430","11.415","0.005","13.273","0.005","14.081","0.006","65.735","0.004","67.531","0.004","71.71","0.005","1765.9","1.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H31 Fe Mn N9 O6 -","- C36 H31 Fe Mn N9 O6 -","- C72 H62 Fe2 Mn2 N18 O12 -","2","1","","Zhou, Hongbo; Wang, Yingying; Mou, Fangyou; Shen, Xiaoping; Liu, Yashu","Crystal structures and magneto-structural correlation analysis for several cyano-bridged bimetallic complexes based on MnIII‒FeIIIsystems","New J. Chem.","2014","38","12","5925","","10.1039/C4NJ01157K","","","0.71073","MoKα","","0.1037","0.0678","","","0.1457","0.1639","","","","","","0.993","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054431","23.328","0.005","10.078","0.002","26.115","0.005","90","","100.04","0.03","90","","6046","2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C58 H73 Fe Mn N9 O7 -","- C58 H73 Fe Mn N9 O7 -","- C232 H292 Fe4 Mn4 N36 O28 -","4","1","","Zhou, Hongbo; Wang, Yingying; Mou, Fangyou; Shen, Xiaoping; Liu, Yashu","Crystal structures and magneto-structural correlation analysis for several cyano-bridged bimetallic complexes based on MnIII‒FeIIIsystems","New J. Chem.","2014","38","12","5925","","10.1039/C4NJ01157K","","","0.71073","MoKα","","0.0742","0.0594","","","0.1517","0.1696","","","","","","1.092","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054432","22.68","0.005","10.109","0.002","26.26","0.005","90","","99.76","0.03","90","","5934","2","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55 H67.6 Fe Mn N8 O6.8 -","- C55 H60 Fe Mn N8 O6.8 -","- C220 H240 Fe4 Mn4 N32 O27.2 -","4","1","","Zhou, Hongbo; Wang, Yingying; Mou, Fangyou; Shen, Xiaoping; Liu, Yashu","Crystal structures and magneto-structural correlation analysis for several cyano-bridged bimetallic complexes based on MnIII‒FeIIIsystems","New J. Chem.","2014","38","12","5925","","10.1039/C4NJ01157K","","","0.71073","MoKα","","0.1682","0.131","","","0.2432","0.268","","","","","","1.015","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054433","13.148","0.003","14.128","0.003","25.24","0.005","90","","102.46","0.03","90","","4578","1.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C47.44 H45.3 Fe Mn N10 O6.44 -","- C47.437 H45.3 Fe Mn N10 O6.437 -","- C189.748 H181.2 Fe4 Mn4 N40 O25.748 -","4","1","","Zhou, Hongbo; Wang, Yingying; Mou, Fangyou; Shen, Xiaoping; Liu, Yashu","Crystal structures and magneto-structural correlation analysis for several cyano-bridged bimetallic complexes based on MnIII‒FeIIIsystems","New J. Chem.","2014","38","12","5925","","10.1039/C4NJ01157K","","","0.71073","MoKα","","0.0908","0.0747","","","0.1556","0.1671","","","","","","1.028","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054434","13.508","0.009","24.193","0.016","7.507","0.005","90","","94.864","0.001","90","","2444","3","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H33 N3 -","- C30 H33 N3 -","- C120 H132 N12 -","4","1","","Vishnoi, Pratap; Sen, Saumik; Patwari, G. Naresh; Murugavel, Ramaswamy","Charge transfer aided selective sensing and capture of picric acid by triphenylbenzenes","New J. Chem.","2015","39","2","886","","10.1039/C4NJ01093K","","","0.71075","MoKα","","0.1581","0.1283","","","0.2274","0.245","","","","","","1.303","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054435","10.766","0.003","13.96","0.005","17.294","0.006","102.357","0.005","98.189","0.005","100.935","0.004","2447","1.4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H42 N12 O21 -","- C48 H42 N12 O21 -","- C96 H84 N24 O42 -","2","1","","Vishnoi, Pratap; Sen, Saumik; Patwari, G. Naresh; Murugavel, Ramaswamy","Charge transfer aided selective sensing and capture of picric acid by triphenylbenzenes","New J. Chem.","2015","39","2","886","","10.1039/C4NJ01093K","","","0.71075","MoKα","","0.0852","0.0662","","","0.1486","0.1631","","","","","","1.087","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054436","8.8114","0.0004","9.8021","0.0005","24.4201","0.0011","90","","95.928","0.002","90","","2097.89","0.17","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 Cd N3 S4 -","- C17 H25 Cd N3 S4 -","- C68 H100 Cd4 N12 S16 -","4","1","","Mlowe, Sixberth; Lewis, David J.; Azad Malik, M.; Raftery, James; Mubofu, Egid B.; O'Brien, Paul; Revaprasadu, Neerish","Bis(piperidinedithiocarbamato)pyridinecadmium(ii) as a single-source precursor for the synthesis of CdS nanoparticles and aerosol-assisted chemical vapour deposition (AACVD) of CdS thin films","New J. Chem.","2014","38","12","6073","","10.1039/C4NJ01201A","","","1.54178","CuKα","","0.0362","0.0346","","","0.0851","0.087","","","","","","0.529","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054437","10.9888","0.0011","8.6363","0.0009","17.4813","0.0015","90","","94.688","0.004","90","","1653.5","0.3","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H38 Co2 N10 O8 S2 -","- C24 H38 Co2 N10 O8 S2 -","- C48 H76 Co4 N20 O16 S4 -","2","0.5","","Murphy, Michael J.; Usov, Pavel M.; Rizzuto, Felix J.; Kepert, Cameron J.; D'Alessandro, Deanna M.","Magnetic, electrochemical and optical properties of a sulfate-bridged Co(ii) imidazole dimer","New J. Chem.","2014","38","12","5856","","10.1039/C4NJ01401D","","","0.71073","MoKα","","0.032","0.0242","","","0.0761","0.101","","","","","","1.179","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054438","7.938","0.004","15.794","0.007","3.4414","0.0015","90","","99.992","0.009","90","","424.9","0.3","293","2","293","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Cd4 O10 Yb -","- B3 Cd4 O10 Yb -","- B6 Cd8 O20 Yb2 -","2","0.5","","Zou, Guohong; Huang, Ling; Cai, Huaqiang; Wang, Shichao; Ye, Ning","Synthesis and characterization of Cd4YbO(BO3)3‒ a congruent melting cadmium‒ytterbium oxyborate with large nonlinear optical properties","New J. Chem.","2014","38","12","6186","","10.1039/C4NJ01421A","","","0.71073","MoKα","","0.0545","0.0527","","","0.1367","0.138","","","","","","1.111","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054439","5.2735","0.0002","8.6164","0.0004","9.3766","0.0004","97.6974","0.0018","93.5064","0.0018","95.8677","0.0019","418.8","0.03","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C16 H26 N2 O6 -","2","1","","Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J.","Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy","New J. Chem.","2014","38","12","5905","","10.1039/C4NJ01339E","","","0.71073","MoKα","","0.0522","0.0424","","0.124","0.1079","0.124","","","","","","0.9467","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054440","10.5713","0.0008","10.6265","0.0005","11.0705","0.0007","72.339","0.005","78.005","0.006","80.552","0.005","1152.29","0.13","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C7 H11 N O3 -","- C7 H11 N O3 -","- C42 H66 N6 O18 -","6","3","","Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J.","Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy","New J. Chem.","2014","38","12","5905","","10.1039/C4NJ01339E","","","1.54184","CuKα","","0.0631","0.0583","","0.1568","0.1518","0.1568","","","","","","0.9925","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054441","6.27304","0.00011","8.13334","0.00011","27.281","0.0005","90","","91.0045","0.0016","90","","1391.68","0.04","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H21 N O5 -","- C13 H21 N O5 -","- C52 H84 N4 O20 -","4","1","","Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J.","Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy","New J. Chem.","2014","38","12","5905","","10.1039/C4NJ01339E","","","1.54184","CuKα","","0.0422","0.0349","","0.0901","0.0854","0.0899","","","","","","0.9877","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054442","7.54965","0.00008","7.8511","0.0001","23.3724","0.0003","90","","95.6507","0.0011","90","","1378.62","0.03","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H18 N2 O3 S2 -","- C11 H18 N2 O3 S2 -","- C44 H72 N8 O12 S8 -","4","1","","Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J.","Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy","New J. Chem.","2014","38","12","5905","","10.1039/C4NJ01339E","","","1.54184","CuKα","","0.0297","0.0277","","0.0742","0.0718","0.0742","","","","","","0.9588","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054443","7.9432","0.0006","8.4258","0.0006","11.299","0.0008","89.703","0.006","71.855","0.006","73.959","0.006","687.92","0.09","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H18 N2 O3 S2 -","- C11 H18 N2 O3 S2 -","- C22 H36 N4 O6 S4 -","2","1","","Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J.","Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy","New J. Chem.","2014","38","12","5905","","10.1039/C4NJ01339E","","","0.71073","MoKα","","0.0878","0.0565","","0.1161","0.0953","0.1155","","","","","","1.0097","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054444","7.71325","0.00007","8.16076","0.00007","23.754","0.0002","90","","94.6857","0.0008","90","","1490.22","0.02","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H20 N2 O3 S2 -","- C13 H20 N2 O3 S2 -","- C52 H80 N8 O12 S8 -","4","1","","Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J.","Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy","New J. Chem.","2014","38","12","5905","","10.1039/C4NJ01339E","","","1.54184","CuKα","","0.0265","0.0257","","0.108","0.1049","0.108","","","","","","0.9997","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054445","6.2079","0.0004","7.7139","0.0007","8.6278","0.0008","82.686","0.008","88.718","0.007","89.279","0.006","409.68","0.06","150","","150","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H11 N O3 -","- C8 H11 N O3 -","- C16 H22 N2 O6 -","2","1","","Gruber, Tobias; Thompson, Amber L.; Odell, Barbara; Bombicz, Petra; Schofield, Christopher J.","Conformational studies on substituted ε-caprolactams by X-ray crystallography and NMR spectroscopy","New J. Chem.","2014","38","12","5905","","10.1039/C4NJ01339E","","","1.54184","CuKα","","0.0338","0.0327","","0.0895","0.0883","0.0895","","","","","","1.0124","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054446","19.53","0.002","19.53","0.002","15.3376","0.0016","90","","90","","90","","5850.1","1","150","2","150","2","","","","","","","","5","I 41/a","-I 4ad","88","","","","- C60 H72 N8 O4 S4 -","- C60 H72 N8 O4 S4 -","- C240 H288 N32 O16 S16 -","4","","","Zhao, Jiang-Lin; Tomiyasu, Hirotsugu; Ni, Xin-Long; Zeng, Xi; Elsegood, Mark R. J.; Redshaw, Carl; Rahman, Shofiur; Georghiou, Paris E.; Yamato, Takehiko","Synthesis and evaluation of a novel ionophore based on a thiacalix[4]arene derivative bearing imidazole units","New J. Chem.","2014","38","12","6041","","10.1039/C4NJ01099J","","","0.71073","MoKα","","0.0789","0.0401","","","0.0748","0.0899","","","","","","1.041","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054447","13.2947","0.0005","21.6351","0.0009","37.7271","0.0015","90","","90","","90","","10851.5","0.7","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C51 H68 N4 O7 S4 -","- C51 H68 N4 O7 S4 -","- C408 H544 N32 O56 S32 -","8","1","","Zhao, Jiang-Lin; Tomiyasu, Hirotsugu; Ni, Xin-Long; Zeng, Xi; Elsegood, Mark R. J.; Redshaw, Carl; Rahman, Shofiur; Georghiou, Paris E.; Yamato, Takehiko","Synthesis and evaluation of a novel ionophore based on a thiacalix[4]arene derivative bearing imidazole units","New J. Chem.","2014","38","12","6041","","10.1039/C4NJ01099J","","","0.71073","MoKα","","0.0725","0.0497","","","0.1268","0.1426","","","","","","1.051","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054448","8.7748","0.0018","9.1491","0.0018","17.558","0.004","93.54","0.03","97.12","0.03","98.33","0.03","1379.4","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H24 Au N2 O3 P -","- C33 H24 Au N2 O3 P -","- C66 H48 Au2 N4 O6 P2 -","2","1","","Shi, Hua-Yun; Qi, Jie; Zhao, Zhen-Ze; Feng, Wen-Juan; Li, Yu-Hao; Sun, Lu; Lin, Zhuo-Jia; Chao, Hsiu-Yi","Synthesis, characterization, photophysics, and anion binding properties of gold(i) acetylide complexes with amide groups","New J. Chem.","2014","38","12","6168","","10.1039/C4NJ01294A","","","0.71073","MoKα","","0.0486","0.0345","","","0.0854","0.0918","","","","","","0.768","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054449","9.8538","0.0003","12.9015","0.0004","12.7365","0.0004","90","","97.033","0.003","90","","1606.99","0.09","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 Fe N3 O3 -","- C16 H19 Fe N3 O3 -","- C64 H76 Fe4 N12 O12 -","4","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.043","0.0344","","","0.0829","0.0896","","","","","","1.069","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054450","12.5421","0.0007","14.1112","0.0008","9.8489","0.0006","90","","92.506","0.005","90","","1741.43","0.17","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 Fe N3 O3 -","- C17 H21 Fe N3 O3 -","- C68 H84 Fe4 N12 O12 -","4","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0973","0.084","","","0.2461","0.2652","","","","","","1.037","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054451","7.6098","0.0003","9.9244","0.0004","12.4142","0.0004","94.402","0.003","97.669","0.003","107.436","0.003","879.69","0.06","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H23 Fe N3 O4 -","- C17 H23 Fe N3 O4 -","- C34 H46 Fe2 N6 O8 -","2","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0333","0.0288","","","0.0741","0.0776","","","","","","1.026","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054452","6.06","0.0002","12.5298","0.0005","20.6252","0.0005","80.833","0.003","87.615","0.002","87.665","0.003","1543.82","0.09","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H17 Fe N4 O3.5 -","- C14 H17 Fe N4 O3.5 -","- C56 H68 Fe4 N16 O14 -","4","2","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0802","0.0677","","","0.1896","0.2023","","","","","","1.103","","","","has coordinates","182257","2020-10-21","18:00:00",""
"7054453","43.0383","0.0015","5.8461","0.0003","8.4347","0.0005","90","","90","","90","","2122.22","0.18","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C21 H19 Fe N5 O7 -","- C21 H19 Fe N5 O7 -","- C84 H76 Fe4 N20 O28 -","4","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0822","0.0724","","","0.1647","0.1716","","","","","","1.091","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054454","9.4141","0.0004","11.4937","0.0005","11.5265","0.0006","109.571","0.004","96.214","0.004","105.601","0.004","1104.49","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H21 Fe N5 O7 -","- C22 H21 Fe N5 O7 -","- C44 H42 Fe2 N10 O14 -","2","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.049","0.0392","","","0.1011","0.1117","","","","","","1.061","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054455","7.4108","0.0003","13.2305","0.0006","13.7738","0.0005","63.098","0.004","74.466","0.003","78.581","0.004","1155.71","0.09","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H23 Fe N5 O7 -","- C23 H23 Fe N5 O7 -","- C46 H46 Fe2 N10 O14 -","2","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0389","0.0329","","","0.0823","0.0867","","","","","","1.035","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054456","11.0568","0.0004","11.2915","0.0004","11.3242","0.0004","77.032","0.003","73.612","0.003","62.236","0.004","1192.99","0.09","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H23 Fe N5 O7 -","- C23 H23 Fe N5 O7 -","- C46 H46 Fe2 N10 O14 -","2","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0549","0.0447","","","0.1153","0.1258","","","","","","1.021","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054457","22.3748","0.0009","5.7925","0.0003","19.342","0.001","90","","90","","90","","2506.8","0.2","296","2","296","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H25 Fe N5 O7 -","- C24 H25 Fe N5 O7 -","- C96 H100 Fe4 N20 O28 -","4","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0892","0.0551","","","0.1113","0.1322","","","","","","1.039","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054458","8.4026","0.0004","10.9599","0.0004","12.3548","0.0005","107.976","0.004","102.058","0.004","92.43","0.004","1051.35","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 Fe N6 O7 -","- C20 H18 Fe N6 O7 -","- C40 H36 Fe2 N12 O14 -","2","1","","Liu, Xuelin; Zhang, Weiqiang; Zhang, Guofang; Gao, Ziwei","Low-migratory ionic ferrocene-based burning rate catalysts with high combustion catalytic efficiency","New J. Chem.","2015","39","1","155","","10.1039/C4NJ01216J","","","0.71073","MoKα","","0.0458","0.0358","","","0.0831","0.0901","","","","","","1.026","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054459","15.959","0.005","11.194","0.003","13.281","0.004","90","","100.678","0.005","90","","2331.5","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H27 Co N2 O9 -","- C22 H27 Co N2 O9 -","- C88 H108 Co4 N8 O36 -","4","1","","Mitra, Merry; Raghavaiah, Pallepogu; Ghosh, Rajarshi","A mononuclear cobalt(iii) complex and its catecholase activity","New J. Chem.","2015","39","1","200","","10.1039/C4NJ01587H","","","0.71073","MoKα","","0.0672","0.0556","","","0.1456","0.1542","","","","","","1.063","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054460","13.9035","0.001","13.9035","0.001","33.499","0.005","90","","90","","120","","5608","1","296","2","296","2","","","","","","","","8","P 63/m","-P 6c","176","0012ljm","","","- C6 H26 As2 N9 Na9 Ni3 O73 W18 -","- C6 H25.92 As2 N9 Na9 Ni3 O73 W18 -","- C12 H51.84 As4 N18 Na18 Ni6 O146 W36 -","2","0.166667","","Liu, Jia-min; Wang, Lu; Yu, Kai; Su, Zhan-hua; Wang, Chun-xiao; Wang, Chun-mei; Zhou, Bai-bin","Synthesis, crystal structure and properties of sandwich type compounds based on {AsW9} and a hexa-nuclear unit with three supporting TM‒triazole complexes","New J. Chem.","2015","39","2","1139","","10.1039/C4NJ01138D","","","0.71073","MoKα","","0.0759","0.0574","","","0.0928","0.1091","","","","","","1.074","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054461","13.9494","0.0008","13.9494","0.0008","33.76","0.004","90","","90","","120","","5689.1","0.8","296","2","296","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C6 H37 As2 Mn3 N9 Na9 O78.5 W18 -","- C6 H36.96 As2 Mn3 N9 Na9 O78.5 W18 -","- C12 H73.92 As4 Mn6 N18 Na18 O157 W36 -","2","0.166667","","Liu, Jia-min; Wang, Lu; Yu, Kai; Su, Zhan-hua; Wang, Chun-xiao; Wang, Chun-mei; Zhou, Bai-bin","Synthesis, crystal structure and properties of sandwich type compounds based on {AsW9} and a hexa-nuclear unit with three supporting TM‒triazole complexes","New J. Chem.","2015","39","2","1139","","10.1039/C4NJ01138D","","","0.71073","MoKα","","0.0682","0.0433","","","0.1012","0.119","","","","","","1.045","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054462","13.9307","0.0005","13.9307","0.0005","33.554","0.003","90","","90","","120","","5639.2","0.6","296","2","296","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C6 H34 As2 Co3 N9 Na9 O77 W18 -","- C6 H30.96 As2 Co3 N9 Na9 O77 W18 -","- C12 H61.92 As4 Co6 N18 Na18 O154 W36 -","2","0.166667","","Liu, Jia-min; Wang, Lu; Yu, Kai; Su, Zhan-hua; Wang, Chun-xiao; Wang, Chun-mei; Zhou, Bai-bin","Synthesis, crystal structure and properties of sandwich type compounds based on {AsW9} and a hexa-nuclear unit with three supporting TM‒triazole complexes","New J. Chem.","2015","39","2","1139","","10.1039/C4NJ01138D","","","0.71073","MoKα","","0.0686","0.0457","","","0.0932","0.1013","","","","","","1.051","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054463","9.807","0.009","9.807","0.009","34.426","0.003","90","","90","","90","","3311","4","296","2","296","2","","","","","","","","5","P 41","P 4w","76","","","","- C26 H30 Cd N12 O8 -","- C26 H30 Cd N12 O8 -","- C104 H120 Cd4 N48 O32 -","4","1","","Guan, Qing-Lin; Liu, Zhi; Wei, Wen-Juan; Xing, Yong-Heng; Liu, Jing; Zhang, Rui; Hou, Ya-Nan; Wang, Xuan; Bai, Feng-Ying","Synthesis, structure, spectroscopy of four novel supramolecular complexes and cytotoxicity study by application of multiple parallel perfused microbioreactors","New Journal of Chemistry","2014","38","7","3258","","10.1039/c3nj01646c","","","0.71073","MoKα","","0.0951","0.0771","","","0.178","0.1885","","","","","","1.071","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054464","9.839","0.001","9.839","0.001","34.516","0.003","90","","90","","90","","3341.4","0.6","273","2","273","2","","","","","","","","5","P 41","P 4w","76","","","","- C27 H31 Cd N10 O2.5 -","- C27 H31 Cd N10 O2.5 -","- C108 H124 Cd4 N40 O10 -","4","1","","Guan, Qing-Lin; Liu, Zhi; Wei, Wen-Juan; Xing, Yong-Heng; Liu, Jing; Zhang, Rui; Hou, Ya-Nan; Wang, Xuan; Bai, Feng-Ying","Synthesis, structure, spectroscopy of four novel supramolecular complexes and cytotoxicity study by application of multiple parallel perfused microbioreactors","New Journal of Chemistry","2014","38","7","3258","","10.1039/c3nj01646c","","","0.71073","MoKα","","0.1139","0.0889","","","0.2475","0.2706","","","","","","1.052","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054465","9.537","0.004","12.679","0.003","15.191","0.001","108.093","0.001","104.845","0.001","91.562","0.001","1676.3","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C31.5 H28.5 N7.5 O11.5 Zn -","- C31.5 H28.5 N7.5 O11.5 Zn -","- C63 H57 N15 O23 Zn2 -","2","1","","Guan, Qing-Lin; Liu, Zhi; Wei, Wen-Juan; Xing, Yong-Heng; Liu, Jing; Zhang, Rui; Hou, Ya-Nan; Wang, Xuan; Bai, Feng-Ying","Synthesis, structure, spectroscopy of four novel supramolecular complexes and cytotoxicity study by application of multiple parallel perfused microbioreactors","New Journal of Chemistry","2014","38","7","3258","","10.1039/c3nj01646c","","","0.71073","MoKα","","0.0563","0.039","","","0.0922","0.1008","","","","","","1.029","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054466","9.9875","0.0007","21.46","0.0018","34.472","0.003","90","","104.236","0.005","90","","7161.6","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C68 H53 N16 O25.5 Zn3 -","- C68 H52 N16 O25.5 Zn3 -","- C272 H208 N64 O102 Zn12 -","4","1","","Guan, Qing-Lin; Liu, Zhi; Wei, Wen-Juan; Xing, Yong-Heng; Liu, Jing; Zhang, Rui; Hou, Ya-Nan; Wang, Xuan; Bai, Feng-Ying","Synthesis, structure, spectroscopy of four novel supramolecular complexes and cytotoxicity study by application of multiple parallel perfused microbioreactors","New Journal of Chemistry","2014","38","7","3258","","10.1039/c3nj01646c","","","0.71073","MoKα","","0.1699","0.0613","","","0.1529","0.1842","","","","","","0.857","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054467","7.0077","0.0003","27.0442","0.0016","9.784","0.0005","90","","102.138","0.004","90","","1812.79","0.16","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 Mo N2 O7 -","- C17 H18 Mo N2 O7 -","- C68 H72 Mo4 N8 O28 -","4","1","","Vrdoljak, Višnja; Pisk, Jana; Agustin, Dominique; Novak, Predrag; Parlov Vuković, Jelena; Matković-Čalogović, Dubravka","Dioxomolybdenum(vi) and dioxotungsten(vi) complexes chelated with the ONO tridentate hydrazone ligand: synthesis, structure and catalytic epoxidation activity","New J. Chem.","2014","38","12","6176","","10.1039/C4NJ01394H","","","0.7107","MoKα","","0.055","0.031","","","0.0607","0.0648","","","","","","0.907","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054468","3.9792","0.0001","10.3039","0.0003","21.3511","0.0009","90","","95.342","0.004","90","","871.62","0.05","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C17 H15 Mo N3 O6 -","- C17 H15 Mo N3 O6 -","- C34 H30 Mo2 N6 O12 -","2","1","","Vrdoljak, Višnja; Pisk, Jana; Agustin, Dominique; Novak, Predrag; Parlov Vuković, Jelena; Matković-Čalogović, Dubravka","Dioxomolybdenum(vi) and dioxotungsten(vi) complexes chelated with the ONO tridentate hydrazone ligand: synthesis, structure and catalytic epoxidation activity","New J. Chem.","2014","38","12","6176","","10.1039/C4NJ01394H","","","0.71073","MoKα","","0.0352","0.0336","","","0.075","0.0758","","","","","","0.993","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054469","6.6695","0.0009","18.7911","0.0019","14.411","0.002","90","","96.799","0.014","90","","1793.4","0.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 Mo N2 O7 -","- C17 H18 Mo N2 O7 -","- C68 H72 Mo4 N8 O28 -","4","1","","Vrdoljak, Višnja; Pisk, Jana; Agustin, Dominique; Novak, Predrag; Parlov Vuković, Jelena; Matković-Čalogović, Dubravka","Dioxomolybdenum(vi) and dioxotungsten(vi) complexes chelated with the ONO tridentate hydrazone ligand: synthesis, structure and catalytic epoxidation activity","New J. Chem.","2014","38","12","6176","","10.1039/C4NJ01394H","","","0.71073","MoKα","","0.1227","0.0623","","","0.1117","0.1386","","","","","","0.978","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054470","9.2163","0.0003","9.9981","0.0004","10.1284","0.0003","63.594","0.004","65.191","0.003","89.389","0.003","740.79","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H24 Mo2 N4 O12 -","- C30 H24 Mo2 N4 O12 -","- C30 H24 Mo2 N4 O12 -","1","0.5","","Vrdoljak, Višnja; Pisk, Jana; Agustin, Dominique; Novak, Predrag; Parlov Vuković, Jelena; Matković-Čalogović, Dubravka","Dioxomolybdenum(vi) and dioxotungsten(vi) complexes chelated with the ONO tridentate hydrazone ligand: synthesis, structure and catalytic epoxidation activity","New J. Chem.","2014","38","12","6176","","10.1039/C4NJ01394H","","","0.71073","MoKα","","0.0266","0.0229","","","0.0515","0.0528","","","","","","1.029","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054471","6.9243","0.0001","7.5678","0.0002","15.8992","0.0004","95.56","0.002","90.676","0.002","100.214","0.002","815.73","0.03","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H16 Mo N2 O6 -","- C16 H16 Mo N2 O6 -","- C32 H32 Mo2 N4 O12 -","2","1","","Vrdoljak, Višnja; Pisk, Jana; Agustin, Dominique; Novak, Predrag; Parlov Vuković, Jelena; Matković-Čalogović, Dubravka","Dioxomolybdenum(vi) and dioxotungsten(vi) complexes chelated with the ONO tridentate hydrazone ligand: synthesis, structure and catalytic epoxidation activity","New J. Chem.","2014","38","12","6176","","10.1039/C4NJ01394H","","","0.71073","MoKα","","0.0275","0.0239","","","0.061","0.062","","","","","","1.02","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054472","7.3136","0.0013","4.5404","0.0008","12.823","0.002","90","","103.9","0.004","90","","413.34","0.12","100","","100","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C9 H8 N4 -","- C9 H8 N4 -","- C18 H16 N8 -","2","1","","Goswami, Shyamaprosad; Chakraborty, Shampa; Adak, Monoj Kumar; Halder, Sandipan; Quah, Ching Kheng; Fun, Hoong-Kun; Pakhira, Bholanath; Sarkar, Sabyasachi","A highly selective ratiometric chemosensor for Ni2+in a quinoxaline matrix","New J. Chem.","2014","38","12","6230","","10.1039/C4NJ01498G","","","0.71073","MoKα","","0.0374","0.0331","","","0.0826","0.0849","","","","","","1.101","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054473","9.5091","0.0015","13.741","0.002","15.412","0.0018","62.573","0.004","73.988","0.006","87.296","0.007","1710.6","0.4","113","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C72 H62 Cl12 N6 -","- C72 H62 Cl12 N6 -","- C72 H62 Cl12 N6 -","1","0.5","","Muratsugu, Satoshi; Nishihara, Hiroshi","π-Conjugation modification of photochromic and redox-active dimethyldihydropyrene by phenyl- and ethynyl-terpyridines and Ru(bis-terpyridine) complexes","New J. Chem.","2014","38","12","6114","","10.1039/C4NJ01462F","","","0.7107","MoKα","","","0.0515","","","","0.1393","","","","","","1.058","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054474","6.9708","0.0014","14.408","0.002","7.8104","0.0013","90","","105.99","0.02","90","","754.1","0.2","173","2","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","3,4-Dicarboxamidoximyl-furoxane","3,4-Dicarboxamidoximyl-furoxane","","- C4 H6 N6 O4 -","- C4 H6 N6 O4 -","- C16 H24 N24 O16 -","4","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0602","0.0485","","","0.1211","0.1288","","","","","","1.139","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054475","7.5509","0.0013","7.844","0.0015","18.562","0.003","90","","94.987","0.016","90","","1095.3","0.3","293","2","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bisammonium 4,5-bis(1-oxidotetrazolyl)furoxane","bisammonium 4,5-bis(1-oxidotetrazolyl)furoxane","","- C4 H8 N12 O4 -","- C4 H8 N12 O4 -","- C16 H32 N48 O16 -","4","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0575","0.0386","","","0.0908","0.1018","","","","","","1.026","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054476","8.0286","0.0012","8.0668","0.0011","9.6666","0.0015","90","","90.004","0.012","90","","626.06","0.16","173","2","173","","","","","","","","","4","P 1 21 1","P 2yb","4","bishydroxyammonium 4,5-bis(1-oxidotetrazolyl)furoxane monohydrate","bishydroxyammonium 4,5-bis(1-oxidotetrazolyl)furoxane monohydrate","","- C4 H10 N12 O7 -","- C4 H10 N12 O7 -","- C8 H20 N24 O14 -","2","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0418","0.0319","","","0.057","0.0616","","","","","","1.04","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054477","6.985","0.0005","8.4845","0.0005","13.8574","0.0009","90","","90","","90","","821.25","0.09","100","2","100","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","3,4-Dichloroximidoyl-furoxane","3,4-Dichloroximidoyl-furoxane","","- C4 H2 Cl2 N4 O4 -","- C4 H2 Cl2 N4 O4 -","- C16 H8 Cl8 N16 O16 -","4","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0294","0.027","","","0.0599","0.0616","","","","","","1.038","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054478","8.2678","0.0006","11.2186","0.0007","8.5693","0.0005","90","","99.912","0.006","90","","782.97","0.09","100","2","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","3,4-Bis(chloroximidoyl)furazane","3,4-Bis(chloroximidoyl)furazane","","- C4 H2 Cl2 N4 O3 -","- C4 H2 Cl2 N4 O3 -","- C16 H8 Cl8 N16 O12 -","4","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0372","0.0291","","","0.067","0.0736","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054479","12.844","0.003","8.919","0.005","6.988","0.004","90","","112.147","0.005","90","","741.5","0.6","100","2","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","3,4-(Dicarboxamidoxyl)furazane","3,4-(Dicarboxamidoxyl)furazane","","- C4 H6 N6 O3 -","- C4 H6 N6 O3 -","- C16 H24 N24 O12 -","4","0.5","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0517","0.0388","","","0.0955","0.1058","","","","","","1.075","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054480","7.1412","0.0006","7.2056","0.0008","11.498","0.0009","89.658","0.007","73.514","0.007","64.814","0.009","508.88","0.09","100","2","100","","","","","","","","","4","P -1","-P 1","2","dipotassium bis(1-oxido-tetrazolyl)-furoxane","dipotassium bis(1-oxido-tetrazolyl)-furoxane","","- C4 K2 N10 O4 -","- C4 K2 N10 O4 -","- C8 K4 N20 O8 -","2","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0332","0.0255","","","0.0565","0.0597","","","","","","1.071","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054481","14.7455","0.0008","11.7557","0.0006","10.6941","0.0006","90","","129.904","0.005","90","","1422.05","0.17","100","2","100","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","bisguanidinium bis(1-oxido-tetrazolyl)-furoxane","bisguanidinium bis(1-oxido-tetrazolyl)-furoxane","","- C6 H12 N16 O4 -","- C6 H12 N16 O4 -","- C24 H48 N64 O16 -","4","0.5","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0468","0.0366","","","0.0815","0.0876","","","","","","1.062","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054482","7.0135","0.0007","31.347","0.002","7.9795","0.0007","90","","115.793","0.012","90","","1579.5","0.3","100","2","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","bis-aminoguanidinium bis-(1-oxidotetrazolyl)-furoxane","bis-aminoguanidinium bis-(1-oxidotetrazolyl)-furoxane","","- C6 H14 N18 O4 -","- C6 H14 N18 O4 -","- C24 H56 N72 O16 -","4","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.052","0.0374","","","0.0799","0.0874","","","","","","1.02","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054483","7.4337","0.0004","21.6146","0.0009","7.5901","0.0004","90","","97.741","0.005","90","","1208.44","0.1","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","dipotassium bis(1-oxidotetrazolyl)furazane dihydrate","dipotassium bis(1-oxidotetrazolyl)furazane dihydrate","","- C4 H4 K2 N10 O5 -","- C4 H4 K2 N10 O5 -","- C16 H16 K8 N40 O20 -","4","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0307","0.0254","","","0.0581","0.061","","","","","","1.046","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054484","3.7659","0.0003","11.0046","0.0014","14.3912","0.0016","97.056","0.01","95.04","0.008","98.978","0.009","581.14","0.11","236","","236","","","","","","","","","4","P -1","-P 1","2","bishydrazinium bis(1-oxidotetrazolyl)-furazane","bishydrazinium bis(1-oxidotetrazolyl)-furazane","","- C4 H10 N14 O3 -","- C4 H10 N14 O3 -","- C8 H20 N28 O6 -","2","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0736","0.0446","","","0.0826","0.097","","","","","","0.98","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054485","14.5573","0.0013","7.5523","0.0007","19.5093","0.0014","90","","90","","90","","2144.9","0.3","293","2","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","bisammonium 4,5-bis(1-oxido-tetrazolyl)furazane","bisammonium 4,5-bis(1-oxido-tetrazolyl)furazane","","- C4 H8 N12 O3 -","- C4 H8 N12 O3 -","- C32 H64 N96 O24 -","8","1","","Fischer, Dennis; Klapötke, Thomas M.; Reymann, Marius; Stierstorfer, Jörg; Völkl, Maurus B. R.","Energetic alliance of tetrazole-1-oxides and 1,2,5-oxadiazoles","New J. Chem.","2015","39","3","1619","","10.1039/C4NJ01351D","","","0.71073","MoKα","","0.0865","0.0465","","","0.0782","0.0959","","","","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054486","8.3016","0.0003","12.104","0.0004","16.4292","0.0005","90","","98.436","0.003","90","","1632.99","0.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H11 F4 N O2 -","- C19 H11 F4 N O2 -","- C76 H44 F16 N4 O8 -","4","1","","Huo, Yanping; Lu, Jiguo; Lu, Tianhua; Fang, Xiaoming; Ouyang, Xinhua; Zhang, Li; Yuan, Guozan","Comparative studies on OLED performances of chloro and fluoro substituted Zn(ii) 8-hydroxyquinolinates","New J. Chem.","2015","39","1","333","","10.1039/C4NJ01085J","","","1.54178","CuKα","","0.0817","0.0704","","","0.2105","0.2274","","","","","","1.131","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054487","6.9516","0.0003","8.1294","0.0003","9.6234","0.0004","74.586","0.004","80.157","0.004","83.657","0.003","515.35","0.04","293","2","293.15","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H16 N2 O3 -","- C9 H16 N2 O3 -","- C18 H32 N4 O6 -","2","1","","Maton, C.; Van Hecke, K.; Stevens, C. V.","Peralkylated imidazolium carbonate ionic liquids: synthesis using dimethyl carbonate, reactivity and structure","New J. Chem.","2015","39","1","461","","10.1039/C4NJ01301H","","","1.5418","CuKα","","0.042","0.0387","","","0.1094","0.1125","","","","","","1.089","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054488","6.77997","0.00017","14.4971","0.0004","9.8785","0.0003","90","","100.572","0.003","90","","954.47","0.05","293","2","293.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H15 Cl N2 -","- C8 H15 Cl N2 -","- C32 H60 Cl4 N8 -","4","1","","Maton, C.; Van Hecke, K.; Stevens, C. V.","Peralkylated imidazolium carbonate ionic liquids: synthesis using dimethyl carbonate, reactivity and structure","New J. Chem.","2015","39","1","461","","10.1039/C4NJ01301H","","","1.5418","CuKα","","0.0413","0.0366","","","0.1014","0.1064","","","","","","1.068","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054489","19.8873","0.0006","19.8873","0.0006","14.4048","0.0004","90","","90","","120","","4933.9","0.3","100","2","100","2","","","","","","","","4","R -3","-R 3","148","","","","- C9 H17 Cl N2 -","- C9 H17 Cl N2 -","- C162 H306 Cl18 N36 -","18","","","Maton, C.; Van Hecke, K.; Stevens, C. V.","Peralkylated imidazolium carbonate ionic liquids: synthesis using dimethyl carbonate, reactivity and structure","New J. Chem.","2015","39","1","461","","10.1039/C4NJ01301H","","","1.5418","CuKα","","0.0522","0.0399","","","0.0934","0.0981","","","","","","1.031","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054490","12.3316","0.0007","21.3475","0.0011","8.8212","0.0005","90","","92.34","0.003","90","","2320.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H22 N2 O -","- C32 H22 N2 O -","- C128 H88 N8 O4 -","4","1","","Jayabharathi, Jayaraman; Ramanathan, Periyasamy; Thanikachalam, Venugopal","Synthesis and optical properties of phenanthromidazole derivatives for organic electroluminescent devices","New J. Chem.","2015","39","1","142","","10.1039/C4NJ01515K","","","0.71073","MoKα","","0.1092","0.0528","","","0.1186","0.1422","","","","","","1.024","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054491","9.575","0.009","20.505","0.017","15.88","0.015","90","","105.413","0.011","90","","3006","5","173","","173","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-phenyl-1-H-1,2,3-triazol-1-yl) phenol complex with Tetra-n-butylammonium fluoride","","- C30 H47 F N4 O -","- C30 H47 F N4 O -","- C120 H188 F4 N16 O4 -","4","1","","Ghosh, Debanjana; Rhodes, Shannon; Hawkins, Karena; Winder, Domonique; Atkinson, Austin; Ming, Weihua; Padgett, Clifford; Orvis, Jeffrey; Aiken, Karelle; Landge, Shainaz","A simple and effective 1,2,3-triazole based “turn-on” fluorescence sensor for the detection of anions","New J. Chem.","2015","39","1","295","","10.1039/C4NJ01411A","","","0.71075","MoKα","","","0.0642","","","","0.2037","","","","","","1.066","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054492","16.2354","0.0008","19.1181","0.001","8.2268","0.0004","90","","90","","90","","2553.5","0.2","293","2","293","2","","","","","","","","4","I b a 2","I 2 -2c","45","","","","- C12 H14 O5 Pb -","- C12 H14 O5 Pb -","- C96 H112 O40 Pb8 -","8","1","","Bo, Qi-Bing; Pang, Juan-Juan; Wang, Hong-Yan; Fan, Chun-Hua; Zhang, Zhen-Wei","In situ solvent and counteranion-induced synthesis, structural characterization and photoluminescence properties of Pb-based MOFs","New J. Chem.","2015","39","1","431","","10.1039/C4NJ01506A","","","0.71073","MoKα","","0.0557","0.0326","","","0.0678","0.0798","","","","","","1.025","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054493","18.7933","0.0009","17.7755","0.0006","8.2471","0.0003","90","","99.723","0.004","90","","2715.45","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 O9 Pb3 -","- C24 H24 O9 Pb3 -","- C96 H96 O36 Pb12 -","4","1","","Bo, Qi-Bing; Pang, Juan-Juan; Wang, Hong-Yan; Fan, Chun-Hua; Zhang, Zhen-Wei","In situ solvent and counteranion-induced synthesis, structural characterization and photoluminescence properties of Pb-based MOFs","New J. Chem.","2015","39","1","431","","10.1039/C4NJ01506A","","","0.71073","MoKα","","0.0975","0.0599","","","0.1319","0.1551","","","","","","1.029","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054494","18.4043","0.0005","30.9956","0.0009","6.9963","0.0002","90","","90","","90","","3991.1","0.2","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C36 H36 O13 Pb4 -","- C36 H36 O13 Pb4 -","- C144 H144 O52 Pb16 -","4","1","","Bo, Qi-Bing; Pang, Juan-Juan; Wang, Hong-Yan; Fan, Chun-Hua; Zhang, Zhen-Wei","In situ solvent and counteranion-induced synthesis, structural characterization and photoluminescence properties of Pb-based MOFs","New J. Chem.","2015","39","1","431","","10.1039/C4NJ01506A","","","0.71073","MoKα","","0.041","0.0354","","","0.0749","0.0778","","","","","","1.055","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054495","10.594","0.0005","14.2967","0.0007","14.5177","0.0008","84.866","0.001","68.83","0.001","77.339","0.001","2000.46","0.18","100","1","100","1","","","","","","","","6","P -1","-P 1","2","","","","- C40 H44 Fe N8 O2 Se2 -","- C40 H44 Fe N8 O2 Se2 -","- C80 H88 Fe2 N16 O4 Se4 -","2","1","","Nguyen, Luong Lam; Guillot, Régis; Laisney, Jérôme; Rechignat, Lionel; Bedoui, Salma; Molnár, Gabor; Rivière, Eric; Boillot, Marie-Laure","Fe(Me2-bpy)2(NCSe)2spin-crossover micro- and nanoparticles showing spin-state switching above 250 K","New J. Chem.","2015","39","3","1603","","10.1039/C4NJ01257G","","x-ray","0.71073","MoKα","","0.0978","0.0632","","","0.1633","0.1832","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054496","12.203","0.001","19.513","0.002","15.887","0.001","90","","90.858","0.002","90","","3782.5","0.6","100","1","100","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H36 Fe N8 O3 Se2 -","- C38 H36 Fe N8 O3 Se2 -","- C152 H144 Fe4 N32 O12 Se8 -","4","1","","Nguyen, Luong Lam; Guillot, Régis; Laisney, Jérôme; Rechignat, Lionel; Bedoui, Salma; Molnár, Gabor; Rivière, Eric; Boillot, Marie-Laure","Fe(Me2-bpy)2(NCSe)2spin-crossover micro- and nanoparticles showing spin-state switching above 250 K","New J. Chem.","2015","39","3","1603","","10.1039/C4NJ01257G","","x-ray","0.71069","MoKα","","0.0845","0.0464","","","0.1128","0.129","","","","","","1.038","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054497","12.3157","0.0012","19.6569","0.0019","22.945","0.002","90","","90","","90","","5554.7","0.9","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C27 H41 Au N P S2 -","- C27 H41 Au N P S2 -","- C216 H328 Au8 N8 P8 S16 -","8","1","","Altaf, Muhammad; Monim-ul-Mehboob, M.; Isab, Anvarhusein A.; Dhuna, Vikram; Bhatia, Gaurav; Dhuna, Kshitija; Altuwaijri, Saleh","The synthesis, spectroscopic characterization and anticancer activity of new mono and binuclear phosphanegold(i) dithiocarbamate complexes","New J. Chem.","2015","39","1","377","","10.1039/C4NJ00747F","","","0.71073","MoKα","","0.0541","0.0277","","","0.0587","0.0623","","","","","","0.793","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054498","28.3533","0.0011","28.3533","0.0011","15.9781","0.0007","90","","90","","120","","11124.1","0.8","115","","115","","","","","","","","","4","R -3","-R 3","148","","","","- C29.33 H26 N3 O6.17 -","- C29.3333 H25.1667 N3 O6.1667 -","- C528 H453.001 N54 O111.001 -","18","","","Haddad, Saoussen; Boudriga, Sarra; Akhaja, Tarunkumar Nanjibhai; Raval, Jignesh Priyakant; Porzio, François; Soldera, Armand; Askri, Moheddine; Knorr, Michael; Rousselin, Yoann; Kubicki, Marek M.; Rajani, Dhanji","A strategic approach to the synthesis of functionalized spirooxindole pyrrolidine derivatives: in vitro antibacterial, antifungal, antimalarial and antitubercular studies","New J. Chem.","2015","39","1","520","","10.1039/C4NJ01008F","","x-ray","0.71073","MoKα","","0.0445","0.0383","","","0.1005","0.1046","","","","","","1.036","","","","has coordinates,has disorder","180098","2020-10-21","18:00:00",""
"7054499","8.1001","0.0007","9.6437","0.0008","13.9228","0.0012","87.481","0.001","77.694","0.002","77.279","0.001","1036.5","0.15","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H19 F I3 N3 O3 -","- C17 H19 F I3 N3 O3 -","- C34 H38 F2 I6 N6 O6 -","2","1","","Zou, Wen-Sheng; Lin, Sen; Li, Jia-Yuan; Wei, Hong-Qing; Zhang, Xiao-Qin; Shen, Dong-Xu; Qiao, Jun-Qin; Lian, Hong-Zhen; Xie, Dai-Qian; Ge, Xin","Mechanism and application of halogen bond induced fluorescence enhancement and iodine molecule cleavage in solution","New J. Chem.","2015","39","1","262","","10.1039/C4NJ01396D","","","0.71073","MoKα","","0.0866","0.0559","","","0.1106","0.1159","","","","","","1.044","","","","has coordinates","180098","2020-10-21","18:00:00",""
"7054500","19.0809","0.0007","11.3904","0.0004","23.6108","0.0004","90","","107.42","0.002","90","","4896.2","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(isothiocyanato)-(N,N'-bis(3-methoxy-2-oxido-benzylidene)-1,6-diamino-4-azahexane)-iron(iii)","","- C24 H29 Fe N4 O4 S -","- C24 H29 Fe N4 O4 S -","- C192 H232 Fe8 N32 O32 S8 -","8","2","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","","0.71073","MoKα","","0.0478","0.0322","","","0.0699","0.0764","","","","","","1.029","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054501","19.165","0.003","11.6749","0.0016","22.449","0.003","90","","107.772","0.003","90","","4783.2","1.2","15","2","15","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(isothiocyanato)-(N,N'-bis(3-methoxy-2-oxido-benzylidene)-1,6-diamino-4-azahexane)-iron(iii)","","- C24 H29 Fe N4 O4 S -","- C24 H29 Fe N4 O4 S -","- C192 H232 Fe8 N32 O32 S8 -","8","2","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","","0.38745","Synchrotron","","0.0577","0.0352","","","0.0698","0.0781","","","","","","1.001","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054502","19.334","0.0007","11.456","0.0003","23.831","0.0009","90","","107.131","0.004","90","","5044.2","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(isothiocyanato)-(N,N'-bis(3-methoxy-2-oxido-benzylidene)-1,6-diamino-4-azahexane)-iron(iii)","","- C24 H29 Fe N4 O4 S -","- C24 H29 Fe N4 O4 S -","- C192 H232 Fe8 N32 O32 S8 -","8","2","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","","0.71073","MoKα","","0.1083","0.0571","","","0.0933","0.109","","","","","","1.046","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054503","7.5011","0.0006","13.0676","0.001","24.704","0.003","90","","90","","90","","2421.5","0.4","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(isothiocyanato)-(N,N'-bis((2-oxido-1-naphthyl)methylene)-1,6-diamino-4-azahexane)-iron(iii)","","- C28 H25 Fe N4 O2 S -","- C28 H25 Fe N4 O2 S -","- C112 H100 Fe4 N16 O8 S4 -","4","1","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","","0.71073","MoKα","","0.079","0.0498","","","0.0857","0.0919","","","","","","0.935","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054504","7.5422","0.0003","13.5725","0.0005","24.6626","0.0009","90","","90","","90","","2524.62","0.16","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(isothiocyanato)-(N,N'-bis((2-oxido-1-naphthyl)methylene)-1,6-diamino-4-azahexane)-iron(iii)","","- C28 H25 Fe N4 O2 S -","- C28 H25 Fe N4 O2 S -","- C112 H100 Fe4 N16 O8 S4 -","4","1","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","","0.71073","MoKα","","0.0498","0.033","","","0.0578","0.0606","","","","","","0.897","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054505","15.903","0.0005","14.218","0.0005","19.6342","0.0005","90","","90","","90","","4439.5","0.2","150","2","150","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","(isothiocyanato)-(N,N'-bis(5-nitro-2-oxido-benzylidene)-1,6-diamino-4-azahexane)-iron(iii)","","- C20 H19 Fe N6 O6 S -","- C20 H19 Fe N6 O6 S -","- C160 H152 Fe8 N48 O48 S8 -","8","1","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","","0.71073","MoKα","","0.0533","0.0383","","","0.091","0.0943","","","","","","1.052","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054506","11.0321","0.0009","11.3322","0.0009","18.9441","0.0015","90","","96.974","0.003","90","","2350.8","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(azido)-(N,N'-bis(3-ethoxy-2-oxido-benzylidene)-1,6-diamino-4-azahexane)-iron(iii)","","- C23 H29 Fe N6 O4 -","- C23 H29 Fe N6 O4 -","- C92 H116 Fe4 N24 O16 -","4","1","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","x-ray","0.71073","MoKα","","0.0281","0.0249","","","0.0656","0.0679","","","","","","1.061","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054507","18.2879","0.0007","11.8974","0.0004","17.3763","0.0007","90","","96.903","0.004","90","","3753.3","0.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(isothiocyanato)-(N,N'-bis(3,5-di(terc-buthyl)-2-oxido-benzylidene)-1,6-diamino-4-azahexane)-iron(iii)","","- C36 H53 Fe N4 O2 S -","- C36 H53 Fe N4 O2 S -","- C144 H212 Fe4 N16 O8 S4 -","4","1","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","","0.71073","MoKα","","0.0671","0.0393","","","0.0884","0.094","","","","","","0.889","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054508","11.5785","0.0006","11.6541","0.0005","18.2132","0.0008","90","","106.508","0.002","90","","2356.33","0.19","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(isothiocyanato)-(N,N'-bis(3-ethoxy-2-oxido-benzylidene)-1,5-diamino-4-azapentene)-iron(iii)","","- C23 H27 Fe N4 O4 S -","- C23 H27 Fe N4 O4 S -","- C92 H108 Fe4 N16 O16 S4 -","4","1","","Masárová, Petra; Zoufalý, Pavel; Moncol, Ján; Nemec, Ivan; Pavlik, Ján; Gembický, Milan; Trávníček, Zdeněk; Boča, Roman; Šalitroš, Ivan","Spin crossover and high spin electroneutral mononuclear iron(iii) Schiff base complexes involving terminal pseudohalido ligands","New J. Chem.","2015","39","1","508","","10.1039/C4NJ01363H","","x-ray","0.71073","MoKα","","0.0421","0.0318","","","0.0779","0.0834","","","","","","1.041","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054509","7.927","0.001","10.615","0.0011","12.92","0.002","78.84","0.01","74.08","0.02","70.62","0.01","979.9","0.2","295","3","295","3","","","","","","","","5","P -1","-P 1","2","","","","- C18 H21 Cl2 N5 Zn -","- C18 H21 Cl2 N5 Zn -","- C36 H42 Cl4 N10 Zn2 -","2","1","","Štefane, Bogdan; Perdih, Franc; Višnjevac, Aleksandar; Požgan, Franc","Novel triazole-based ligands and their zinc(ii) and nickel(ii) complexes with a nitrogen donor environment as potential structural models for mononuclear active sites","New J. Chem.","2015","39","1","566","","10.1039/C4NJ01642D","","","0.71073","MoKα","","0.1878","0.0989","","","","0.3482","","","","","","1.012","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054510","8.8955","0.0009","14.5691","0.0011","21.5718","0.0019","90","","91.451","0.008","90","","2794.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 Cl2 N6 Zn -","- C28 H26 Cl2 N6 Zn -","- C112 H104 Cl8 N24 Zn4 -","4","1","","Štefane, Bogdan; Perdih, Franc; Višnjevac, Aleksandar; Požgan, Franc","Novel triazole-based ligands and their zinc(ii) and nickel(ii) complexes with a nitrogen donor environment as potential structural models for mononuclear active sites","New J. Chem.","2015","39","1","566","","10.1039/C4NJ01642D","","","0.71073","MoKα","","0.1035","0.0595","","","0.1418","0.1641","","","","","","1.071","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054511","6.4217","0.0001","11.6331","0.0002","34.4621","0.0008","89.715","0.002","85.211","0.002","82.58","0.002","2543.95","0.08","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H29 Cl2 N5 Ni O2 -","- C24 H29 Cl2 N5 Ni O2 -","- C96 H116 Cl8 N20 Ni4 O8 -","4","2","","Štefane, Bogdan; Perdih, Franc; Višnjevac, Aleksandar; Požgan, Franc","Novel triazole-based ligands and their zinc(ii) and nickel(ii) complexes with a nitrogen donor environment as potential structural models for mononuclear active sites","New J. Chem.","2015","39","1","566","","10.1039/C4NJ01642D","","","0.71073","MoKα","","0.0399","0.0348","","","0.0764","0.0793","","","","","","1.11","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054512","26.919","0.005","8.723","0.0017","22.424","0.005","90","","107.99","0.03","90","","5008.1","1.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H23 Cu N3 O4 S -","- C27 H23 Cu N3 O4 S -","- C216 H184 Cu8 N24 O32 S8 -","8","1","","Li, Jun-Ling; Jiang, Lin; Wang, Bi-Wei; Tian, Jin-Lei; Gu, Wen; Liu, Xin; Yan, Shi-Ping","Significant differences in the biological activity of mononuclear Cu(ii) and Ni(ii) complexes with the polyquinolinyl ligand","New J. Chem.","2015","39","1","529","","10.1039/C4NJ00876F","","","0.71073","MoKα","","0.0869","0.0567","","","0.115","0.1274","","","","","","0.922","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054513","14.759","0.003","13.805","0.003","14.772","0.003","90","","96.14","0.03","90","","2992.5","1.1","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H33 N3 Ni O7 S -","- C29 H33 N3 Ni O7 S -","- C116 H132 N12 Ni4 O28 S4 -","4","1","","Li, Jun-Ling; Jiang, Lin; Wang, Bi-Wei; Tian, Jin-Lei; Gu, Wen; Liu, Xin; Yan, Shi-Ping","Significant differences in the biological activity of mononuclear Cu(ii) and Ni(ii) complexes with the polyquinolinyl ligand","New J. Chem.","2015","39","1","529","","10.1039/C4NJ00876F","","","0.71073","MoKα","","0.0496","0.0448","","","0.1036","0.1066","","","","","","1.039","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054514","15.6778","0.001","3.9598","0.0003","17.4076","0.0014","90","","108.928","0.008","90","","1022.24","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","m-MPCPA","","","- C11 H10 N2 O2 -","- C11 H10 N2 O2 -","- C44 H40 N8 O8 -","4","1","","Song, Qingbao; Wang, Yongsheng; Hu, Chenchen; Zhang, Yujian; Sun, Jingwei; Wang, Kunyan; Zhang, Cheng","Effect of stacking mode on the mechanofluorochromic properties of 3-aryl-2-cyano acrylamide derivatives","New J. Chem.","2015","39","1","659","","10.1039/C4NJ01492H","","","0.71073","MoKα","","0.0544","0.043","","","0.1079","0.1138","","","","","","1.169","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054515","13.7381","0.0009","8.877","0.0004","17.564","0.0009","90","","103.368","0.006","90","","2083.9","0.2","293","2","293","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","o-MPCPA","2-cyano-3-(2-methoxyphenyl)-2-propenamide","","- C11 H10 N2 O2 -","- C11 H10 N2 O2 -","- C88 H80 N16 O16 -","8","1","","Song, Qingbao; Wang, Yongsheng; Hu, Chenchen; Zhang, Yujian; Sun, Jingwei; Wang, Kunyan; Zhang, Cheng","Effect of stacking mode on the mechanofluorochromic properties of 3-aryl-2-cyano acrylamide derivatives","New J. Chem.","2015","39","1","659","","10.1039/C4NJ01492H","","","0.71073","MoKα","","0.0672","0.0448","","","0.1034","0.1153","","","","","","1.061","","","","has coordinates","204135","2020-10-21","18:00:00",""
"7054516","3.92","0.002","10.792","0.006","23.124","0.012","90","","93.463","0.008","90","","976.5","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","p-MPCPA","2-cyano-3-(4-methoxyphenyl)-2-propenamide","","- C11 H10 N2 O2 -","- C11 H10 N2 O2 -","- C44 H40 N8 O8 -","4","1","","Song, Qingbao; Wang, Yongsheng; Hu, Chenchen; Zhang, Yujian; Sun, Jingwei; Wang, Kunyan; Zhang, Cheng","Effect of stacking mode on the mechanofluorochromic properties of 3-aryl-2-cyano acrylamide derivatives","New J. Chem.","2015","39","1","659","","10.1039/C4NJ01492H","","","0.71073","MoKα","","0.1143","0.0824","","","0.2333","0.2367","","","","","","1.035","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054517","13.8001","0.001","14.107","0.0008","14.966","0.001","90","","93.4","0.005","90","","2908.4","0.3","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H28 N6 O Ti2 -","- C32 H28 N6 O Ti2 -","- C128 H112 N24 O4 Ti8 -","4","1","","Křižan, Martin; Honzíček, Jan; Vinklárek, Jaromír; Růžičková, Zdeňka; Erben, Milan","Titanocene(iii) pseudohalides: an ESR and structural study","New J. Chem.","2015","39","1","576","","10.1039/C4NJ01404A","","","0.71073","MoKα","","0.096","0.0549","","","0.0985","0.1177","","","","","","1.161","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054518","9.842","0.0005","19.9841","0.0014","15.283","0.0013","90","","99.947","0.007","90","","2960.7","0.4","150","1","150","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H36 N2 O3 S2 Ti2 -","- C30 H36 N2 O3 S2 Ti2 -","- C120 H144 N8 O12 S8 Ti8 -","4","1","","Křižan, Martin; Honzíček, Jan; Vinklárek, Jaromír; Růžičková, Zdeňka; Erben, Milan","Titanocene(iii) pseudohalides: an ESR and structural study","New J. Chem.","2015","39","1","576","","10.1039/C4NJ01404A","","","0.71073","MoKα","","0.0806","0.0496","","","0.0881","0.104","","","","","","1.172","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054519","14.5932","0.0012","14.925","0.0011","15.54","0.0008","74.368","0.007","83.551","0.007","61.471","0.006","2863.2","0.4","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C51 H78 N3 Si6 Ti3 -","- C51 H78 N3 Si6 Ti3 -","- C102 H156 N6 Si12 Ti6 -","2","1","","Křižan, Martin; Honzíček, Jan; Vinklárek, Jaromír; Růžičková, Zdeňka; Erben, Milan","Titanocene(iii) pseudohalides: an ESR and structural study","New J. Chem.","2015","39","1","576","","10.1039/C4NJ01404A","","","0.71073","MoKα","","0.0475","0.0324","","","0.0701","0.0815","","","","","","1.129","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054520","7.598","0.0004","11.523","0.0006","25.0561","0.0017","77.795","0.005","89.851","0.006","84.089","0.005","2132.3","0.2","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C36 H52 N6 Si4 Ti2 -","- C36 H52 N6 Si4 Ti2 -","- C72 H104 N12 Si8 Ti4 -","2","1","","Křižan, Martin; Honzíček, Jan; Vinklárek, Jaromír; Růžičková, Zdeňka; Erben, Milan","Titanocene(iii) pseudohalides: an ESR and structural study","New J. Chem.","2015","39","1","576","","10.1039/C4NJ01404A","","","0.71073","MoKα","","0.0956","0.0552","","","0.0973","0.115","","","","","","1.121","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054521","11.475","0.0006","11.6289","0.001","18.8461","0.0013","92.434","0.007","99.597","0.005","96.7","0.005","2457.8","0.3","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C47 H60 N6 Si4 Ti2 -","- C47 H60 N6 Si4 Ti2 -","- C94 H120 N12 Si8 Ti4 -","2","1","","Křižan, Martin; Honzíček, Jan; Vinklárek, Jaromír; Růžičková, Zdeňka; Erben, Milan","Titanocene(iii) pseudohalides: an ESR and structural study","New J. Chem.","2015","39","1","576","","10.1039/C4NJ01404A","","","0.71073","MoKα","","0.0702","0.045","","","0.091","0.1055","","","","","","1.11","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054522","8.828","0.0004","9.427","0.0008","12.2471","0.0014","71.689","0.006","78.624","0.006","89.462","0.005","947.09","0.15","150","1","150","1","","","","","","","","5","P -1","-P 1","2","","","","- C32 H52 Cl2 Si4 Ti2 -","- C32 H52 Cl2 Si4 Ti2 -","- C32 H52 Cl2 Si4 Ti2 -","1","0.5","","Křižan, Martin; Honzíček, Jan; Vinklárek, Jaromír; Růžičková, Zdeňka; Erben, Milan","Titanocene(iii) pseudohalides: an ESR and structural study","New J. Chem.","2015","39","1","576","","10.1039/C4NJ01404A","","","0.71073","MoKα","","0.0893","0.0677","","","0.1675","0.1924","","","","","","1.061","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054523","9.616","0.006","12.119","0.007","12.594","0.007","90.497","0.01","98.27","0.01","113.05","0.009","1333","1.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H30 N8 O11 V2 -","- C21 H30 N8 O11 V2 -","- C42 H60 N16 O22 V4 -","2","1","","Ma, Xi Tong; Xing, Na; Yan, Zhi Dan; Zhang, Xiao Xi; Wu, Qiong; Xing, Yong Heng","Peroxo- and oxovanadium(iv) complexes with tridentate N-heterocycle ligands: synthesis, structure, and catalytic performance","New J. Chem.","2015","39","2","1067","","10.1039/C4NJ01525H","","","0.71073","MoKα","","0.0644","0.0482","","","0.1295","0.1367","","","","","","1.078","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054524","9.9813","0.0013","12.3482","0.0015","13.298","0.0017","103.22","0.002","93.546","0.002","100.63","0.002","1558.9","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H32 N8 O12 S V -","- C23 H32 N8 O12 S V -","- C46 H64 N16 O24 S2 V2 -","2","1","","Ma, Xi Tong; Xing, Na; Yan, Zhi Dan; Zhang, Xiao Xi; Wu, Qiong; Xing, Yong Heng","Peroxo- and oxovanadium(iv) complexes with tridentate N-heterocycle ligands: synthesis, structure, and catalytic performance","New J. Chem.","2015","39","2","1067","","10.1039/C4NJ01525H","","","0.71073","MoKα","","0.074","0.0443","","","0.0998","0.1089","","","","","","0.986","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054525","21.563","0.004","21.563","0.004","24.14","0.008","90","","90","","120","","9720","4","296","2","296","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C22 H18 N3 O5.5 V -","- C22 H18 N3 O5.5 V -","- C396 H324 N54 O99 V18 -","18","1","","Ma, Xi Tong; Xing, Na; Yan, Zhi Dan; Zhang, Xiao Xi; Wu, Qiong; Xing, Yong Heng","Peroxo- and oxovanadium(iv) complexes with tridentate N-heterocycle ligands: synthesis, structure, and catalytic performance","New J. Chem.","2015","39","2","1067","","10.1039/C4NJ01525H","","","0.71073","MoKα","","0.0874","0.0632","","","0.172","0.2031","","","","","","1.043","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7054526","11.1223","0.0004","13.6579","0.0006","16.7386","0.0007","67.229","0.003","81.64","0.002","71.075","0.002","2217.22","0.17","293","2","293","2","","","","","","","synthesis as described","7","P -1","-P 1","2","[Pt(p-SC6F4CF3)(triphos)][OTf]","Platinum-triphos-SC7F7 Triflate","","- C42 H33 F10 O3 P3 Pt S2 -","- C42 H33 F10 O3 P3 Pt S2 -","- C84 H66 F20 O6 P6 Pt2 S4 -","2","1","","Cervantes, Ruy; Tiburcio, Jorge; Torrens, Hugo","cis and trans influences on [Pt(SRF)(triphos)]+complexes (SRF= polyfluorobenzothiolate)","New J. Chem.","2015","39","1","631","","10.1039/C4NJ01686F","","x-ray","0.71073","MoKα","","0.1128","0.0866","","","0.2318","0.2972","","","","","","1.335","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054527","10.2751","0.0003","19.9018","0.0007","19.3686","0.0008","90","","93.744","0.001","90","","3952.3","0.2","293","2","293","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","[Pt(SC6H5)(triphos)][OTf]","Platinum-triphos-SC6H5 Triflate","","- C41 H38 F3 O3 P3 Pt S2 -","- C41 H38 F3 O3 P3 Pt S2 -","- C164 H152 F12 O12 P12 Pt4 S8 -","4","1","","Cervantes, Ruy; Tiburcio, Jorge; Torrens, Hugo","cis and trans influences on [Pt(SRF)(triphos)]+complexes (SRF= polyfluorobenzothiolate)","New J. Chem.","2015","39","1","631","","10.1039/C4NJ01686F","","","0.71073","MoKα","","0.1106","0.066","","","0.1774","0.2267","","","","","","1.066","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054528","10.188","0.002","19.711","0.004","21.039","0.004","90","","96.02","0.03","90","","4201.7","1.4","293","2","293","2","","","","","","","synthesis as described","7","P 1 21/n 1","-P 2yn","14","[Pt(SC6F4H)(triphos)][OTf]","Platinum-triphos-SC6F4H Triflate","","- C41 H34 F7 O3 P3 Pt S2 -","- C41 H34 F7 O3 P3 Pt S2 -","- C164 H136 F28 O12 P12 Pt4 S8 -","4","1","","Cervantes, Ruy; Tiburcio, Jorge; Torrens, Hugo","cis and trans influences on [Pt(SRF)(triphos)]+complexes (SRF= polyfluorobenzothiolate)","New J. Chem.","2015","39","1","631","","10.1039/C4NJ01686F","","","0.71073","MoKα","","0.1537","0.0724","","","0.1729","0.2359","","","","","","1.037","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054529","8.0665","0.0008","8.3119","0.0008","13.9189","0.0014","90.693","0.003","104.018","0.003","118.084","0.003","790.11","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H8 N12 O8 -","- C9 H8 N12 O8 -","- C18 H16 N24 O16 -","2","1","","Wu, Bo; Wang, Zhixin; Yang, Hongwei; Lin, Qiuhan; Ju, Xuehai; Lu, Chunxu; Cheng, Guangbin","Synthesis and characterization of a new family of energetic salts based on a guanidinium cation containing a picryl moiety","New J. Chem.","2015","39","2","893","","10.1039/C4NJ01849D","","","0.71073","MoKα","","0.108","0.0451","","","0.0698","0.0795","","","","","","1.009","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054530","17.582","0.001","10.4936","0.0006","15.8405","0.001","90","","111.304","0.002","90","","2722.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N8 O9 -","- C8 H8 N8 O9 -","- C64 H64 N64 O72 -","8","2","","Wu, Bo; Wang, Zhixin; Yang, Hongwei; Lin, Qiuhan; Ju, Xuehai; Lu, Chunxu; Cheng, Guangbin","Synthesis and characterization of a new family of energetic salts based on a guanidinium cation containing a picryl moiety","New J. Chem.","2015","39","2","893","","10.1039/C4NJ01849D","","","0.71073","MoKα","","0.1073","0.0478","","","0.0932","0.1143","","","","","","1.016","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054531","20.6963","0.0008","4.89894","0.00019","16.9658","0.0007","90","","97.371","0.004","90","","1705.95","0.12","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H28 N2 O S -","- C16 H28 N2 O S -","- C64 H112 N8 O4 S4 -","4","1","","Yadav, Priyanka; Ballabh, Amar","Odd‒even effect in a thiazole based organogelator: understanding the interplay of non-covalent interactions on property and applications","New J. Chem.","2015","39","1","721","","10.1039/C4NJ01247J","","","0.71073","MoKα","","0.0541","0.0445","","","0.1231","0.1339","","","","","","1.067","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054532","23.237","0.002","4.9497","0.0003","15.6429","0.0012","90","","90.966","0.008","90","","1798.9","0.2","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H30 N2 O S -","- C17 H30 N2 O S -","- C68 H120 N8 O4 S4 -","4","1","","Yadav, Priyanka; Ballabh, Amar","Odd‒even effect in a thiazole based organogelator: understanding the interplay of non-covalent interactions on property and applications","New J. Chem.","2015","39","1","721","","10.1039/C4NJ01247J","","","1.54184","CuKα","","0.1948","0.1155","","","0.2385","0.2629","","","","","","1.135","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054533","22.1166","0.0002","19.4545","0.0002","9.42062","0.00013","90","","101.186","0.0013","90","","3976.38","0.08","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 N2 O S -","- C18 H32 N2 O S -","- C144 H256 N16 O8 S8 -","8","2","","Yadav, Priyanka; Ballabh, Amar","Odd‒even effect in a thiazole based organogelator: understanding the interplay of non-covalent interactions on property and applications","New J. Chem.","2015","39","1","721","","10.1039/C4NJ01247J","","","1.54184","CuKα","","0.0605","0.0493","","","0.1351","0.1468","","","","","","1.032","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054534","4.9139","0.0003","8.2041","0.0005","23.1603","0.001","84.043","0.004","87.033","0.004","78.743","0.005","910.3","0.09","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H30 N2 O S -","- C17 H30 N2 O S -","- C34 H60 N4 O2 S2 -","2","1","","Yadav, Priyanka; Ballabh, Amar","Odd‒even effect in a thiazole based organogelator: understanding the interplay of non-covalent interactions on property and applications","New J. Chem.","2015","39","1","721","","10.1039/C4NJ01247J","","","1.54184","CuKα","","0.0641","0.0549","","","0.1482","0.1599","","","","","","1.044","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054535","10.036","0.002","11.838","0.002","15.884","0.003","79.36","0.03","78.98","0.03","74.71","0.03","1768.7","0.6","12","","12","","","","","","","","","4","P 1","P 1","1","loxistatinic acid (E64c)","[(+)-(2S,3S)-3-(1-[N-(3-methylbutyl)amino]-leucylcarbonyl) oxirane-2-carboxylic acid]","","- C15 H26 N2 O5 -","- C15 H26 N2 O5 -","- C60 H104 N8 O20 -","4","4","","Shi, Ming W.; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Schmidt, Thomas C.; Luger, Peter; Mebs, Stefan; Dittrich, Birger; Chen, Yu-Sheng; Bąk, Joanna M.; Jayatilaka, Dylan; Bond, Charles S.; Turner, Michael J.; Stewart, Scott G.; Spackman, Mark A.; Grabowsky, Simon","Electrostatic complementarity in pseudoreceptor modeling based on drug molecule crystal structures: the case of loxistatin acid (E64c)","New J. Chem.","2015","39","3","1628","","10.1039/C4NJ01503G","","","0.3936","synchrotron","","0.1179","0.1099","","","0.2679","0.2735","","","","","","1.102","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054536","29.7753","0.0009","4.8973","0.0002","13.9889","0.0004","90","","103.74","0.001","90","","1981.47","0.12","293","2","293","2","","","","","","","Synthetic","4","C 1 2/c 1","-C 2yc","15","","N,N-Bis(3,4,5-trimethoxybenzylidene)hydrazine","","- C20 H24 N2 O6 -","- C20 H24 N2 O6 -","- C80 H96 N8 O24 -","4","0.5","","Parveen, Mehtab; Azaz, Shaista; Malla, Ali Mohammed; Ahmad, Faheem; Pereira da Silva, Pedro Sidonio; Ramos Silva, Manuela","Solvent-free, [Et3NH][HSO4] catalyzed facile synthesis of hydrazone derivatives","New J. Chem.","2015","39","1","469","","10.1039/C4NJ01666A","","","0.71073","MoKα","","0.0489","0.0396","","","0.1091","0.1214","","","","","","1.064","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054537","10.13","0.003","10.886","0.003","11.806","0.003","95.962","0.004","105.519","0.003","93.803","0.003","1241.6","0.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H8 Br N O9 Ru3 -","- C23 H8 Br N O9 Ru3 -","- C46 H16 Br2 N2 O18 Ru6 -","2","1","","Ma, Zhihong; Fan, Dong; Li, Suzhen; Han, Zhangang; Li, Xiaoyan; Zheng, Xuezhong; Lin, Jin","Reactivity of a trinuclear ruthenium complex involving C‒H activation and insertion of alkene","New J. Chem.","2015","39","2","1075","","10.1039/C4NJ01382D","","","0.71073","MoKα","","0.0446","0.0368","","","0.0932","0.0967","","","","","","0.986","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054538","24.724","0.008","10.628","0.004","23.593","0.008","90","","115.263","0.004","90","","5607","3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H17 Br N2 O4 Ru2 -","- C32 H17 Br N2 O4 Ru2 -","- C256 H136 Br8 N16 O32 Ru16 -","8","1","","Ma, Zhihong; Fan, Dong; Li, Suzhen; Han, Zhangang; Li, Xiaoyan; Zheng, Xuezhong; Lin, Jin","Reactivity of a trinuclear ruthenium complex involving C‒H activation and insertion of alkene","New J. Chem.","2015","39","2","1075","","10.1039/C4NJ01382D","","","0.71073","MoKα","","0.058","0.0417","","","0.1015","0.1106","","","","","","0.992","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054539","23.277","0.016","6.251","0.004","14.611","0.011","90","","92.423","0.012","90","","2124","3","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H16 Br2 N2 -","- C28 H16 Br2 N2 -","- C112 H64 Br8 N8 -","4","0.5","","Ma, Zhihong; Fan, Dong; Li, Suzhen; Han, Zhangang; Li, Xiaoyan; Zheng, Xuezhong; Lin, Jin","Reactivity of a trinuclear ruthenium complex involving C‒H activation and insertion of alkene","New J. Chem.","2015","39","2","1075","","10.1039/C4NJ01382D","","","0.71073","MoKα","","0.0811","0.0403","","","0.0561","0.061","","","","","","0.969","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054540","7.181","0.0006","9.6498","0.0008","16.7441","0.0015","95.889","0.001","98.26","0.001","104.031","0.002","1102.52","0.16","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H8 Br N O7 Ru3 -","- C21 H8 Br N O7 Ru3 -","- C42 H16 Br2 N2 O14 Ru6 -","2","1","","Ma, Zhihong; Fan, Dong; Li, Suzhen; Han, Zhangang; Li, Xiaoyan; Zheng, Xuezhong; Lin, Jin","Reactivity of a trinuclear ruthenium complex involving C‒H activation and insertion of alkene","New J. Chem.","2015","39","2","1075","","10.1039/C4NJ01382D","","","0.71073","MoKα","","0.0572","0.0356","","","0.0757","0.0871","","","","","","1.046","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054541","9.241","0.006","13.168","0.009","8.138","0.006","90","","112.245","0.009","90","","916.6","1.1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H14 O4 Ru2 -","- C22 H14 O4 Ru2 -","- C44 H28 O8 Ru4 -","2","0.5","","Ma, Zhihong; Fan, Dong; Li, Suzhen; Han, Zhangang; Li, Xiaoyan; Zheng, Xuezhong; Lin, Jin","Reactivity of a trinuclear ruthenium complex involving C‒H activation and insertion of alkene","New J. Chem.","2015","39","2","1075","","10.1039/C4NJ01382D","","","0.71073","MoKα","","0.0342","0.0327","","","0.0842","0.0855","","","","","","1.175","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054542","13.5255","0.0013","12.8602","0.0009","15.6149","0.0014","90","","114.691","0.002","90","","2467.7","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H16 Br N O5 Ru2 -","- C27 H16 Br N O5 Ru2 -","- C108 H64 Br4 N4 O20 Ru8 -","4","1","","Ma, Zhihong; Fan, Dong; Li, Suzhen; Han, Zhangang; Li, Xiaoyan; Zheng, Xuezhong; Lin, Jin","Reactivity of a trinuclear ruthenium complex involving C‒H activation and insertion of alkene","New J. Chem.","2015","39","2","1075","","10.1039/C4NJ01382D","","","0.71073","MoKα","","0.0687","0.0443","","","0.1113","0.128","","","","","","1.035","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054543","46.333","0.003","17.299","0.001","32.343","0.002","90","","123.542","0.001","90","","21607","2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C69 H59.33 Eu2 N12 O11.67 -","- C69 H51 Eu2 N12 O11.6667 -","- C828 H612 Eu24 N144 O140 -","12","1.5","","Das, Kuheli; Nandi, Soumendra; Mondal, Sudipa; Askun, Tulin; Cantürk, Zerrin; Celikboyun, Pinar; Massera, Chiara; Garribba, Eugenio; Datta, Amitabha; Sinha, Chittaranjan; Akitsu, Takashiro","Triply phenoxo bridged Eu(iii) and Sm(iii) complexes with 2,6-diformyl-4-methylphenol-di(benzoylhydrazone): structure, spectra and biological study in human cell lines","New J. Chem.","2015","39","2","1101","","10.1039/C4NJ01464B","","","0.71069","MoKα","","0.0977","0.0525","","","0.1378","0.1633","","","","","","1.019","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054544","12.6452","0.0006","15.0817","0.0007","20.7038","0.0009","101.662","0.001","97.13","0.001","106.03","0.001","3648","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H104 Li N8 Nd O3 -","- C80 H104 Li N8 Nd O3 -","- C160 H208 Li2 N16 Nd2 O6 -","2","1","","Yakovenko, Marina V.; Udilova, Natalia Yu.; Glukhova, Tatyana A.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Amido rare-earth complexes supported by an ansa bis(amidinate) ligand with a rigid 1,8-naphthalene linker: synthesis, structures and catalytic activity in rac-lactide polymerization and hydrophosphonylation of carbonyl compounds","New J. Chem.","2015","39","2","1083","","10.1039/C4NJ01698J","","","0.71073","MoKα","","0.0507","0.0405","","","0.1023","0.1071","","","","","","1.057","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054545","23.9499","0.0016","19.4258","0.0013","21.8709","0.0014","90","","116.878","0.001","90","","9076.1","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H68 N5 Nd O Si2 -","- C46 H68 N5 Nd O Si2 -","- C368 H544 N40 Nd8 O8 Si16 -","8","2","","Yakovenko, Marina V.; Udilova, Natalia Yu.; Glukhova, Tatyana A.; Cherkasov, Anton V.; Fukin, Georgy K.; Trifonov, Alexander A.","Amido rare-earth complexes supported by an ansa bis(amidinate) ligand with a rigid 1,8-naphthalene linker: synthesis, structures and catalytic activity in rac-lactide polymerization and hydrophosphonylation of carbonyl compounds","New J. Chem.","2015","39","2","1083","","10.1039/C4NJ01698J","","","0.71073","MoKα","","0.0858","0.077","","","0.1598","0.1628","","","","","","1.154","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054546","13.0391","0.0005","6.8246","0.0003","15.9891","0.001","90","","92.828","0.005","90","","1421.08","0.12","173","2","173","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C26 H28 Br2 F8 N4 -","- C26 H28 Br2 F8 N4 -","- C52 H56 Br4 F16 N8 -","2","0.5","","Yi, Hai; Albrecht, Markus; Valkonen, Arto; Rissanen, Kari","Perfluoro-1,1′-biphenyl and perfluoronaphthalene and their derivatives as π-acceptors for anions","New J. Chem.","2015","39","1","746","","10.1039/C4NJ01654H","","","0.71073","MoKα","","0.0461","0.0382","","","0.0967","0.1038","","","","","","1.052","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054547","13.647","0.0003","12.4533","0.0002","22.0643","0.0004","90","","90","","90","","3749.83","0.12","123","2","123","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H18 Br F7 N2 O -","- C18 H18 Br F7 N2 O -","- C144 H144 Br8 F56 N16 O8 -","8","1","","Yi, Hai; Albrecht, Markus; Valkonen, Arto; Rissanen, Kari","Perfluoro-1,1′-biphenyl and perfluoronaphthalene and their derivatives as π-acceptors for anions","New J. Chem.","2015","39","1","746","","10.1039/C4NJ01654H","","","0.71073","MoKα","","0.0745","0.047","","","0.109","0.1189","","","","","","1.037","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054548","7.32285","0.00013","13.0124","0.0002","26.9145","0.0005","90","","90","","90","","2564.62","0.08","130","2","130","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N3-{[(o-carboran-1-yl)propyl]-1N-1,2,3-triazol-4-yl}methylenethymidine","","- C18 H33 B10 N5 O5 -","- C18 H33 B10 N5 O5 -","- C72 H132 B40 N20 O20 -","4","1","","Matuszewski, Michał; Kiliszek, Agnieszka; Rypniewski, Wojciech; Lesnikowski, Zbigniew J.; Olejniczak, Agnieszka B.","Nucleoside bearing boron clusters and their phosphoramidites ‒ building blocks for modified oligonucleotide synthesis","New J. Chem.","2015","39","2","1202","","10.1039/C4NJ01096E","","","1.54184","CuKα","","0.039","0.0351","","","0.0933","0.0946","","","","","","1.048","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7054549","12.6104","0.0002","10.35013","0.00019","37.1231","0.0008","90","","90","","90","","4845.28","0.16","100.01","0.1","100.01","0.1","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H16.86 Fe2 N12 O8.43 S5 -","- C4 H16 Fe2 N12 O8.43 S5 -","- C32 H128 Fe16 N96 O67.44 S40 -","8","1","","Sanina, Nataliya A.; Aldoshin, Sergey M.; Shmatko, Natal'ya Yu.; Korchagin, Denis V.; Shilov, Gennadii V.; Knyazkina, Ekaterine V.; Ovanesyan, Nikolay S.; Kulikov, Alexander V.","Nitrosyl iron complexes with enhanced NO donating ability: synthesis, structure and properties of a new type of salt with the DNIC cations [Fe(SC(NH2)2)2(NO)2]+","New J. Chem.","2015","39","2","1022","","10.1039/C4NJ01693A","","","0.7107","MoKα","","0.0725","0.0583","","","0.0908","0.0945","","","","","","1.245","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054550","6.2712","0.0003","10.4132","0.0005","12.1912","0.0005","86.462","0.004","88.363","0.004","87.613","0.004","793.65","0.06","99.9","0.2","99.9","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H16 Fe4 N16 O14 S8 -","- C4 H16 Fe4 N16 O14 S8 -","- C4 H16 Fe4 N16 O14 S8 -","1","0.5","","Sanina, Nataliya A.; Aldoshin, Sergey M.; Shmatko, Natal'ya Yu.; Korchagin, Denis V.; Shilov, Gennadii V.; Knyazkina, Ekaterine V.; Ovanesyan, Nikolay S.; Kulikov, Alexander V.","Nitrosyl iron complexes with enhanced NO donating ability: synthesis, structure and properties of a new type of salt with the DNIC cations [Fe(SC(NH2)2)2(NO)2]+","New J. Chem.","2015","39","2","1022","","10.1039/C4NJ01693A","","","0.71073","MoKα","","0.0622","0.0415","","","0.0787","0.0915","","","","","","1.048","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054551","9.4934","0.0003","13.2045","0.0004","14.699","0.0005","76.486","0.002","85.811","0.002","83.394","0.002","1777.66","0.1","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","Bis[aquatri(dimethylaminoethanolato)yttrium dicopper(II) triacetate] toluene sovate","","- C13.4 H24.5 Cl0 Cu N1.5 O5.92 Y0.5 -","- C13.4 H24.5 Cu N1.5 O5.922 Y0.5 -","- C53.6 H98 Cu4 N6 O23.688 Y2 -","4","2","","Ahmed, Sohail; Mansoor, Muhammad Adil; Basirun, Wan Jefrey; Sookhakian, Mehran; Huang, Nay Ming; Mun, Lo Kong; Söhnel, Tilo; Arifin, Zainudin; Mazhar, Muhammad","The synthesis and characterization of a hexanuclear copper‒yttrium complex for deposition of semiconducting CuYO2‒0.5Cu2O composite thin films","New J. Chem.","2015","39","2","1031","","10.1039/C4NJ01602E","","","0.71073","MoKα","","0.0391","0.0296","","","0.0762","0.0808","","","","","","1.034","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054552","15.368","0.01","8.37","0.006","13.71","0.009","90","","101.697","0.012","90","","1727","2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 Cu4 N10 -","- C12 H12 Cu4 N10 -","- C48 H48 Cu16 N40 -","4","1","","Xu, Hui; Zhou, Bo-Yu; Yu, Kai; Su, Zhan-Hua; Zhao, Zhi-Feng; Sun, Wen-Long; Zhou, Bai-Bin","Two novel topological structures of [Cu(CN)] coordination polymers modified by flexible triazole ligands","New J. Chem.","2015","39","2","1301","","10.1039/C4NJ01499E","","","0.71073","MoKα","","0.1241","0.0499","","","0.1123","0.1397","","","","","","1.01","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054553","15.836","0.005","24.736","0.007","7.948","0.002","90","","90","","90","","3113.4","1.5","296","2","296","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C6 H8 Cu N4 -","- C6 H8 Cu N4 -","- C96 H128 Cu16 N64 -","16","1","","Xu, Hui; Zhou, Bo-Yu; Yu, Kai; Su, Zhan-Hua; Zhao, Zhi-Feng; Sun, Wen-Long; Zhou, Bai-Bin","Two novel topological structures of [Cu(CN)] coordination polymers modified by flexible triazole ligands","New J. Chem.","2015","39","2","1301","","10.1039/C4NJ01499E","","","0.71073","MoKα","","0.024","0.0235","","","0.0608","0.0611","","","","","","1.048","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054554","33.1","0.008","11.236","0.002","8.061","0.002","90","","97.58","0.03","90","","2971.8","1.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 Cl O4 P -","- C12 H18 Cl O4 P -","- C96 H144 Cl8 O32 P8 -","8","1","","Dar, Aijaz A.; Mallick, Abhijit; Murugavel, Ramaswamy","Synthetic strategies to achieve further-functionalised monoaryl phosphate primary building units: crystal structures and solid-state aggregation behavior","New J. Chem.","2015","39","2","1186","","10.1039/C4NJ01614A","","","0.71073","MoKα","","0.1173","0.0858","","","0.2375","0.2521","","","","","","1.082","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054555","33.434","0.014","11.241","0.005","7.946","0.003","90","","97.374","0.005","90","","2962","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 Br O4 P -","- C12 H18 Br O4 P -","- C96 H144 Br8 O32 P8 -","8","1","","Dar, Aijaz A.; Mallick, Abhijit; Murugavel, Ramaswamy","Synthetic strategies to achieve further-functionalised monoaryl phosphate primary building units: crystal structures and solid-state aggregation behavior","New J. Chem.","2015","39","2","1186","","10.1039/C4NJ01614A","","","0.71075","MoKα","","0.0375","0.036","","","0.0922","0.0935","","","","","","1.074","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054556","34.091","0.018","11.245","0.006","8.001","0.004","90","","97.511","0.011","90","","3041","3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 I O4 P -","- C12 H18 I O4 P -","- C96 H144 I8 O32 P8 -","8","1","","Dar, Aijaz A.; Mallick, Abhijit; Murugavel, Ramaswamy","Synthetic strategies to achieve further-functionalised monoaryl phosphate primary building units: crystal structures and solid-state aggregation behavior","New J. Chem.","2015","39","2","1186","","10.1039/C4NJ01614A","","","0.71075","MoKα","","0.0804","0.0671","","","0.2019","0.2136","","","","","","1.077","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054557","33.71","0.016","6.824","0.003","17.253","0.008","90","","90.834","0.008","90","","3968","3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H27 O4 P -","- C20 H27 O4 P -","- C160 H216 O32 P8 -","8","1","","Dar, Aijaz A.; Mallick, Abhijit; Murugavel, Ramaswamy","Synthetic strategies to achieve further-functionalised monoaryl phosphate primary building units: crystal structures and solid-state aggregation behavior","New J. Chem.","2015","39","2","1186","","10.1039/C4NJ01614A","","","0.71075","MoKα","","0.07","0.0667","","","0.1676","0.1702","","","","","","1.143","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054558","13.664","0.009","10.956","0.006","23.642","0.014","90","","98.563","0.012","90","","3500","4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H48 N O4 P -","- C39 H48 N O4 P -","- C156 H192 N4 O16 P4 -","4","1","","Dar, Aijaz A.; Mallick, Abhijit; Murugavel, Ramaswamy","Synthetic strategies to achieve further-functionalised monoaryl phosphate primary building units: crystal structures and solid-state aggregation behavior","New J. Chem.","2015","39","2","1186","","10.1039/C4NJ01614A","","","0.71075","MoKα","","0.1581","0.1244","","","0.2379","0.2577","","","","","","1.211","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054559","6.69","0.002","9.064","0.003","17.502","0.005","79.175","0.012","89.61","0.012","82.167","0.012","1032.5","0.5","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H27 O5 P -","- C21 H27 O5 P -","- C42 H54 O10 P2 -","2","1","","Dar, Aijaz A.; Mallick, Abhijit; Murugavel, Ramaswamy","Synthetic strategies to achieve further-functionalised monoaryl phosphate primary building units: crystal structures and solid-state aggregation behavior","New J. Chem.","2015","39","2","1186","","10.1039/C4NJ01614A","","","0.71075","MoKα","","0.0421","0.0398","","","0.0997","0.1014","","","","","","1.078","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054560","41.181","0.013","11.01","0.003","8.186","0.003","90","","92.162","0.006","90","","3709","2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H23 O5 P -","- C19 H23 O5 P -","- C152 H184 O40 P8 -","8","1","","Dar, Aijaz A.; Mallick, Abhijit; Murugavel, Ramaswamy","Synthetic strategies to achieve further-functionalised monoaryl phosphate primary building units: crystal structures and solid-state aggregation behavior","New J. Chem.","2015","39","2","1186","","10.1039/C4NJ01614A","","","0.71075","MoKα","","0.0487","0.0466","","","0.1099","0.1113","","","","","","1.077","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054561","26.008","0.003","6.836","0.0008","22.709","0.003","90","","123.384","0.002","90","","3371.3","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H6.5 N5 O1.75 -","- C8 H6.5 N5 O1.75 -","- C128 H104 N80 O28 -","16","2","","Chen, Wen-Bin; Li, Zhi-Xin; Yu, Xin-Wei; Yang, Meng; Qiu, Yan-Xuan; Dong, Wen","M2+and Ln3±catalyzed synthesis of a [1,2,4]triazine core via intramolecular C‒H/N‒H functionalization and C‒N bond formation (M = Mn, Zn, Cd; Ln = Dy, Tb)","New J. Chem.","2015","39","2","1222","","10.1039/C4NJ01027B","","","0.71073","MoKα","","0.066","0.0432","","","0.1266","0.1531","","","","","","1.176","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7054562","19.315","0.004","8.088","0.0016","11.97","0.002","90","","94.203","0.009","90","","1864.9","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H16 Mn N10 O6 -","- C16 H16 Mn N10 O6 -","- C64 H64 Mn4 N40 O24 -","4","0.5","","Chen, Wen-Bin; Li, Zhi-Xin; Yu, Xin-Wei; Yang, Meng; Qiu, Yan-Xuan; Dong, Wen","M2+and Ln3±catalyzed synthesis of a [1,2,4]triazine core via intramolecular C‒H/N‒H functionalization and C‒N bond formation (M = Mn, Zn, Cd; Ln = Dy, Tb)","New J. Chem.","2015","39","2","1222","","10.1039/C4NJ01027B","","","0.71073","MoKα","","0.0345","0.028","","","0.0641","0.067","","","","","","0.985","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054563","19.02","0.003","8.0801","0.0012","11.953","0.0017","90","","94.235","0.008","90","","1832","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H16 N10 O6 Zn -","- C16 H16 N10 O6 Zn -","- C64 H64 N40 O24 Zn4 -","4","0.5","","Chen, Wen-Bin; Li, Zhi-Xin; Yu, Xin-Wei; Yang, Meng; Qiu, Yan-Xuan; Dong, Wen","M2+and Ln3±catalyzed synthesis of a [1,2,4]triazine core via intramolecular C‒H/N‒H functionalization and C‒N bond formation (M = Mn, Zn, Cd; Ln = Dy, Tb)","New J. Chem.","2015","39","2","1222","","10.1039/C4NJ01027B","","","0.71073","MoKα","","0.0281","0.0251","","","0.0639","0.0653","","","","","","1.068","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054564","19.4542","0.0007","8.1626","0.0003","12.0696","0.0005","90","","94.203","0.002","90","","1911.46","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H16 Cd N10 O6 -","- C16 H16 Cd N10 O6 -","- C64 H64 Cd4 N40 O24 -","4","0.5","","Chen, Wen-Bin; Li, Zhi-Xin; Yu, Xin-Wei; Yang, Meng; Qiu, Yan-Xuan; Dong, Wen","M2+and Ln3±catalyzed synthesis of a [1,2,4]triazine core via intramolecular C‒H/N‒H functionalization and C‒N bond formation (M = Mn, Zn, Cd; Ln = Dy, Tb)","New J. Chem.","2015","39","2","1222","","10.1039/C4NJ01027B","","","0.71073","MoKα","","0.021","0.0202","","","0.0671","0.0676","","","","","","1.121","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054565","6.8792","0.0011","20.841","0.003","13.359","0.003","90","","103.471","0.012","90","","1862.6","0.6","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H8 N5 O1.5 -","- C9 H8 N5 O1.5 -","- C72 H64 N40 O12 -","8","2","","Chen, Wen-Bin; Li, Zhi-Xin; Yu, Xin-Wei; Yang, Meng; Qiu, Yan-Xuan; Dong, Wen","M2+and Ln3±catalyzed synthesis of a [1,2,4]triazine core via intramolecular C‒H/N‒H functionalization and C‒N bond formation (M = Mn, Zn, Cd; Ln = Dy, Tb)","New J. Chem.","2015","39","2","1222","","10.1039/C4NJ01027B","","","0.71073","MoKα","","0.1283","0.0549","","","0.1391","0.1746","","","","","","0.959","","","","has coordinates","182221","2020-10-21","18:00:00",""
"7054566","13.3142","0.0003","15.6092","0.0003","14.3394","0.0004","90","","98.779","0.001","90","","2945.16","0.12","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 Br Cl2 Cu N6 -","- C30 H32 Br Cl2 Cu N6 -","- C120 H128 Br4 Cl8 Cu4 N24 -","4","1","","Chou, Chang-Chuan; Liu, Hsueh-Ju; Chao, Lucas Hung-Chieh; Yang, Chia-Chi","Halide-modulated bistate and tristate fluorescence switching for Cu(i) and Ag(i) complexes","New J. Chem.","2015","39","2","1260","","10.1039/C4NJ01639D","","","0.71073","MoKα","","0.0859","0.061","","","0.1627","0.1863","","","","","","1.086","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054567","25.9994","0.0017","15.1102","0.001","17.1561","0.0011","90","","107.436","0.003","90","","6430.2","0.7","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 Cl4 Cu2 N6 -","- C30 H32 Cl4 Cu2 N6 -","- C240 H256 Cl32 Cu16 N48 -","8","2","","Chou, Chang-Chuan; Liu, Hsueh-Ju; Chao, Lucas Hung-Chieh; Yang, Chia-Chi","Halide-modulated bistate and tristate fluorescence switching for Cu(i) and Ag(i) complexes","New J. Chem.","2015","39","2","1260","","10.1039/C4NJ01639D","","","0.71073","MoKα","","0.1598","0.092","","","0.2418","0.2887","","","","","","1.02","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054568","10.2448","0.0009","12.581","0.0011","13.3336","0.0011","71.022","0.002","86.393","0.002","66.479","0.002","1485.7","0.2","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H30 Ag Cl N6 O4 -","- C29 H30 Ag Cl N6 O4 -","- C58 H60 Ag2 Cl2 N12 O8 -","2","1","","Chou, Chang-Chuan; Liu, Hsueh-Ju; Chao, Lucas Hung-Chieh; Yang, Chia-Chi","Halide-modulated bistate and tristate fluorescence switching for Cu(i) and Ag(i) complexes","New J. Chem.","2015","39","2","1260","","10.1039/C4NJ01639D","","","0.71073","MoKα","","0.0639","0.0474","","","0.1193","0.126","","","","","","1.031","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054569","13.3203","0.0003","25.2381","0.0007","15.0807","0.0003","90","","109.346","0.001","90","","4783.5","0.2","296","2","296","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C43 H53 B Co F4 N6 O6 P2 S2 -","- C43 H35 B Co F4 N6 O6 P2 S2 -","- C172 H140 B4 Co4 F16 N24 O24 P8 S8 -","4","1","","Jing, Xu; Wu, Pengyan; Liu, Xin; Yang, Linlin; He, Cheng; Duan, Chunying","Light-driven hydrogen evolution with a nickel thiosemicarbazone redox catalyst featuring Ni⋯H interactions under basic conditions","New J. Chem.","2015","39","2","1051","","10.1039/C4NJ01540A","","","0.71073","MoKα","","0.1008","0.0608","","","0.1621","0.1812","","","","","","1.036","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054570","9.43","0.0008","12.8553","0.001","21.7668","0.0018","93.409","0.006","91.482","0.006","111.218","0.005","2452.3","0.4","296","2","296","2","","","","","","","","9","P -1","-P 1","2","","","","- C42 H47 B F4 N6 Ni O5 P2 S2 -","- C42 H47 B F4 N6 Ni O5 P2 S2 -","- C84 H94 B2 F8 N12 Ni2 O10 P4 S4 -","2","1","","Jing, Xu; Wu, Pengyan; Liu, Xin; Yang, Linlin; He, Cheng; Duan, Chunying","Light-driven hydrogen evolution with a nickel thiosemicarbazone redox catalyst featuring Ni⋯H interactions under basic conditions","New J. Chem.","2015","39","2","1051","","10.1039/C4NJ01540A","","","0.71073","MoKα","","0.0932","0.0675","","","0.1964","0.2148","","","","","","1.063","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054571","4.919","0.002","7.285","0.001","18.574","0.002","84.19","0.01","86.42","0.01","84.08","0.02","657.7","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H34 O4 S4 -","- C24 H34 O4 S4 -","- C24 H34 O4 S4 -","1","0.5","","Turbiez, Mathieu; Faye, Djibril; Leriche, Philippe; Frère, Pierre","Bis-EDOT end capped by n-hexyl or n-hexylsulfanyl groups: the effect of the substituents on the stability of the oxidized states","New J. Chem.","2015","39","3","1678","","10.1039/C4NJ01684J","","x-ray","0.71073","MoKα","","0.0838","0.0571","","","0.1577","0.1763","","","","","","1.032","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054572","10.1585","0.0004","10.1585","0.0004","19.0174","0.0005","90","","90","","90","","1962.5","0.12","100","1","100","1","","","","","","","","5","P 43","P 4cw","78","","","","- C19 H27 F N2 O4 -","- C19 H27 F N2 O4 -","- C76 H108 F4 N8 O16 -","4","1","","Hassoun, Ammar; Grison, Claire M.; Guillot, Régis; Boddaert, Thomas; Aitken, David J.","Conformational preferences in the β-peptide oligomers of cis-2-amino-1-fluorocyclobutane-1-carboxylic acid","New J. Chem.","2015","39","5","3270","","10.1039/C4NJ01929F","","x-ray","0.71073","MoKα","","0.0348","0.0321","","","0.0833","0.0851","","","","","","1.028","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054573","5.35","0.0009","20.2","0.003","29.927","0.004","90","","90","","90","","3234.2","0.8","100","1","100","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H40 F4 N4 O7 -","- C32 H40 F4 N4 O7 -","- C128 H160 F16 N16 O28 -","4","1","","Hassoun, Ammar; Grison, Claire M.; Guillot, Régis; Boddaert, Thomas; Aitken, David J.","Conformational preferences in the β-peptide oligomers of cis-2-amino-1-fluorocyclobutane-1-carboxylic acid","New J. Chem.","2015","39","5","3270","","10.1039/C4NJ01929F","","x-ray","0.71069","MoKα","","0.1212","0.0682","","","0.1483","0.1709","","","","","","1.031","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054574","12.4021","0.0012","12.3286","0.0012","13.1324","0.0013","90","","105.544","0.001","90","","1934.5","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H15 Cu N7 O8 -","- C17 H15 Cu N7 O8 -","- C68 H60 Cu4 N28 O32 -","4","1","","Ma, Lu-Fang; Shi, Zhen-Zhen; Li, Fei-Fei; Zhang, Jian; Wang, Li-Ya","Coordination polymers with free Brønsted acid sites for selective catalysis","New J. Chem.","2015","39","2","810","","10.1039/C4NJ01898B","","","0.71073","MoKα","","0.036","0.0288","","","0.0772","0.083","","","","","","1.001","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054575","10.272","0.003","15.184","0.004","16.2","0.004","100.009","0.003","99.61","0.003","108.045","0.003","2299.2","1.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H34 Cu2 N14 O18 -","- C42 H34 Cu2 N14 O18 -","- C84 H68 Cu4 N28 O36 -","2","1","","Ma, Lu-Fang; Shi, Zhen-Zhen; Li, Fei-Fei; Zhang, Jian; Wang, Li-Ya","Coordination polymers with free Brønsted acid sites for selective catalysis","New J. Chem.","2015","39","2","810","","10.1039/C4NJ01898B","","","0.71073","MoKα","","0.0942","0.0546","","","0.1336","0.1587","","","","","","1.011","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054576","13.0584","0.0003","17.2823","0.0003","17.4795","0.0004","90","","94.228","0.002","90","","3934.02","0.15","190","","190","","","","101","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H36 N4 O12 S4 -","- C36 H36 N4 O12 S4 -","- C144 H144 N16 O48 S16 -","4","1","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","","1.5418","CuKα","","0.0619","0.0493","","0.1598","0.1378","0.1598","","","","","","0.9865","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054577","11.0672","0.0008","12.3077","0.0011","18.3099","0.0011","101.125","0.007","95.076","0.006","102.421","0.007","2367.8","0.3","170","","170","","","","101","","","","","5","P -1","-P 1","2","","","","- C44 H52 N4 O12 S4 -","- C44 H52 N4 O12 S4 -","- C88 H104 N8 O24 S8 -","2","1","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","","1.5418","CuKα","","0.0745","0.0613","","0.213","0.1779","0.196","","","","","","0.921","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054578","13.2452","0.00012","13.2452","0.00012","14.9787","0.0002","90","","90","","90","","2627.79","0.05","170","","170","","","","101","","","","","5","P 42/n :2","-P 4bc","86","","","","- C48 H58 N6 O12 S4 -","- C48 H58 N6 O12 S4 -","- C96 H116 N12 O24 S8 -","2","0.25","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","","1.5418","CuKα","","0.0851","0.08","","0.2601","0.2505","0.2601","","","","","","1.065","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054579","12.73537","0.00012","12.73537","0.00012","28.8831","0.0003","90","","90","","90","","4684.54","0.08","190","","190","","","","101","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C52 H36 N4 O12 S4 -","- C52 H36 N4 O12 S4 -","- C208 H144 N16 O48 S16 -","4","0.5","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","","1.5418","CuKα","","0.0464","0.0437","","0.1148","0.1044","0.1148","","","","","","1.0794","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054580","27.261","0.0014","16.3468","0.0003","17.9466","0.0009","90","","139.366","0.01","90","","5208.2","1.1","180","","180","","","","101","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H60 N4 O12 S4 -","- C48 H60 N4 O12 S4 -","- C192 H240 N16 O48 S16 -","4","1","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","","1.54184","CuKα","","0.0766","0.0588","","0.131","0.1079","0.1309","","","","","","1.0005","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054581","11.2845","0.0012","18.1827","0.0017","18.8706","0.0019","90","","105.953","0.01","90","","3722.8","0.7","180","","180","","","","101","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H20 N4 O12 S4 -","- C36 H20 N4 O12 S4 -","- C144 H80 N16 O48 S16 -","4","0.5","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","","1.54184","CuKα","","0.1203","0.1094","","0.218","0.2151","0.218","","","","","","0.9798","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054582","12.64786","0.00019","14.04823","0.00019","13.3958","0.0002","90","","101.233","0.0015","90","","2334.57","0.06","190","","190","","","","101","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H52 N4 O12 S4 -","- C44 H52 N4 O12 S4 -","- C88 H104 N8 O24 S8 -","2","1","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","","1.5418","CuKα","","0.0547","0.0534","","0.1274","0.1223","0.1274","","","","","","0.9794","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054583","28.7209","0.0004","19.3593","0.0004","13.9154","0.0004","90","","136.11","0.003","90","","5364","0.4","120","0.14","120","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C48 H56 N8 O12 S4 -","- C48 H56 N8 O12 S4 -","- C192 H224 N32 O48 S16 -","4","0.5","","Mačková, Michaela; Mikšátko, Jiří; Budka, Jan; Eigner, Václav; Cuřínová, Petra; Lhoták, Pavel","Chiral anion recognition by a ureido-thiacalix[4]arene ligand immobilized in the 1,3-alternate conformation","New J. Chem.","2015","39","2","1382","","10.1039/C4NJ01956C","","x-ray","1.5418","CuKα","","0.058","0.0511","","","0.1383","0.1425","","","","2.37","2.37","2.26","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054584","8.398","0.003","4.9346","0.0018","14.205","0.004","90","","95.64","0.02","90","","585.8","0.3","296","","296","","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H8 B3 N2 O9 Zn4 -","- C2 H8 B3 N2 O9 Zn4 -","- C4 H16 B6 N4 O18 Zn8 -","2","0.5","","Jiang, Xiangzhan; Yang, Yun; Pan, Shilie; Han, Jian; Dong, Xiaoyu; Zhang, Fangyuan; Yu, Hongwei; Wang, Ying","Zn4B3O9C2H8N2: an organic‒inorganic hybrid borate with a novel graphene-like layer","New J. Chem.","2014","38","12","6025","","10.1039/C4NJ01015A","","x-ray","0.71073","MoKα","","0.0663","0.042","","","0.0923","0.1018","","","","","","1.072","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054585","15.65","0.01","17.82","0.01","26.44","0.02","70.56","0.03","86.08","0.03","87.57","0.04","6936","8","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C150.6 H206.4 N8 O14.6 -","- C150.6 H206.4 N8 O14.6 -","- C301.2 H412.8 N16 O29.2 -","2","1","","Gattuso, Giuseppe; Notti, Anna; Parisi, Melchiorre F.; Pisagatti, Ilenia; Marcos, Paula Maria; Ascenso, José Rosário; Brancatelli, Giovanna; Geremia, Silvano","Selective recognition of biogenic amine hydrochlorides by heteroditopic dihomooxacalix[4]arenes","New J. Chem.","2015","39","2","817","","10.1039/C4NJ01423E","","","0.7","","","0.1594","0.1288","","","0.3366","0.3641","","","","","","1.054","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054586","15.6352","0.0002","16.2677","0.0002","8.8947","0.00012","90","","103.891","0.0014","90","","2196.2","0.05","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 N3 O2 S -","- C26 H25 N3 O2 S -","- C104 H100 N12 O8 S4 -","4","1","","Sharma, Shilpa; Pradeep, Chullikkattill. P.; Dhir, Abhimanew","Dansyl-carbazole AIEE material for selective recognition of thiourea derivatives","New J. Chem.","2015","39","3","1822","","10.1039/C4NJ01800A","","","0.71073","MoKα","","0.0326","0.0307","","","0.0772","0.0786","","","","","","1.065","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054587","14.9946","0.0006","17.0429","0.0007","22.7907","0.0008","90","","128.291","0.002","90","","4571.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C55 H41 Er N2 O6 -","- C55 H41 Er N2 O6 -","- C220 H164 Er4 N8 O24 -","4","1","","Martín-Ramos, Pablo; Coutinho, Joana T.; Ramos Silva, Manuela; Pereira, Laura C. J.; Lahoz, Fernando; da Silva, Pedro S. Pereira; Lavín, Víctor; Martín-Gil, Jesús","Slow magnetic relaxation and photoluminescent properties of a highly coordinated erbium(iii) complex with dibenzoylmethane and 2,2′-bipyridine","New J. Chem.","2015","39","3","1703","","10.1039/C4NJ01828A","","","0.71073","MoKα","","0.0334","0.0208","","","0.0457","0.0513","","","","","","1.04","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054588","15.2886","0.0006","17.7424","0.0007","20.7735","0.0007","73.91","0.002","70.046","0.002","68.647","0.002","4857.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C55 H41 Er N2 O6 -","- C55 H41 Er N2 O6 -","- C220 H164 Er4 N8 O24 -","4","2","","Martín-Ramos, Pablo; Coutinho, Joana T.; Ramos Silva, Manuela; Pereira, Laura C. J.; Lahoz, Fernando; da Silva, Pedro S. Pereira; Lavín, Víctor; Martín-Gil, Jesús","Slow magnetic relaxation and photoluminescent properties of a highly coordinated erbium(iii) complex with dibenzoylmethane and 2,2′-bipyridine","New J. Chem.","2015","39","3","1703","","10.1039/C4NJ01828A","","","0.71073","MoKα","","0.1672","0.0664","","","0.1354","0.1627","","","","","","0.869","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054589","13.9619","0.0007","25.3276","0.0014","12.567","0.0006","90","","104.037","0.003","90","","4311.3","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H44 B Cu N7 S2 -","- C50 H44 B Cu N7 S2 -","- C200 H176 B4 Cu4 N28 S8 -","4","1","","Harding, David J.; Phonsri, Wasinee; Harding, Phimphaka; Sirirak, Jitnapa; Tangtirungrotechai, Yuthana; Webster, Richard D.; Adams, Harry","Copper hydrotris(3,5-diphenylpyrazolyl)borate dithiocarbamates: mimicking green copper proteins","New J. Chem.","2015","39","2","1498","","10.1039/C4NJ01298D","","","0.71073","MoKα","","0.1307","0.0601","","","0.1397","0.1773","","","","","","0.987","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054590","17.804","0.005","18.099","0.005","17.81","0.005","90","","119.686","0.006","90","","4986","2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C60 H48 B Cu N7 S2 -","- C60 H48 B Cu N7 S2 -","- C240 H192 B4 Cu4 N28 S8 -","4","1","","Harding, David J.; Phonsri, Wasinee; Harding, Phimphaka; Sirirak, Jitnapa; Tangtirungrotechai, Yuthana; Webster, Richard D.; Adams, Harry","Copper hydrotris(3,5-diphenylpyrazolyl)borate dithiocarbamates: mimicking green copper proteins","New J. Chem.","2015","39","2","1498","","10.1039/C4NJ01298D","","","0.71073","MoKα","","0.1377","0.0689","","","0.18","0.2489","","","","","","0.995","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054591","13.9204","0.0014","25.042","0.003","12.6285","0.0013","90","","102.523","0.002","90","","4297.5","0.8","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H42 B Cu N7 S2 -","- C50 H42 B Cu N7 S2 -","- C200 H168 B4 Cu4 N28 S8 -","4","1","","Harding, David J.; Phonsri, Wasinee; Harding, Phimphaka; Sirirak, Jitnapa; Tangtirungrotechai, Yuthana; Webster, Richard D.; Adams, Harry","Copper hydrotris(3,5-diphenylpyrazolyl)borate dithiocarbamates: mimicking green copper proteins","New J. Chem.","2015","39","2","1498","","10.1039/C4NJ01298D","","","0.71073","MoKα","","0.0677","0.0448","","","0.1283","0.1717","","","","","","1.024","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054592","15.7805","0.0009","5.0908","0.0003","21.06","0.0013","90","","110.851","0.001","90","","1581.06","0.16","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O4 S -","- C16 H17 N O4 S -","- C64 H68 N4 O16 S4 -","4","1","","Ragab, Sherif Shaban; Swaminathan, Subramani; Garcia-Amorós, Jaume; Captain, Burjor; Raymo, Françisco M.","Bimolecular photoactivation of NBD fluorescence","New J. Chem.","2015","39","3","1570","","10.1039/C4NJ01983K","","","0.71073","MoKα","","0.0523","0.038","","","0.0949","0.1034","","","","","","1.038","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054593","15.5059","0.0003","11.4074","0.0002","16.1421","0.0003","90","","100.036","0.0016","90","","2811.56","0.09","99.99","0.17","99.99","0.17","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 Cl2 N5 Ni O9 -","- C26 H25 Cl2 N5 Ni O9 -","- C104 H100 Cl8 N20 Ni4 O36 -","4","1","","Song, Xiaowei; Wen, Huimin; Ma, Chengbing; Chen, Hui; Chen, Changneng","Hydrogen photogeneration catalyzed by a cobalt complex of a pentadentate aminopyridine-based ligand","New J. Chem.","2015","39","3","1734","","10.1039/C4NJ01858C","","","1.54184","CuKα","","","0.0421","","","0.1041","0.1093","","","","","","1.054","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054594","15.5452","0.0002","11.45475","0.00014","16.1105","0.0002","90","","99.8494","0.0012","90","","2826.46","0.06","100","0.2","100","0.2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 Cl2 Co N5 O9 -","- C26 H25 Cl2 Co N5 O9 -","- C104 H100 Cl8 Co4 N20 O36 -","4","1","","Song, Xiaowei; Wen, Huimin; Ma, Chengbing; Chen, Hui; Chen, Changneng","Hydrogen photogeneration catalyzed by a cobalt complex of a pentadentate aminopyridine-based ligand","New J. Chem.","2015","39","3","1734","","10.1039/C4NJ01858C","","","1.54184","CuKα","","","0.0308","","","0.0751","0.0781","","","","","","1.035","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054595","11.307","0.0004","13.8002","0.0004","17.341","0.0005","70.683","0.002","73.734","0.002","71.237","0.002","2371.71","0.13","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H55 Cl6 N5 O8 -","- C39 H55 Cl6 N5 O8 -","- C78 H110 Cl12 N10 O16 -","2","1","","Pike, Sarah J.; Boddaert, Thomas; Raftery, James; Webb, Simon J.; Clayden, Jonathan","Participation of non-aminoisobutyric acid (Aib) residues in the 310helical conformation of Aib-rich foldamers: a solid state study","New J. Chem.","2015","39","5","3288","","10.1039/C4NJ01547A","","","1.54178","CuKα","","0.0815","0.0659","","","0.1562","0.1683","","","","","","1.07","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054596","19.2677","0.0013","14.6496","0.0008","22.219","0.002","90","","122.706","0.005","90","","5277.3","0.7","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H82 Cl4 P2 Ru -","- C54 H82 Cl4 P2 Ru -","- C216 H328 Cl16 P8 Ru4 -","4","1","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","","0.71073","MoKα","","0.0818","0.0634","","","0.1641","0.1795","","","","","","1.053","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054597","46.1591","0.0018","46.1591","0.0018","13.9447","0.0003","90","","90","","120","","25730.9","1.5","100","0.1","100","0.1","","","","","","","","5","R -3","-R 3","148","","","","- C51 H76 Cl2 P2 Ru -","- C51 H76 Cl2 P2 Ru -","- C918 H1368 Cl36 P36 Ru18 -","18","","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","","1.5418","CuKα","","0.0932","0.0628","","","0.1603","0.1812","","","","","","0.955","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054598","11.4775","0.0003","19.2194","0.0005","25.7969","0.0006","90","","96.478","0.002","90","","5654.2","0.2","100","0.1","100","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H45 Cl2 O P Ru -","- C28 H45 Cl2 O P Ru -","- C224 H360 Cl16 O8 P8 Ru8 -","8","2","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","","0.7107","MoKα","","0.1065","0.0543","","","0.1042","0.125","","","","","","0.968","","","","has coordinates","180099","2020-10-21","18:00:00",""
"7054599","10.2241","0.0008","12.7121","0.001","20.0557","0.0016","72.94","0.007","76.718","0.007","81.407","0.006","2415.8","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H44 Cl2 P2 Ru -","- C53 H44 Cl2 P2 Ru -","- C106 H88 Cl4 P4 Ru2 -","2","1","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","","0.71073","MoKα","","0.0843","0.0619","","","0.1616","0.1767","","","","","","1.026","","","","has coordinates,has disorder","180099","2020-10-21","18:00:00",""
"7054600","6.6764","0.0002","16.5673","0.0006","11.6107","0.0003","90","","92.308","0.003","90","","1283.22","0.07","100","0.1","100","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 O -","- C17 H16 O -","- C68 H64 O4 -","4","1","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","","1.5418","CuKα","","0.045","0.0383","","","0.1005","0.1072","","","","","","1.062","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054601","47.1514","0.0015","47.1514","0.0015","13.6692","0.0003","90","","90","","120","","26318.6","1.3","100","0.1","100","0.1","","","","","","","","5","R -3","-R 3","148","","","","- C53 H80 Cl2 P2 Ru -","- C53 H80 Cl2 P2 Ru -","- C954 H1440 Cl36 P36 Ru18 -","18","","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","x-ray","1.54184","CuKα","","0.0967","0.072","","","0.1589","0.1715","","","","","","1.049","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054602","46.042","0.0017","46.042","0.0017","14.0313","0.0003","90","","90","","120","","25759.5","1.5","100","0.1","100","0.1","","","","","","","","5","R -3","-R 3","148","","","","- C55 H78 Cl2 P2 Ru -","- C55 H78 Cl2 P2 Ru -","- C990 H1404 Cl36 P36 Ru18 -","18","","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","x-ray","1.54184","CuKα","","0.1289","0.0968","","","0.2133","0.2263","","","","","","1.032","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054603","45.479","0.003","45.479","0.003","14.179","0.0005","90","","90","","120","","25398","3","100","0.1","100","0.1","","","","","","","","6","R -3","-R 3","148","","","","- C51 H75 Cl2 F P2 Ru -","- C51 H75 Cl2 F P2 Ru -","- C918 H1350 Cl36 F18 P36 Ru18 -","18","","","Yu, Baoyi; Xie, Yu; Hamad, Fatma B.; Leus, Karen; Lyapkov, Alex A.; Van Hecke, Kristof; Verpoort, Francis","Synthesis and characterization of non-chelating ruthenium‒indenylidene olefin metathesis catalysts derived from substituted 1,1-diphenyl-2-propyn-1-ols","New J. Chem.","2015","39","3","1858","","10.1039/C4NJ02034K","","x-ray","1.54184","CuKα","","0.1537","0.0916","","","0.1781","0.2086","","","","","","0.962","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054604","10.1589","0.0011","11.3338","0.0012","11.6688","0.0014","68.322","0.001","67.396","0.001","82.841","0.002","1152.4","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H25 N3 O4 -","- C26 H25 N3 O4 -","- C52 H50 N6 O8 -","2","1","","Yan, Xingchen; Xu, Jiakun; Wu, Xiaojing; Zhang, Zhongyu; Zhang, Xia; Fan, Yuhua; Bi, Caifeng","Proteasome inhibition and cytostatic effects on human cancer cells by pyrazolone-enamines: a combined crystallographic, structural and computational study","New J. Chem.","2015","39","3","2168","","10.1039/C4NJ01906G","","","0.71073","MoKα","","0.0931","0.0513","","","0.1346","0.172","","","","","","0.973","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054605","7.3752","0.0006","10.9275","0.0009","14.5614","0.0012","101.707","0.002","92.769","0.001","98.544","0.001","1132.64","0.16","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H24 N4 O3 -","- C25 H24 N4 O3 -","- C50 H48 N8 O6 -","2","1","","Yan, Xingchen; Xu, Jiakun; Wu, Xiaojing; Zhang, Zhongyu; Zhang, Xia; Fan, Yuhua; Bi, Caifeng","Proteasome inhibition and cytostatic effects on human cancer cells by pyrazolone-enamines: a combined crystallographic, structural and computational study","New J. Chem.","2015","39","3","2168","","10.1039/C4NJ01906G","","","0.71073","MoKα","","0.1387","0.0721","","","0.1896","0.2453","","","","","","1.025","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054606","7.7356","0.0007","10.8256","0.0008","13.5508","0.0011","112.683","0.002","90.907","0.001","107.741","0.001","985.67","0.14","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H21 N3 O2 -","- C24 H21 N3 O2 -","- C48 H42 N6 O4 -","2","1","","Yan, Xingchen; Xu, Jiakun; Wu, Xiaojing; Zhang, Zhongyu; Zhang, Xia; Fan, Yuhua; Bi, Caifeng","Proteasome inhibition and cytostatic effects on human cancer cells by pyrazolone-enamines: a combined crystallographic, structural and computational study","New J. Chem.","2015","39","3","2168","","10.1039/C4NJ01906G","","","0.71073","MoKα","","0.0735","0.0446","","","0.1076","0.132","","","","","","1.044","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054607","9.5274","0.0008","10.4205","0.0009","14.7518","0.0013","77.254","0.001","82.096","0.001","84.377","0.002","1411.4","0.2","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H34 N4 O3 -","- C32 H34 N4 O3 -","- C64 H68 N8 O6 -","2","1","","Yan, Xingchen; Xu, Jiakun; Wu, Xiaojing; Zhang, Zhongyu; Zhang, Xia; Fan, Yuhua; Bi, Caifeng","Proteasome inhibition and cytostatic effects on human cancer cells by pyrazolone-enamines: a combined crystallographic, structural and computational study","New J. Chem.","2015","39","3","2168","","10.1039/C4NJ01906G","","","0.71073","MoKα","","0.2033","0.0729","","","0.1616","0.2464","","","","","","1.01","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054608","7.2287","0.0006","11.0934","0.0009","14.0509","0.0014","107.981","0.002","99.534","0.001","105.146","0.001","996.58","0.15","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H21 N3 O2 -","- C24 H21 N3 O2 -","- C48 H42 N6 O4 -","2","1","","Yan, Xingchen; Xu, Jiakun; Wu, Xiaojing; Zhang, Zhongyu; Zhang, Xia; Fan, Yuhua; Bi, Caifeng","Proteasome inhibition and cytostatic effects on human cancer cells by pyrazolone-enamines: a combined crystallographic, structural and computational study","New J. Chem.","2015","39","3","2168","","10.1039/C4NJ01906G","","","0.71073","MoKα","","0.0627","0.0427","","","0.1076","0.1258","","","","","","0.971","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054609","8.4482","0.0007","10.4238","0.0011","13.9303","0.0012","86.458","0.002","77.239","0.001","86.317","0.002","1192.54","0.19","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H25 N3 O6 -","- C27 H25 N3 O6 -","- C54 H50 N6 O12 -","2","1","","Yan, Xingchen; Xu, Jiakun; Wu, Xiaojing; Zhang, Zhongyu; Zhang, Xia; Fan, Yuhua; Bi, Caifeng","Proteasome inhibition and cytostatic effects on human cancer cells by pyrazolone-enamines: a combined crystallographic, structural and computational study","New J. Chem.","2015","39","3","2168","","10.1039/C4NJ01906G","","","0.71073","MoKα","","0.1562","0.064","","","0.1427","0.1892","","","","","","0.995","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054610","11.552","0.0001","12.366","0.0001","22.149","0.0002","90","","97.83","","90","","3134.53","0.05","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H36 Al2 N2 O4 -","- C34 H36 Al2 N2 O4 -","- C136 H144 Al8 N8 O16 -","4","1","","Forder, Thomas R.; Jones, Matthew D.","Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA","New J. Chem.","2015","39","3","1974","","10.1039/C4NJ02228A","","","0.71073","MoKα","","0.0475","0.0374","","","0.0982","0.1063","","","","","","1.034","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7054611","12.0601","0.0002","22.5938","0.0003","35.5013","0.0006","90","","90","","90","","9673.5","0.3","150","2","150","2","","","","","","","","6","P b n 21","P 2c -2ab","33","","","","- C102 H95 Al4 Cl8 N4 O8 -","- C102 H95 Al4 Cl8 N4 O8 -","- C408 H380 Al16 Cl32 N16 O32 -","4","1","","Forder, Thomas R.; Jones, Matthew D.","Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA","New J. Chem.","2015","39","3","1974","","10.1039/C4NJ02228A","","","0.71073","MoKα","","0.115","0.0756","","","0.1719","0.195","","","","","","1.038","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054612","13.632","0.003","19.128","0.0017","25.491","0.002","90","","99.037","0.007","90","","6564.3","1.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C69 H100 Al2 N2 O4 -","- C69 H100 Al2 N2 O4 -","- C276 H400 Al8 N8 O16 -","4","1","","Forder, Thomas R.; Jones, Matthew D.","Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA","New J. Chem.","2015","39","3","1974","","10.1039/C4NJ02228A","","","0.71073","MoKα","","0.1104","0.0638","","","0.1417","0.1716","","","","","","1.043","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054613","22.383","0.0016","5.781","0.0005","17.844","0.0016","90","","99.915","0.004","90","","2274.5","0.3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H13 N O2 -","- C14 H13 N O2 -","- C112 H104 N8 O16 -","8","1","","Forder, Thomas R.; Jones, Matthew D.","Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA","New J. Chem.","2015","39","3","1974","","10.1039/C4NJ02228A","","","0.71073","MoKα","","0.047","0.0372","","","0.0855","0.0923","","","","","","1.064","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054614","9.505","0.0002","11.258","0.0002","13.533","0.0003","90","","109.058","0.001","90","","1368.76","0.05","150","2","150","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C16 H17 N O2 -","- C16 H17 N O2 -","- C64 H68 N4 O8 -","4","1","","Forder, Thomas R.; Jones, Matthew D.","Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA","New J. Chem.","2015","39","3","1974","","10.1039/C4NJ02228A","","","0.71073","MoKα","","0.0696","0.0458","","","0.1046","0.1182","","","","","","1.05","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054615","8.041","0.0005","8.647","0.0006","18.742","0.001","90","","95.121","0.004","90","","1297.94","0.14","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H11 Cl2 N O2 -","- C14 H11 Cl2 N O2 -","- C56 H44 Cl8 N4 O8 -","4","1","","Forder, Thomas R.; Jones, Matthew D.","Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA","New J. Chem.","2015","39","3","1974","","10.1039/C4NJ02228A","","","0.71073","MoKα","","0.0482","0.0357","","","0.0857","0.093","","","","","","1.031","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054616","9.96","0.0001","24.276","0.0003","12.226","0.0002","90","","104.981","0.001","90","","2855.64","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H45 N O2 -","- C30 H45 N O2 -","- C120 H180 N4 O8 -","4","1","","Forder, Thomas R.; Jones, Matthew D.","Synthesis and characterisation of aluminium(iii) imine bis(phenolate) complexes with application for the polymerisation of rac-LA","New J. Chem.","2015","39","3","1974","","10.1039/C4NJ02228A","","","0.71073","MoKα","","0.0651","0.05","","","0.1286","0.1392","","","","","","1.033","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054617","8.3983","0.0008","25.31","0.003","14.1228","0.0016","90","","105.357","0.002","90","","2894.8","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H42 Eu2 I6 N2 O16 -","- C48 H42 Eu2 I6 N2 O16 -","- C96 H84 Eu4 I12 N4 O32 -","2","0.5","","Monteiro, Jorge H. S. K.; de Bettencourt-Dias, Ana; Mazali, Italo O.; Sigoli, Fernando A.","The effect of 4-halogenobenzoate ligands on luminescent and structural properties of lanthanide complexes: experimental and theoretical approaches","New J. Chem.","2015","39","3","1883","","10.1039/C4NJ01701C","","","0.71073","MoKα","","0.056","0.0331","","","0.0492","0.0539","","","","","","1.01","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054618","8.782","0.005","11.521","0.005","14.083","0.005","106.769","0.005","98.537","0.005","91.636","0.005","1345.3","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H26 Mo N4 O7 S -","- C25 H26 Mo N4 O7 S -","- C50 H52 Mo2 N8 O14 S2 -","2","1","","Maurya, Mannar R.; Dhaka, Sarita; Avecilla, Fernando","Oxidation of secondary alcohols by conventional and microwave-assisted methods using molybdenum complexes of ONO donor ligands","New J. Chem.","2015","39","3","2130","","10.1039/C4NJ02208D","","","0.71073","MoKα","","0.0719","0.046","","","0.1162","0.1421","","","","","","1.094","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054619","7.3114","0.001","13.174","0.002","13.6623","0.0019","98.512","0.007","91.457","0.006","90.513","0.007","1300.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H26 Mo N6 O7 S -","- C24 H26 Mo N6 O7 S -","- C48 H52 Mo2 N12 O14 S2 -","2","1","","Maurya, Mannar R.; Dhaka, Sarita; Avecilla, Fernando","Oxidation of secondary alcohols by conventional and microwave-assisted methods using molybdenum complexes of ONO donor ligands","New J. Chem.","2015","39","3","2130","","10.1039/C4NJ02208D","","","0.71073","MoKα","","0.1703","0.083","","","0.1915","0.2258","","","","","","1.112","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054620","13.4761","0.0019","13.4761","0.0019","27.254","0.005","90","","90","","90","","4949.5","1.3","153","2","153","2","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C10 H13 N4 O3 Zn -","- C6 H4 N3 O2 Zn -","- C96 H64 N48 O32 Zn16 -","16","1","","Zhu, Yu; Wang, Yan-Mei; Liu, Pan; Wu, Yun-Long; Wei, Wei; Xia, Chang-Kun; Xie, Ji-Min","Cage-like pores of a metal‒organic framework for separations and encapsulation of Pd nanoparticles for efficient catalysis","New J. Chem.","2015","39","4","2669","","10.1039/C4NJ01985G","","","0.71073","MoKα","","0.0607","0.052","","","0.1573","0.1644","","","","","","1.089","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054621","9.4237","0.0006","11.6936","0.0007","9.8675","0.0007","90","","95.103","0.002","90","","1083.06","0.12","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H33 N3 O7 -","- C19 H33 N3 O7 -","- C38 H66 N6 O14 -","2","1","","Kwon, Sunmi; Kang, Philjae; Choi, Moon-Gun; Choi, Soo Hyuk","cis-2-Aminocyclohex-4-enecarboxylic acid as a new building block of helical foldamers","New J. Chem.","2015","39","5","3221","","10.1039/C4NJ02056A","","","0.71073","MoKα","","0.0404","0.0319","","","0.0681","0.0718","","","","","","1.047","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054622","9.4408","0.0003","11.5247","0.0003","15.054","0.0004","90","","91.567","0.0015","90","","1637.3","0.08","301.4","","301.4","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H47 N5 O9 -","- C29 H47 N5 O9 -","- C58 H94 N10 O18 -","2","1","","Kwon, Sunmi; Kang, Philjae; Choi, Moon-Gun; Choi, Soo Hyuk","cis-2-Aminocyclohex-4-enecarboxylic acid as a new building block of helical foldamers","New J. Chem.","2015","39","5","3221","","10.1039/C4NJ02056A","","","1.54178","CuKα","","0.0726","0.0475","","","0.1181","0.1331","","","","","","1.028","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054623","31.232","0.008","8.842","0.002","18.831","0.005","90","","95.848","0.007","90","","5173","2","103.5","","103.5","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C39 H59 N7 O10 -","- C39 H59 N7 O10 -","- C156 H236 N28 O40 -","4","1","","Kwon, Sunmi; Kang, Philjae; Choi, Moon-Gun; Choi, Soo Hyuk","cis-2-Aminocyclohex-4-enecarboxylic acid as a new building block of helical foldamers","New J. Chem.","2015","39","5","3221","","10.1039/C4NJ02056A","","","0.71073","MoKα","","0.1034","0.0767","","","0.2191","0.2378","","","","","","1.037","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054624","9.2829","0.0008","17.955","0.002","23.143","0.003","90","","90","","90","","3857.3","0.7","100","","100","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H45 N5 O8 -","- C29 H45 N5 O8 -","- C116 H180 N20 O32 -","4","1","","Kwon, Sunmi; Kang, Philjae; Choi, Moon-Gun; Choi, Soo Hyuk","cis-2-Aminocyclohex-4-enecarboxylic acid as a new building block of helical foldamers","New J. Chem.","2015","39","5","3221","","10.1039/C4NJ02056A","","","0.71073","MoKα","","0.0588","0.0494","","","0.1212","0.1258","","","","","","1.065","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054625","7.42","0.0009","7.42","0.0009","12.11","0.002","90","","90","","120","","577.41","0.14","173","2","173","2","","","","","","","","4","P 31 2 1","P 31 2""","152","","","","- C2 H8 O8 Zn -","- C2 H8 O8 Zn -","- C6 H24 O24 Zn3 -","3","0.5","","Mei, Hong-Xin; Zhang, Ting; Wang, Dan-Feng; Huang, Rong-Bin; Zheng, Lan-Sun","A Zn-oxalate helix linked by a water helix: spontaneous chiral resolution of a Zn helical coordination polymer","New J. Chem.","2015","39","3","2075","","10.1039/C4NJ02017K","","","0.71073","MoKα","","0.0483","0.0442","","","0.1156","0.1227","","","","","","0.94","","","","has coordinates","278046","2022-09-21","15:45:41",""
"7054626","7.42","0.0003","7.42","0.0003","12.11","0.0007","90","","90","","120","","577.41","0.05","173","2","173","2","","","","","","","","4","P 32 2 1","P 32 2""","154","","","","- C2 H8 O8 Zn -","- C2 H8 O8 Zn -","- C6 H24 O24 Zn3 -","3","0.5","","Mei, Hong-Xin; Zhang, Ting; Wang, Dan-Feng; Huang, Rong-Bin; Zheng, Lan-Sun","A Zn-oxalate helix linked by a water helix: spontaneous chiral resolution of a Zn helical coordination polymer","New J. Chem.","2015","39","3","2075","","10.1039/C4NJ02017K","","","0.71073","MoKα","","0.0405","0.0365","","","0.0712","0.0732","","","","","","1.052","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7054627","9.8262","0.0003","9.8965","0.0003","9.9887","0.0003","104.009","0.003","99.865","0.002","110.767","0.003","845.09","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H18 Cl2 N4 O2 Pd -","- C15 H18 Cl2 N4 O2 Pd -","- C30 H36 Cl4 N8 O4 Pd2 -","2","1","","Kumar, Sushil; Jha, Rajeev Ranjan; Yadav, Sunil; Gupta, Rajeev","Pd(ii) complexes with amide-based macrocycles: syntheses, properties and applications in cross-coupling reactions","New J. Chem.","2015","39","3","2042","","10.1039/C4NJ01300J","","","1.5418","CuKα","","0.0373","0.0367","","","0.096","0.0967","","","","","","1.068","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054628","9.606","0.002","15.616","0.004","10.6058","0.0011","90","","104.624","0.016","90","","1539.4","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 N4 O2 Pd -","- C15 H20 N4 O2 Pd -","- C60 H80 N16 O8 Pd4 -","4","1","","Kumar, Sushil; Jha, Rajeev Ranjan; Yadav, Sunil; Gupta, Rajeev","Pd(ii) complexes with amide-based macrocycles: syntheses, properties and applications in cross-coupling reactions","New J. Chem.","2015","39","3","2042","","10.1039/C4NJ01300J","","","0.71073","MoKα","","0.054","0.0392","","","0.0917","0.0956","","","","","","1.018","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054629","10.4774","0.0004","10.9664","0.0003","16.1533","0.0006","90","","99.73","0.003","90","","1829.31","0.11","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H24 N4 O4 Pd -","- C17 H24 N4 O4 Pd -","- C68 H96 N16 O16 Pd4 -","4","1","","Kumar, Sushil; Jha, Rajeev Ranjan; Yadav, Sunil; Gupta, Rajeev","Pd(ii) complexes with amide-based macrocycles: syntheses, properties and applications in cross-coupling reactions","New J. Chem.","2015","39","3","2042","","10.1039/C4NJ01300J","","","1.54184","CuKα","","0.0349","0.0305","","","0.0816","0.086","","","","","","1.063","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054630","9.864","0.005","10.537","0.005","17.033","0.005","90","0.005","106.046","0.005","90","0.005","1701.4","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H24 N4 O2 Pd -","- C17 H24 N4 O2 Pd -","- C68 H96 N16 O8 Pd4 -","4","1","","Kumar, Sushil; Jha, Rajeev Ranjan; Yadav, Sunil; Gupta, Rajeev","Pd(ii) complexes with amide-based macrocycles: syntheses, properties and applications in cross-coupling reactions","New J. Chem.","2015","39","3","2042","","10.1039/C4NJ01300J","","","1.54184","CuKα","","0.067","0.0589","","","0.1847","0.2052","","","","","","1.053","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054631","16.43","0.0012","26.165","0.002","21.2458","0.0015","90","","105.579","0.001","90","","8797.8","1.1","188","2","188","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H66 N2 O4 Ti -","- C41 H66 N2 O4 Ti -","- C328 H528 N16 O32 Ti8 -","8","1","","Gao, Bo; Li, Xiang; Duan, Ranlong; Pang, Xuan","Titanium complexes with octahedral geometry chelated by salen ligands adopting β-cis configuration for the ring-opening polymerisation of lactide","New J. Chem.","2015","39","4","2404","","10.1039/C4NJ02266A","","","0.71073","MoKα","","0.0984","0.0684","","","0.1828","0.2011","","","","","","1.059","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054632","15.4724","0.0019","14.1459","0.0017","24.04","0.002","90","","90.188","0.002","90","","5261.6","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C80 H92 Eu3 N11 O38 -","- C80 H92 Eu3 N11 O38 -","- C160 H184 Eu6 N22 O76 -","2","0.5","","Li, Ao; Li, Liang; Lin, Zhi; Song, Lin; Wang, Zi-Hao; Chen, Qiang; Yang, Tao; Zhou, Xin-Hui; Xiao, Hong-Ping; Yin, Xiu-Ju","Guest-induced reversible structural transitions and concomitant on/off luminescence switching of an Eu(iii) metal‒organic framework and its application in detecting picric acid","New J. Chem.","2015","39","3","2289","","10.1039/C4NJ01946F","","","0.71073","MoKα","","0.0584","0.0543","","","0.1365","0.1371","","","","","","1.001","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054633","9.2503","0.0005","10.679","0.0006","13.4211","0.0006","76.141","0.002","77.031","0.002","64.664","0.002","1152.1","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24.5 H18 N2 O7 -","- C24.5 H18 N2 O7 -","- C49 H36 N4 O14 -","2","1","","Vitório, Felipe; Pereira, Thiago Moreira; Castro, Rosane Nora; Guedes, Guilherme Pereira; Graebin, Cedric Stephan; Kümmerle, Arthur Eugen","Synthesis and mechanism of novel fluorescent coumarin-dihydropyrimidinone dyads obtained by Biginelli multicomponent reaction","New J. Chem.","2015","","","","","10.1039/C4NJ02155J","","","0.71073","MoKα","","0.0992","0.0622","","","0.1714","0.1986","","","","","","1.06","","","","has coordinates","211691","2020-10-21","18:00:00",""
"7054634","5.8352","0.0012","7.3473","0.0015","5.2561","0.001","90","","90","","90","","225.34","0.08","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Dy0.5 Mn O3 Yb0.5 -","- Dy0.5 Mn O3 Yb0.5 -","- Dy2 Mn4 O12 Yb2 -","4","0.5","","Zhang, Yingnan; Liu, Fuyang; Zheng, Tong; Zhang, Ziqing; Liu, Wei; Zhao, Xudong; Liu, Xiaoyang","Synthesis of perovskite-type manganites Yb1−xDyxMnO3(0.1 ≤ x ≤ 0.5) via solid-state reaction and high-pressure flux methods followed by structural characterization and magnetic property studies","New J. Chem.","2015","39","4","2596","","10.1039/C4NJ01876A","","","0.71073","MoKα","","0.0177","0.0171","","","0.0397","0.0402","","","","","","1.201","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054635","8.2512","0.0003","30.1101","0.001","11.634","0.0005","90","","102.212","0.001","90","","2825","0.18","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 F6 N5 O2 S -","- C28 H25 F6 N5 O2 S -","- C112 H100 F24 N20 O8 S4 -","4","1","","Guo, Jixi; Liu, Li; Jia, Dianzeng; Guo, Mingxi; Zhang, Yucai; Song, Xianli","Photochromism and fluorescence modulation of pyrazolone derivatives in the solid state","New J. Chem.","2015","39","4","3059","","10.1039/C4NJ01970A","","","0.71073","MoKα","","0.1099","0.0723","","","0.1355","0.1574","","","","","","1.081","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054636","9.2721","0.0007","10.3272","0.0006","10.7817","0.0007","81.614","0.005","81.335","0.006","89.456","0.005","1009.62","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl(2R,3aR,10bR)-1-benzyl-10-chloro-1,2,3,3a,4,10b-hexadydropyrrolo- [2'3':3,4]pyrrolo[1,2-a]indole-2-carboxylate","","- C23 H23 Cl N2 O2 -","- C23 H23 Cl N2 O2 -","- C46 H46 Cl2 N4 O4 -","2","1","","Sutariya, Tushar R.; Labana, Balvantsingh M.; Parmar, Narsidas J.; Kant, Rajni; Gupta, Vivek K.; Plata, Gabriela B.; Padrón, José M.","Efficient synthesis of some new antiproliferative N-fused indoles and isoquinolines via 1,3-dipolar cycloaddition reaction in an ionic liquid","New J. Chem.","2015","39","4","2657","","10.1039/C4NJ02308K","","","0.71073","MoKα","","0.1201","0.0569","","","0.1227","0.1606","","","","","","0.996","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054637","13.9521","0.001","6.6102","0.0004","21.977","0.0013","90","","106.352","0.007","90","","1944.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5aS,12bS)-12-chloro-2,3-dimethoxy-4b,5,5a,12b,14, 15-hexahydro-6H-benzo[5',6']pyrrolizino[2',1':4,5]pyrrolo[2,1-a]isoquinoline","","- C23 H23 Cl N2 O2 -","- C23 H23 Cl N2 O2 -","- C92 H92 Cl4 N8 O8 -","4","1","","Sutariya, Tushar R.; Labana, Balvantsingh M.; Parmar, Narsidas J.; Kant, Rajni; Gupta, Vivek K.; Plata, Gabriela B.; Padrón, José M.","Efficient synthesis of some new antiproliferative N-fused indoles and isoquinolines via 1,3-dipolar cycloaddition reaction in an ionic liquid","New J. Chem.","2015","39","4","2657","","10.1039/C4NJ02308K","","","0.71073","MoKα","","0.0672","0.0441","","","0.0975","0.1118","","","","","","1.019","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054638","6.7203","0.0002","8.2504","0.0003","12.3358","0.0004","84.469","0.001","79.593","0.002","85.31","0.002","668.13","0.04","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H34 Co N4 O18 S2 -","- C14 H34 Co N4 O18 S2 -","- C14 H34 Co N4 O18 S2 -","1","0.5","","Kammoun, Omar; Rekik, Walid; Naïli, Houcine; Bataille, Thierry","Inorganic layered structures in hybrid double sulfates: related phases and thermal reactivity","New J. Chem.","2015","39","4","2682","","10.1039/C4NJ02195A","","","0.71073","MoKα","","0.0565","0.0421","","","0.1085","0.1183","","","","","","1.026","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054639","6.8292","0.0001","8.1314","0.0002","12.3445","0.0003","85.429","0.001","81.437","0.001","85.436","0.001","674.11","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H34 Cu N4 O18 S2 -","- C14 H34 Cu N4 O18 S2 -","- C14 H34 Cu N4 O18 S2 -","1","0.5","","Kammoun, Omar; Rekik, Walid; Naïli, Houcine; Bataille, Thierry","Inorganic layered structures in hybrid double sulfates: related phases and thermal reactivity","New J. Chem.","2015","39","4","2682","","10.1039/C4NJ02195A","","","0.71073","MoKα","","0.0537","0.0475","","","0.1225","0.1278","","","","","","1.06","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054640","6.6706","0.0001","26.5804","0.0004","15.2009","0.0002","90","","92.254","0.001","90","","2693.14","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H32 Fe N4 O17 S2 -","- C14 H32 Fe N4 O17 S2 -","- C56 H128 Fe4 N16 O68 S8 -","4","1","","Kammoun, Omar; Rekik, Walid; Naïli, Houcine; Bataille, Thierry","Inorganic layered structures in hybrid double sulfates: related phases and thermal reactivity","New J. Chem.","2015","39","4","2682","","10.1039/C4NJ02195A","","","0.71073","MoKα","","0.0573","0.0432","","","0.1082","0.1184","","","","","","1.056","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054641","6.6415","0.0003","8.2264","0.0004","12.2601","0.0006","84.337","0.002","79.491","0.002","85.886","0.002","654.4","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H34 N4 Ni O18 S2 -","- C14 H34 N4 Ni O18 S2 -","- C14 H34 N4 Ni O18 S2 -","1","0.5","","Kammoun, Omar; Rekik, Walid; Naïli, Houcine; Bataille, Thierry","Inorganic layered structures in hybrid double sulfates: related phases and thermal reactivity","New J. Chem.","2015","39","4","2682","","10.1039/C4NJ02195A","","","0.71073","MoKα","","0.0446","0.0359","","","0.0991","0.1138","","","","","","1.119","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7054642","11.6864","0.0003","17.6541","0.0004","14.7499","0.0004","90","","113.152","0.001","90","","2798.02","0.12","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H33 Co2 I3 N4 O -","- C22 H33 Co2 I3 N4 O -","- C88 H132 Co8 I12 N16 O4 -","4","1","","Khandar, Ali Akbar; Kirschbaum, Kristin; Abedi, Marjan; Mock, Kristi; Tracy, Greg; Spasojevic, Vojislav; Hosseini-Yazdi, Seyed Abolfazl","Synthesis, characterization and crystal structures of mono and dinuclear macrocyclic cobalt(ii) complexes with a new tetraaza m-xylyl-based macrocyclic ligand","New J. Chem.","2015","39","4","2822","","10.1039/C4NJ01608D","","","0.71073","MoKα","","0.05","0.0456","","","0.0924","0.0939","","","","","","1.272","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054643","8.8736","0.0002","13.6929","0.0003","21.0647","0.0006","90","","90","","90","","2559.47","0.11","140","2","140","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H34 Cl4 Co N4 -","- C22 H34 Cl4 Co N4 -","- C88 H136 Cl16 Co4 N16 -","4","1","","Khandar, Ali Akbar; Kirschbaum, Kristin; Abedi, Marjan; Mock, Kristi; Tracy, Greg; Spasojevic, Vojislav; Hosseini-Yazdi, Seyed Abolfazl","Synthesis, characterization and crystal structures of mono and dinuclear macrocyclic cobalt(ii) complexes with a new tetraaza m-xylyl-based macrocyclic ligand","New J. Chem.","2015","39","4","2822","","10.1039/C4NJ01608D","","","0.71073","MoKα","","0.085","0.0589","","","0.1233","0.1336","","","","","","1.025","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054644","7.9236","0.0012","10.168","0.0017","10.2931","0.0018","62.925","0.003","67.443","0.003","69.428","0.004","665.97","0.19","140","2","140","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H40 Cl4 N4 O2 -","- C22 H40 Cl4 N4 O2 -","- C22 H40 Cl4 N4 O2 -","1","0.5","","Khandar, Ali Akbar; Kirschbaum, Kristin; Abedi, Marjan; Mock, Kristi; Tracy, Greg; Spasojevic, Vojislav; Hosseini-Yazdi, Seyed Abolfazl","Synthesis, characterization and crystal structures of mono and dinuclear macrocyclic cobalt(ii) complexes with a new tetraaza m-xylyl-based macrocyclic ligand","New J. Chem.","2015","39","4","2822","","10.1039/C4NJ01608D","","","0.71073","MoKα","","0.0411","0.0357","","","0.0889","0.0918","","","","","","1.074","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054645","4.8468","0.0008","9.2594","0.0016","12.245","0.002","69.536","0.007","89.567","0.007","85.993","0.007","513.51","0.15","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-19 1,1'-di[(4-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)2-COOH","","- C22 H22 N6 O4 -","- C22 H22 N6 O4 -","- C22 H22 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","1.54178","CuKα","","0.0624","0.0507","","","0.1279","0.14","","","","","","1.084","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054646","5.5146","0.0011","6.81","0.0014","15.254","0.003","79.288","0.006","85.259","0.006","75.952","0.005","545.62","0.19","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-20 1,1'-di[(4-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)4-COOH","","- C24 H26 N6 O4 -","- C24 H26 N6 O4 -","- C24 H26 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","0.71073","MoKα","","0.0563","0.0467","","","0.1267","0.1358","","","","","","1.099","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054647","5.6196","0.0011","6.7825","0.0013","16.078","0.003","87.236","0.004","82.669","0.004","75.451","0.004","588.2","0.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-21 1,1'-di[(4-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)6-COOH","","- C26 H30 N6 O4 -","- C26 H30 N6 O4 -","- C26 H30 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","0.71073","MoKα","","0.0519","0.0458","","","0.1235","0.1329","","","","","","1.014","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054648","5.632","0.0007","6.845","0.0008","17.748","0.002","93.63","0.007","98.988","0.007","104.67","0.007","649.97","0.14","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-22 1,1'-di[(3-pyridyl)methyl]-2,2'-biimidazole, HOOCH-(CH2)8-COOH","","- C28 H34 N6 O4 -","- C28 H34 N6 O4 -","- C28 H34 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","1.54178","CuKα","","0.0658","0.055","","","0.182","0.1976","","","","","","1.544","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054649","5.6047","0.0008","6.8589","0.001","18.879","0.003","97.644","0.005","91.164","0.005","104.659","0.005","694.78","0.18","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-23 1,1'-di[(4-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)10-COOH","","- C30 H38 N6 O4 -","- C30 H38 N6 O4 -","- C30 H38 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","1.54178","CuKα","","0.0546","0.0523","","","0.1665","0.1716","","","","","","1.472","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054650","14.797","0.003","4.5097","0.0007","29.886","0.005","90","","104.056","0.008","90","","1934.6","0.6","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","TW-2B-24-C 1,1'-di[(4-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)-COOH","","- C21 H20 N6 O4 -","- C21 H20 N6 O4 -","- C84 H80 N24 O16 -","4","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","0.71073","MoKα","","0.1229","0.0652","","","0.1575","0.1937","","","","","","0.998","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054651","7.6142","0.0011","8.6608","0.0013","11.0348","0.0016","102.357","0.005","105.996","0.005","93.866","0.005","677.09","0.17","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-25-SE 1,1'-di[(4-pyridyl)methyl]-2,2'-biimidazole, (HOOC-(CH2)3-COOH)2","","- C28 H32 N6 O8 -","- C28 H32 N6 O8 -","- C28 H32 N6 O8 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","0.71073","MoKα","","0.0471","0.0422","","","0.1184","0.1231","","","","","","0.973","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054652","5.0121","0.0005","7.8964","0.0008","15.1589","0.0016","78.403","0.004","88.333","0.004","72.636","0.003","560.62","0.1","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-2 1,1'-di[(2-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)4-COOH","","- C24 H26 N6 O4 -","- C24 H26 N6 O4 -","- C24 H26 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","0.71073","MoKα","","0.0505","0.0434","","","0.1195","0.1317","","","","","","1.116","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054653","5.1024","0.001","8.0128","0.0015","16.497","0.003","99.94","0.009","93.967","0.01","108.231","0.008","625.5","0.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-3 1,1'-di[(2-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)6-COOH","","- C26 H30 N6 O4 -","- C26 H30 N6 O4 -","- C26 H30 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","1.54178","CuKα","","0.0548","0.0496","","","0.1457","0.158","","","","","","1.176","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054654","5.2731","0.0008","7.8464","0.0011","17.163","0.003","81.964","0.006","88.938","0.006","72.499","0.006","670.39","0.18","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-4 1,1'-di[(2-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)8-COOH","","- C28 H34 N6 O4 -","- C28 H34 N6 O4 -","- C28 H34 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","1.54178","CuKα","","0.0351","0.0327","","","0.0832","0.085","","","","","","1.06","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054655","5.2955","0.0008","7.8185","0.0013","18.424","0.003","85.042","0.01","83.543","0.01","71.912","0.01","719.4","0.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-5 1,1'-di[(2-pyridyl)methyl]-2,2'-biimidazole, HOOC-(CH2)10-COOH","","- C30 H38 N6 O4 -","- C30 H38 N6 O4 -","- C30 H38 N6 O4 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","1.54178","CuKα","","0.0528","0.0446","","","0.1244","0.1335","","","","","","1.1","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054656","4.9161","0.001","8.0077","0.0016","20.828","0.004","87.266","0.011","88.665","0.01","72.608","0.009","781.5","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","TW-2B-8-C 1,1'-di[(2-pyridyl)methyl]-2,2'-biimidazole, [HOOC-(CH2)5-COOH]2","","- C32 H40 N6 O8 -","- C32 H40 N6 O8 -","- C32 H40 N6 O8 -","1","0.5","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","0.71073","MoKα","","0.1768","0.0996","","","0.2355","0.2647","","","","","","1.286","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054657","11.4449","0.0017","8.9002","0.0015","21.338","0.003","90","","94.855","0.01","90","","2165.7","0.6","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","TW-2B-33 1,1'-di[(phenyl)methyl]-2,2'-biimidazole, HOOC-CH2-COOH","","- C23 H22 N4 O4 -","- C23 H22 N4 O4 -","- C92 H88 N16 O16 -","4","1","","Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John","Molecular electrostatic potential dependent selectivity of hydrogen bonding","New J. Chem.","2015","39","2","822","","10.1039/C4NJ01324G","","","1.54178","CuKα","","0.0666","0.0417","","","0.1279","0.1494","","","","","","1.102","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054658","7.8846","0.0003","27.1172","0.0012","20.7714","0.0009","90","","90","","90","","4441.1","0.3","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H20 Cl F N4 O2 -","- C26 H20 Cl F N4 O2 -","- C208 H160 Cl8 F8 N32 O16 -","8","1","","Turkoglu, Gulsen; Berber, Halil; Kani, Ibrahim","Synthesis, crystal structure, optical and electrochemical properties of novel diphenylether-based formazan derivatives","New J. Chem.","2015","39","4","2728","","10.1039/C4NJ02353F","","","0.71073","MoKα","","0.1504","0.0522","","","0.1038","0.1506","","","","","","1.018","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054659","9.7435","0.0008","6.5523","0.0004","11.959","0.0012","90","","105.802","0.01","90","","734.64","0.11","295","2","295","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H19 N O3 -","- C15 H19 N O3 -","- C30 H38 N2 O6 -","2","1","","Rodríguez, Isabel; Calaza, M. Isabel; Jiménez, Ana I.; Cativiela, Carlos","Synthesis of enantiomerically pure δ-benzylproline derivatives","New J. Chem.","2015","39","5","3310","","10.1039/C4NJ01894J","","","0.71073","MoKα","","0.0848","0.059","","","0.1278","0.1465","","","","","","1.025","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054660","12.3453","0.0012","12.0038","0.0012","20.971","0.002","90","","90","","90","","3107.7","0.5","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C11 H17 N O9 Zn -","- C11 H17 N O9 Zn -","- C88 H136 N8 O72 Zn8 -","8","1","","Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.","Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction","New J. Chem.","2015","39","4","3004","","10.1039/C4NJ02371D","","","0.71073","MoKα","","0.0518","0.0422","","","0.1108","0.1186","","","","","","1.056","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054661","7.0755","0.0002","11.1714","0.0003","12.1991","0.0004","73.152","0.001","82.48","0.0009","72.042","0.001","877","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H21 N O11 Zn -","- C11 H21 N O11 Zn -","- C22 H42 N2 O22 Zn2 -","2","1","","Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.","Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction","New J. Chem.","2015","39","4","3004","","10.1039/C4NJ02371D","","","0.71073","MoKα","","0.0537","0.0467","","","0.1198","0.1258","","","","","","1.091","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054662","5.2989","0.0005","15.3102","0.0012","19.3432","0.0017","90","","90","","90","","1569.3","0.2","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H13 N O7 Zn -","- C15 H13 N O7 Zn -","- C60 H52 N4 O28 Zn4 -","4","1","","Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.","Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction","New J. Chem.","2015","39","4","3004","","10.1039/C4NJ02371D","","","0.71073","MoKα","","0.0343","0.0337","","","0.0883","0.0893","","","","","","1.063","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054663","8.9796","0.0017","10.1531","0.0016","10.6054","0.0018","89.721","0.007","77.398","0.007","71.835","0.006","894.5","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 N O9 Zn -","- C15 H17 N O9 Zn -","- C30 H34 N2 O18 Zn2 -","2","1","","Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.","Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction","New J. Chem.","2015","39","4","3004","","10.1039/C4NJ02371D","","","0.71073","MoKα","","0.0619","0.0405","","","0.094","0.103","","","","","","1.056","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054664","13.5334","0.0006","12.3004","0.0008","28.098","0.002","90","","102.177","0.006","90","","4572.1","0.5","294","2","294","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 Br N3 O -","- C11 H10 Br N3 O -","- C176 H160 Br16 N48 O16 -","16","4","","Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Mesías-Salazar, Angela; Zarate, Ximena; Schott, Eduardo","New 3,4,5-trisubstituted isoxazole derivatives with potential biological properties","New J. Chem.","2015","39","6","4295","","10.1039/C4NJ02427C","","","0.71073","MoKα","","0.1773","0.0789","","","0.1448","0.179","","","","","","1.056","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054665","11.765","0.004","11.314","0.006","17.774","0.012","90","","95.75","0.04","90","","2354","2","294","2","294","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C11 H10 N4 O3 -","- C11 H10 N4 O3 -","- C88 H80 N32 O24 -","8","1","","Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Mesías-Salazar, Angela; Zarate, Ximena; Schott, Eduardo","New 3,4,5-trisubstituted isoxazole derivatives with potential biological properties","New J. Chem.","2015","39","6","4295","","10.1039/C4NJ02427C","","x-ray","0.71073","MoKα","","0.1436","0.0576","","","0.1374","0.1615","","","","","","1.017","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054666","5.0508","0.0003","33.692","0.002","8.9618","0.0006","90","","100.081","0.006","90","","1501.5","0.16","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 N2 O S2 -","- C16 H16 N2 O S2 -","- C64 H64 N8 O4 S8 -","4","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan","Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study","New J. Chem.","2015","39","4","2778","","10.1039/C4NJ02225D","","","0.71073","MoKα","","0.1159","0.0629","","","0.1315","0.1606","","","","","","0.935","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054667","14.489","0.002","7.1442","0.001","21.09","0.003","90","","91.518","0.006","90","","2182.3","0.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Mo N2 O4 S2 -","- C20 H22 Mo N2 O4 S2 -","- C80 H88 Mo4 N8 O16 S8 -","4","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan","Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study","New J. Chem.","2015","39","4","2778","","10.1039/C4NJ02225D","","","0.71073","MoKα","","0.0461","0.0324","","","0.0982","0.114","","","","","","0.831","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054668","9.7755","0.0008","10.9369","0.0009","12.4981","0.001","99.619","0.003","96.272","0.003","90.833","0.004","1308.81","0.19","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H21 Cl3 Mo N4 O3 S2 -","- C21 H21 Cl3 Mo N4 O3 S2 -","- C42 H42 Cl6 Mo2 N8 O6 S4 -","2","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan","Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study","New J. Chem.","2015","39","4","2778","","10.1039/C4NJ02225D","","","0.71073","MoKα","","0.0522","0.0478","","","0.1629","0.1718","","","","","","1.022","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054669","14.272","0.004","11.291","0.003","14.874","0.004","90","","102.868","0.003","90","","2336.7","1.1","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 Mo N4 O3 S2 -","- C22 H22 Mo N4 O3 S2 -","- C88 H88 Mo4 N16 O12 S8 -","4","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan","Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study","New J. Chem.","2015","39","4","2778","","10.1039/C4NJ02225D","","","0.71073","MoKα","","0.1051","0.0503","","","0.0982","0.117","","","","","","0.986","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054670","7.505","0.003","13.022","0.005","14.463","0.005","106.162","0.004","101.97","0.004","105.956","0.004","1242.1","0.8","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23.33 H24.96 Mo N3 O4 S2 -","- C23.32 H24.96 Mo N3 O3.99 S2 -","- C46.64 H49.92 Mo2 N6 O7.98 S4 -","2","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan","Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study","New J. Chem.","2015","39","4","2778","","10.1039/C4NJ02225D","","","0.71073","MoKα","","0.0691","0.0471","","","0.1426","0.1742","","","","","","0.849","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054671","11.2231","0.0005","14.2627","0.0007","14.4636","0.0007","103.729","0.004","97.022","0.004","106.223","0.004","2114.93","0.19","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H19 Mo N3 O3 S2 -","- C21 H19 Mo N3 O3 S2 -","- C84 H76 Mo4 N12 O12 S8 -","4","2","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan","Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study","New J. Chem.","2015","39","4","2778","","10.1039/C4NJ02225D","","","0.71073","MoKα","","0.0459","0.0349","","","0.0785","0.0848","","","","","","1.004","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054672","14.8304","0.0011","19.0315","0.0014","12.5878","0.0009","90","","94.618","0.005","90","","3541.3","0.4","223","2","223","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","zwx","","","- C42 H80 N24 O28 -","- C42 H46 N24 O12 -","- C84 H92 N48 O24 -","2","0.25","","Zhao, Wenxuan; Wang, Chuanzeng; Zhang, Yunqian; Xue, Saifeng; Zhu, Qianjiang; Tao, Zhu","Supramolecular assembly of a methyl-substituted cucurbit[6]uril and its potential applications in selective sorption","New J. Chem.","2015","39","4","2433","","10.1039/C5NJ00255A","","","0.71073","MoKα","","0.1283","0.0837","","","0.2677","0.2994","","","","","","0.952","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054673","13.3215","0.001","12.3215","0.0009","16.7717","0.0012","90","","90","","90","","2752.9","0.3","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H18 Cu2 N10 O6 S2 -","- C24 H18 Cu2 N10 O6 S2 -","- C96 H72 Cu8 N40 O24 S8 -","4","0.5","","Hazra, Susanta; Karmakar, Anirban; Guedes da Silva, Maria de Fátima C.; Dlháň, L'ubor; Boča, Roman; Pombeiro, Armando J. L.","Sulfonated Schiff base dinuclear and polymeric copper(ii) complexes: crystal structures, magnetic properties and catalytic application in Henry reaction","New J. Chem.","2015","39","5","3424","","10.1039/C5NJ00330J","","","0.71069","MoKα","","0.0472","0.0366","","","0.0946","0.0989","","","","","","1.11","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054674","7.2488","0.0004","8.5638","0.0004","13.1244","0.0007","83.205","0.002","89.661","0.003","70.551","0.002","762.35","0.07","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H18 Cu2 N6 O6 S4 -","- C26 H18 Cu2 N6 O6 S4 -","- C26 H18 Cu2 N6 O6 S4 -","1","0.5","","Hazra, Susanta; Karmakar, Anirban; Guedes da Silva, Maria de Fátima C.; Dlháň, L'ubor; Boča, Roman; Pombeiro, Armando J. L.","Sulfonated Schiff base dinuclear and polymeric copper(ii) complexes: crystal structures, magnetic properties and catalytic application in Henry reaction","New J. Chem.","2015","39","5","3424","","10.1039/C5NJ00330J","","","0.71073","MoKα","","0.0563","0.0482","","","0.1219","0.1283","","","","","","1.085","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054675","8.5179","0.0006","15.1779","0.0007","12.2602","0.001","90","","92.219","0.003","90","","1583.86","0.19","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 Cu N5 O4 S -","- C14 H11 Cu N5 O4 S -","- C56 H44 Cu4 N20 O16 S4 -","4","1","","Hazra, Susanta; Karmakar, Anirban; Guedes da Silva, Maria de Fátima C.; Dlháň, L'ubor; Boča, Roman; Pombeiro, Armando J. L.","Sulfonated Schiff base dinuclear and polymeric copper(ii) complexes: crystal structures, magnetic properties and catalytic application in Henry reaction","New J. Chem.","2015","39","5","3424","","10.1039/C5NJ00330J","","","0.71069","MoKα","","0.0575","0.0438","","","0.1066","0.1119","","","","","","1.102","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054676","17.8522","0.0018","10.6611","0.0014","19.9365","0.0012","90","","106.854","0.002","90","","3631.4","0.6","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 Dy F12 N5 Ni O11 -","- C29 H28 Dy F12 N5 Ni O11 -","- C116 H112 Dy4 F48 N20 Ni4 O44 -","4","1","","Lu, Xing-Yun; Liu, Yu-Qing; Deng, Xiao-Wei; Zhu, Zhao-Xia; Yao, Min-Xia; Jing, Su","Synthesis, structures and magnetism of heterodinuclear Ni‒Ln complexes: field-induced single-molecule magnet behavior in the dysprosium analogue","New J. Chem.","2015","39","5","3467","","10.1039/C4NJ02162B","","","0.71073","MoKα","","0.0646","0.0602","","","0.15","0.1512","","","","","","1.076","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054677","18.351","0.003","10.8682","0.0015","19.911","0.003","90","","106.184","0.002","90","","3813.7","1","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 F12 Gd N5 Ni O11 -","- C29 H28 F12 Gd N5 Ni O11 -","- C116 H112 F48 Gd4 N20 Ni4 O44 -","4","1","","Lu, Xing-Yun; Liu, Yu-Qing; Deng, Xiao-Wei; Zhu, Zhao-Xia; Yao, Min-Xia; Jing, Su","Synthesis, structures and magnetism of heterodinuclear Ni‒Ln complexes: field-induced single-molecule magnet behavior in the dysprosium analogue","New J. Chem.","2015","39","5","3467","","10.1039/C4NJ02162B","","","0.71073","MoKα","","0.0671","0.0591","","","0.1517","0.1527","","","","","","1.062","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054678","17.8821","0.0014","10.8892","0.0011","20.0534","0.0018","90","","106.038","0.002","90","","3752.9","0.6","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 F12 N5 Ni O11 Tb -","- C29 H28 F12 N5 Ni O11 Tb -","- C116 H112 F48 N20 Ni4 O44 Tb4 -","4","1","","Lu, Xing-Yun; Liu, Yu-Qing; Deng, Xiao-Wei; Zhu, Zhao-Xia; Yao, Min-Xia; Jing, Su","Synthesis, structures and magnetism of heterodinuclear Ni‒Ln complexes: field-induced single-molecule magnet behavior in the dysprosium analogue","New J. Chem.","2015","39","5","3467","","10.1039/C4NJ02162B","","","0.71073","MoKα","","0.0603","0.0543","","","0.133","0.1336","","","","","","1.086","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054679","23.852","0.003","13.2551","0.0017","41.053","0.006","90","","104.55","0.002","90","","12563","3","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C61 H49 F9 N9 O8 Yb Zn -","- C61 H44 F9 N9 O8 Yb Zn -","- C488 H352 F72 N72 O64 Yb8 Zn8 -","8","1","","Yu, Chao; Zhang, Zhao; Liu, Lin; Li, Hongyan; He, Yani; Lü, Xingqiang; Wong, Wai-Kwok; Jones, Richard A.","PMMA-supported hybrid materials doped with highly near-infrared (NIR) luminescent complexes [Zn(L1)(Py)Ln(L2)3] (Ln = Nd, Yb or Er)","New J. Chem.","2015","39","5","3698","","10.1039/C4NJ02373K","","","0.71073","MoKα","","0.0954","0.0613","","","0.1431","0.158","","","","","","1.018","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054680","12.0156","0.0017","12.0304","0.0017","13.4566","0.0019","90","","102.37","0.003","90","","1900","0.5","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H27 I N2 Pt -","- C17 H27 I N2 Pt -","- C68 H108 I4 N8 Pt4 -","4","1","","Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine","Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines","New J. Chem.","2015","39","5","3536","","10.1039/C4NJ02426E","","","0.71073","MoKα","","0.0184","0.0146","","","0.0344","0.0359","","","","","","1.079","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054681","11.1252","0.0004","12.8648","0.0005","12.2536","0.0003","90","","98.742","0.002","90","","1733.4","0.1","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H23 I N2 Pt -","- C15 H23 I N2 Pt -","- C60 H92 I4 N8 Pt4 -","4","1","","Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine","Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines","New J. Chem.","2015","39","5","3536","","10.1039/C4NJ02426E","","","0.71073","MoKα","","0.022","0.0189","","","0.0398","0.041","","","","","","1.079","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054682","9.7124","0.0005","10.2867","0.0005","10.3892","0.0005","70.911","0.003","66.286","0.003","73.069","0.003","882.64","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; Lentz, Dieter; Schlecht, Sabine","Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines","New J. Chem.","2015","39","5","3536","","10.1039/C4NJ02426E","","","0.71073","MoKα","","0.0235","0.0215","","","0.0508","0.0514","","","","","","1.049","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054683","8.88211","0.00018","12.088","0.0002","22.6364","0.0005","90","","99.0938","0.0019","90","","2399.85","0.08","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; Lentz, Dieter; Schlecht, Sabine","Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines","New J. Chem.","2015","39","5","3536","","10.1039/C4NJ02426E","","","0.71073","MoKα","","0.0339","0.0302","","","0.0649","0.0669","","","","","","1.042","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054684","8.0595","0.0002","11.2505","0.0003","13.6434","0.0004","90","","106.09","0.003","90","","1188.63","0.06","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 I2 N4 Pt2 -","- C18 H26 I2 N4 Pt2 -","- C36 H52 I4 N8 Pt4 -","2","0.5","","Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine","Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines","New J. Chem.","2015","39","5","3536","","10.1039/C4NJ02426E","","","0.71073","MoKα","","0.0349","0.0331","","","0.0868","0.0887","","","","","","1.064","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054685","10.407","0.0009","11.7649","0.0006","20.7823","0.0017","90","","98.377","0.01","90","","2517.4","0.3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H32 I2 N2 O2 Pt2 -","- C18 H32 I2 N2 O2 Pt2 -","- C72 H128 I8 N8 O8 Pt8 -","4","1","","Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine","Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines","New J. Chem.","2015","39","5","3536","","10.1039/C4NJ02426E","","","0.71073","MoKα","","0.0334","0.0232","","","0.0493","0.0512","","","","","","0.928","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054686","10.7003","0.001","12.7871","0.0009","18.4091","0.0017","90","","90","","90","","2518.8","0.4","193","2","193","2","","","","","","","","5","P n a m","-P 2c 2n","62","","","","- C20 H36 I2 N2 Pt2 -","- C20 H36 I2 N2 Pt2 -","- C80 H144 I8 N8 Pt8 -","4","0.5","","Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine","Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines","New J. Chem.","2015","39","5","3536","","10.1039/C4NJ02426E","","","0.71073","MoKα","","0.0384","0.0351","","","0.0925","0.0947","","","","","","1.05","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054687","8.999","0.004","14.013","0.006","14.873","0.006","66.19","0.02","75.21","0.03","73.6","0.02","1624.6","1.2","296","2","296","2","","","","","","","","4","P 1","P 1","1","Boc-[Aib-R-Gamma-Leu]2-OMe","t-Butyloxycarbonyl-[alanyl-R-gamma-leucyl]2-methyl ester","","- C28 H52 N4 O7 -","- C28 H52 N4 O7 -","- C56 H104 N8 O14 -","2","2","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","0.71073","MoKα","","0.3763","0.0801","","","0.1281","0.2271","","","","","","0.849","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054688","10.6075","0.0003","10.735","0.0003","19.1418","0.0006","90","","105.348","0.002","90","","2101.97","0.11","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","Boc-[Leu-R-Gamma-Leu]2-OMe","t-Butyloxycarbonyl-[Leucyl-R-gamma-Leucyl]2-methyl ester","","- C34 H64 N4 O9 -","- C34 H64 N4 O9 -","- C68 H128 N8 O18 -","2","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","0.71073","MoKα","","0.0893","0.06","","","0.1604","0.1812","","","","","","1.095","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054689","9.5742","0.0002","10.8563","0.0003","28.0245","0.0007","90","","93.811","0.002","90","","2906.44","0.12","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","Boc-Leu-Leu-Val-DPro-Gly-Leu-Val-Val-OMe","t-Butyloxycarbonyl-Leucyl-Leucyl-Valyl-D-Prolyl-Glycyl-Leucyl-Valyl-Valyl-methyl ester","","- C49 H88 N8 O12 -","- C49 H88 N8 O12 -","- C98 H176 N16 O24 -","2","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","1.54178","CuKα","","0.0612","0.0577","","","0.17","0.1762","","","","","","1.128","","","","has coordinates,has disorder","180100","2020-10-21","18:00:00",""
"7054690","5.0768","0.0011","8.924","0.002","25.12","0.006","98.67","0.013","94.399","0.014","99.374","0.014","1104","0.4","296","2","296","2","","","","","","","","4","P 1","P 1","1","Boc-[Gamma-R-Leu]2-Delta-R-Leu-Gamma-R-Leu-OMe","t-Butyloxycarbonyl-[R-gamma-Leucyl]2-R-delta-Leucyl-R-gamma-Leucyl-methyl ester","","- C39 H74 N4 O7 -","- C39 H74 N4 O7 -","- C39 H74 N4 O7 -","1","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","0.71073","MoKα","","0.1583","0.0701","","","0.1818","0.2308","","","","","","0.994","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054691","5.0056","0.0014","15.829","0.004","20.317","0.005","90","","93.452","0.018","90","","1606.9","0.7","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","Boc-[Gamma-R-Val]3-NHMe","t-Butyloxycarbonyl-[R-gamma-valyl]3-N-methyl amide","","- C27 H52 N4 O5 -","- C27 H52 N4 O5 -","- C54 H104 N8 O10 -","2","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","0.71073","MoKα","","0.3121","0.1433","","","0.3135","0.3742","","","","","","1.087","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054692","5.1643","0.0002","30.0027","0.0011","7.5724","0.0003","90","","94.261","0.002","90","","1170.05","0.08","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","Boc-[Gamma-R-Val]2-OMe","t-Butyloxycarbonyl-[gamma-R-Valyl]2-methyl ester","","- C20 H38 N2 O5 -","- C20 H38 N2 O5 -","- C40 H76 N4 O10 -","2","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","1.54178","CuKα","","0.0765","0.0622","","","0.1756","0.2106","","","","","","1.074","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054693","5.1182","0.0003","50.153","0.003","7.4046","0.0004","90","","97.675","0.004","90","","1883.68","0.19","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","Boc-[Gamma-R-Val]4-OMe","t-Butyloxycarbonyl-[R-gamma-Valyl]4-methyl ester","","- C34 H64 N4 O7 -","- C34 H64 N4 O7 -","- C68 H128 N8 O14 -","2","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","1.54178","CuKα","","0.1048","0.0956","","","0.2571","0.274","","","","","","1.195","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054694","28.9383","0.0008","5.1419","0.0001","18.4128","0.0005","90","","120.323","0.001","90","","2364.96","0.11","296","2","296","2","","","","","","","","4","C 1 2 1","C 2y","5","Boc-Gamma-S-Val-Gamma-R-Val-OMe","t-Butyloxycarbonyl-gamma-S-Valyl-gamma-R-Valyl-methyl ester","","- C20 H38 N2 O5 -","- C20 H38 N2 O5 -","- C80 H152 N8 O20 -","4","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","1.54178","CuKα","","0.0522","0.0499","","","0.1485","0.1496","","","","","","1.143","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054695","9.901","0.002","10.527","0.003","10.553","0.002","100.403","0.012","106.665","0.013","93.047","0.014","1029.9","0.4","296","2","296","2","","","","","","","","4","P 1","P 1","1","Boc-[Aib-S-Gamma-Val]2-OMe","t-Butyloxycarbonyl-[alpha Amino isobutyryl-S-gamma-leucyl]2-methyl ester","","- C33 H63 N5 O8 -","- C33 H63 N5 O8 -","- C33 H63 N5 O8 -","1","1","","M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.","Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences","New J. Chem.","2015","39","5","3319","","10.1039/C5NJ00132C","","","0.71073","MoKα","","0.2325","0.0856","","","0.2109","0.2875","","","","","","0.905","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054696","18.57","0.0014","10.3191","0.0007","17.2851","0.0014","90","","133.39","0.005","90","","2407","0.4","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2,2'-(ethylenedioxy)bis-(ethylamine))Cadmium(II) tetracyano palladate (II)","","- C16 H32 Cd N8 O4 Pd -","- C16 H32 Cd N8 O4 Pd -","- C64 H128 Cd4 N32 O16 Pd4 -","4","0.5","","Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer","Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations","New J. Chem.","2015","39","5","3675","","10.1039/C5NJ00071H","","","0.71073","MoKα","","0.0437","0.0403","","","0.097","0.0993","","","","","","1.1","","","","has coordinates","209363","2020-10-21","18:00:00",""
"7054697","11.463","0.001","8.9492","0.0008","14.7436","0.0013","90","","90","","90","","1512.5","0.2","293","2","293","","","","","","","","","6","P b c n","-P 2n 2ab","60","","(2,2'-(ethylenedioxy)bis-(ethylamine))zinc(II) tetracyanidonickelate(II)","","- C10 H16 N6 Ni O2 Zn -","- C10 H16 N6 Ni O2 Zn -","- C40 H64 N24 Ni4 O8 Zn4 -","4","0.5","","Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer","Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations","New J. Chem.","2015","39","5","3675","","10.1039/C5NJ00071H","","","0.71073","MoKα","","0.0439","0.0349","","","0.0823","0.0863","","","","","","1.069","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054698","10.8081","0.0005","10.4606","0.0004","14.2364","0.0005","90","","107.209","0.003","90","","1537.5","0.11","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(2,2'-(ethylenedioxy)bis-(ethylamine))cadmium(II) tetracyanonickelate(II)","","- C10 H16 Cd N6 Ni O2 -","- C10 H16 Cd N6 Ni O2 -","- C40 H64 Cd4 N24 Ni4 O8 -","4","0.5","","Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer","Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations","New J. Chem.","2015","39","5","3675","","10.1039/C5NJ00071H","","","0.71073","MoKα","","0.0185","0.018","","","0.0408","0.041","","","","","","1.231","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054699","9.6656","0.0004","14.9615","0.0004","17.9211","0.0005","90","0.005","90","0.005","90","0.005","2591.6","0.15","293","2","293","2","","","","","","","synthesis as described","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H36 Cd N8 Ni O6 -","- C16 H36 Cd N8 Ni O6 -","- C64 H144 Cd4 N32 Ni4 O24 -","4","1","","Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer","Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations","New J. Chem.","2015","39","5","3675","","10.1039/C5NJ00071H","","x-ray","0.71073","MoKα","","0.0342","0.0291","","","0.0616","0.0644","","","","","","1.07","","","","has coordinates","180100","2020-10-21","18:00:00",""
"7054700","8.5367","0.0006","8.8067","0.0006","10.1596","0.0007","106.505","0.006","92.538","0.006","97.889","0.006","722.6","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H32 Be2 N4 O6 -","- C32 H32 Be2 N4 O6 -","- C32 H32 Be2 N4 O6 -","1","0.5","","Reglinski, John; Kennedy, Alan R.; Steel, Graham","Tetradentate Schiff base beryllium complexes","New J. Chem.","2015","39","4","2437","","10.1039/C4NJ01949K","","","0.71073","MoKα","","0.0485","0.0361","","","0.0869","0.0934","","","","","","1.028","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054701","7.6771","0.001","17.9229","0.001","11.3182","0.0012","90","","98.385","0.014","90","","1540.7","0.3","123","2","123","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C18 H18 Be N2 O2 -","- C18 H18 Be N2 O2 -","- C72 H72 Be4 N8 O8 -","4","1","","Reglinski, John; Kennedy, Alan R.; Steel, Graham","Tetradentate Schiff base beryllium complexes","New J. Chem.","2015","39","4","2437","","10.1039/C4NJ01949K","","","0.71073","MoKα","","0.0603","0.0445","","","0.0847","0.0931","","","","","","1.039","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054702","7.4296","0.0005","19.375","0.002","22.676","0.0018","90","","90","","90","","3264.2","0.5","298","2","298","2","","","","","","","","5","P b n a","-P 2ac 2b","60","","","","- C18 H16 N2 O2 S -","- C18 H16 N2 O2 S -","- C144 H128 N16 O16 S8 -","8","1","","Salahifar, Eslam; Nematollahi, Davood","Electrochemical generation of a Michael acceptor: a green method for the synthesis of 4-amino-3-(phenylsulfonyl)diphenylamine derivatives","New J. Chem.","2015","39","5","3852","","10.1039/C5NJ00087D","","","0.71073","MoKα","","0.2351","0.0882","","","0.1063","0.145","","","","","","1.009","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7054703","10.1735","0.0011","14.3043","0.001","11.2897","0.0009","90","","96.376","0.008","90","","1632.8","0.2","292.34","0.1","292.34","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Quinolinone","3,7,7-trimethyl-4-phenyl-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-b]quinolin-5(4H)-one","","- C19 H21 N3 O -","- C19 H21 N3 O -","- C76 H84 N12 O4 -","4","1","","Singh, Nongthombam Geetmani; Nagarajaprakash, Rammamorthy; Rani, Jims World Star; Kathing, Chingrishon; Nongrum, Ridaphun; Nongkhlaw, Rishanlang","Nickel nanoparticles assisted regioselective synthesis of pyrazoloquinolinone and triazoloquinazolinone derivatives","New J. Chem.","2015","39","5","3908","","10.1039/C4NJ02372B","","","0.71073","MoKα","","0.1132","0.0588","","","0.1376","0.1646","","","","","","0.964","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054704","6.0023","0.0011","12.317","0.002","12.46","0.002","67.981","0.017","77.245","0.015","80.977","0.015","830.1","0.3","291.9","0.9","291.9","0.9","","","","","","","","5","P -1","-P 1","2","Quinazolinone","9-(4-chlorophenyl)-6,6-dimethyl-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one","","- C17 H17 Cl N4 O -","- C17 H17 Cl N4 O -","- C34 H34 Cl2 N8 O2 -","2","1","","Singh, Nongthombam Geetmani; Nagarajaprakash, Rammamorthy; Rani, Jims World Star; Kathing, Chingrishon; Nongrum, Ridaphun; Nongkhlaw, Rishanlang","Nickel nanoparticles assisted regioselective synthesis of pyrazoloquinolinone and triazoloquinazolinone derivatives","New J. Chem.","2015","39","5","3908","","10.1039/C4NJ02372B","","","0.7107","MoKα","","0.084997","0.053494","","","","0.140108","","","","","","1.03577","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054705","18.628","0.003","7.56","0.0012","14.269","0.002","90","","119.874","0.002","90","","1742.5","0.5","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H9 Cd N5 O3 -","- C5 H9 Cd N5 O3 -","- C40 H72 Cd8 N40 O24 -","8","1","","Salinas-Castillo, Alfonso; Calahorro, Antonio Jesús; Briones Gil, David; Fairen-Jimenez, David; gandara, felipe; Mendicute-Fierro, Claudio; Seco, José M; Perez-Mendoza, Manuel; Fernández, Belén; Rodriguez-Dieguez, Antonio","Adsorption and Luminescence Properties of First 2D-Cadmium MOF and Gismondine-Like Zinc Coordination Network Based on N-(2-tetrazolethyl)-4'-Glycine Linker","New J. Chem.","2015","","","","","10.1039/C5NJ00011D","","","0.71073","MoKα","","0.0216","0.0204","","","0.0487","0.0496","","","","","","1.075","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054706","21.71","0.003","21.71","0.003","6.8793","0.0011","90","","90","","90","","3242.4","0.8","273","2","273","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C5 H7 N5 O2 Zn -","- C5 H7 N5 O2 Zn -","- C80 H112 N80 O32 Zn16 -","16","1","","Salinas-Castillo, Alfonso; Calahorro, Antonio Jesús; Briones Gil, David; Fairen-Jimenez, David; gandara, felipe; Mendicute-Fierro, Claudio; Seco, José M; Perez-Mendoza, Manuel; Fernández, Belén; Rodriguez-Dieguez, Antonio","Adsorption and Luminescence Properties of First 2D-Cadmium MOF and Gismondine-Like Zinc Coordination Network Based on N-(2-tetrazolethyl)-4'-Glycine Linker","New J. Chem.","2015","","","","","10.1039/C5NJ00011D","","","0.71073","MoKα","","0.048","0.0381","","","0.0946","0.1001","","","","","","1.069","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054707","12.3263","0.0001","20.7018","0.0002","18.2517","0.0002","90","","91.642","0.001","90","","4655.49","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C102 H90 N16 O19 Pb2 Tb -","- C102 H90 N16 O19 Pb2 Tb -","- C204 H180 N32 O38 Pb4 Tb2 -","2","0.5","","Pan, Mei; Yan, Cheng; Chen, Ling; Zhang, Lu-Yin; Yin, Shao-Yun; Zhu, Yi-Xuan; Wu, Kai; Hou, Ya-Jun; Su, Cheng-Yong","Photoluminescence and white-light emission in two series of heteronuclear Pb(ii)‒Ln(iii) complexes","New J. Chem.","2015","39","5","3770","","10.1039/C5NJ00168D","","","1.54178","CuKα","","0.0433","0.04","","","0.1097","0.1139","","","","","","1.058","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054708","12.31597","0.00016","20.8623","0.0002","18.2267","0.0002","90","","91.689","0.0011","90","","4681.12","0.09","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C102 H90 Eu N16 O19 Pb2 -","- C102 H90 Eu N16 O19 Pb2 -","- C204 H180 Eu2 N32 O38 Pb4 -","2","0.5","","Pan, Mei; Yan, Cheng; Chen, Ling; Zhang, Lu-Yin; Yin, Shao-Yun; Zhu, Yi-Xuan; Wu, Kai; Hou, Ya-Jun; Su, Cheng-Yong","Photoluminescence and white-light emission in two series of heteronuclear Pb(ii)‒Ln(iii) complexes","New J. Chem.","2015","39","5","3770","","10.1039/C5NJ00168D","","","1.54184","CUKα","","0.0412","0.0361","","","0.109","0.1162","","","","","","0.883","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054709","11.7061","0.0005","13.0527","0.0004","17.955","0.0008","87.73","0.003","88.01","0.004","89.886","0.003","2739.65","0.19","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C108 H100 N20 O28 Pb Tb2 -","- C108 H100 N20 O28 Pb Tb2 -","- C108 H100 N20 O28 Pb Tb2 -","1","0.5","","Pan, Mei; Yan, Cheng; Chen, Ling; Zhang, Lu-Yin; Yin, Shao-Yun; Zhu, Yi-Xuan; Wu, Kai; Hou, Ya-Jun; Su, Cheng-Yong","Photoluminescence and white-light emission in two series of heteronuclear Pb(ii)‒Ln(iii) complexes","New J. Chem.","2015","39","5","3770","","10.1039/C5NJ00168D","","","1.54178","CuKα","","0.0451","0.041","","","0.1074","0.1119","","","","","","1.079","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054710","11.0785","0.0012","11.9068","0.0013","16.6733","0.0018","76.422","0.002","75.205","0.002","79.014","0.002","2047","0.4","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H42 Cl2 N8 O10 Ru S -","- C36 H42 Cl2.001 N8 O10 Ru S -","- C72 H84 Cl4.002 N16 O20 Ru2 S2 -","2","1","","Bhat, Satish S.; Revankar, Vidyanand K.; Khan, Ayesha; Butcher, Raymond J.; Thatipamula, Krishnachary","Supramolecular architecture and photophysical and biological properties of ruthenium(ii) polypyridyl complexes","New J. Chem.","2015","39","5","3646","","10.1039/C4NJ02394C","","","0.71073","MoKα","","0.0951","0.0786","","","0.1781","0.1863","","","","","","1.112","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054711","10.6473","0.0019","19.752","0.004","13.407","0.0016","90","","113.396","0.01","90","","2587.7","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 Cu Mo4 N6 O14 -","- C18 H15 Cu Mo4 N6 O14 -","- C72 H60 Cu4 Mo16 N24 O56 -","4","1","","Li, Shaobin; Zhang, Li; Ma, Huiyuan; Pang, Haijun; Zhao, Chunyan","Tuning the topology structures of polymolybdate-based hybrids from interpenetrated framework to interdigitated architecture via changing polymolybdate clusters","New J. Chem.","2015","39","5","3528","","10.1039/C5NJ00238A","","","0.71073","MoKα","","0.1045","0.0553","","","0.0995","0.1145","","","","","","1.03","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054712","11.158","0.005","12.946","0.005","13.292","0.005","97.478","0.005","112.381","0.005","104.018","0.005","1668.8","1.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H40 Cu Mo12 N12 O44 P -","- C36 H36 Cu Mo12 N12 O44 P -","- C36 H36 Cu Mo12 N12 O44 P -","1","0.5","","Li, Shaobin; Zhang, Li; Ma, Huiyuan; Pang, Haijun; Zhao, Chunyan","Tuning the topology structures of polymolybdate-based hybrids from interpenetrated framework to interdigitated architecture via changing polymolybdate clusters","New J. Chem.","2015","39","5","3528","","10.1039/C5NJ00238A","","","0.71069","MoKα","","0.0994","0.0716","","","0.1931","0.2236","","","","","","1.024","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054713","10.9784","0.0009","14.048","0.0011","14.5469","0.0012","110.234","0.002","107.408","0.001","102.658","0.001","1873.7","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H44 Cu4 Mo12 N16 O42 Si -","- C48 H40 Cu4 Mo12 N16 O42 Si -","- C48 H40 Cu4 Mo12 N16 O42 Si -","1","0.5","","Li, Shaobin; Zhang, Li; Ma, Huiyuan; Pang, Haijun; Zhao, Chunyan","Tuning the topology structures of polymolybdate-based hybrids from interpenetrated framework to interdigitated architecture via changing polymolybdate clusters","New J. Chem.","2015","39","5","3528","","10.1039/C5NJ00238A","","","0.71073","MoKα","","0.0902","0.0534","","","0.0944","0.1073","","","","","","1.041","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054714","5.0156","0.0005","6.9262","0.0009","7.0836","0.0008","112.956","0.012","97.227","0.01","107.388","0.011","207.85","0.05","118","2","118","2","","","","","","","","3","P -1","-P 1","2","0D-118","But-2-ynoic acid triclinic polymorph","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.0784","0.0538","","","0.1368","0.163","","","","","","1.052","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054715","5.0359","0.0009","6.9758","0.0013","7.1152","0.0013","112.963","0.018","97.033","0.016","107.706","0.017","210.8","0.08","154","2","154","2","","","","","","","","3","P -1","-P 1","2","0D-154","But-2-ynoic acid triclinic polymorph","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.0876","0.0575","","","0.1436","0.1719","","","","","","1.017","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054716","5.058","0.0009","7.0169","0.0017","7.1325","0.0015","112.92","0.02","96.962","0.017","108.002","0.019","213.14","0.1","190","2","190","2","","","","","","","","3","P -1","-P 1","2","0D-190","","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.1055","0.064","","","0.1663","0.2136","","","","","","1.065","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054717","5.0673","0.0008","7.0638","0.0013","7.163","0.0009","113.064","0.016","96.689","0.012","108.347","0.015","215.3","0.07","226","2","226","2","","","","","","","","3","P -1","-P 1","2","0D-226","But-2-ynoic acid triclinic polymorph","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.0997","0.0605","","","0.1695","0.2071","","","","","","1.081","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054718","3.9158","0.0011","7.1104","0.001","7.871","0.003","90","","100.59","0.03","90","","215.42","0.11","262","2","262","2","","","","","","","","3","P 1 21 1","P 2yb","4","0D-262","But-2-ynoic acid","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.1392","0.0633","","","0.1602","0.1981","","","","","","1.099","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054719","3.8248","0.0008","7.0987","0.0007","7.7801","0.0009","90","","101.058","0.015","90","","207.32","0.05","118","2","118","2","","","","","","","","3","P 1 21 1","P 2yb","4","","But-2-ynoic acid","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.0449","0.04","","","0.0929","0.0973","","","","","","1.09","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054720","3.8518","0.0005","7.0956","0.0005","7.7924","0.0009","90","","100.862","0.012","90","","209.16","0.04","154","2","154","2","","","","","","","","3","P 1 21 1","P 2yb","4","1D-154","But-2-ynoic acid","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","x-ray","0.71073","MoKα","","0.0526","0.0426","","","0.0944","0.1019","","","","","","1.086","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054721","3.8856","0.0013","7.1138","0.0012","7.8353","0.0016","90","","100.93","0.03","90","","212.65","0.09","190","2","190","2","","","","","","","","3","P 1 21 1","P 2yb","4","1D-190","But-2-ynoic acid","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","x-ray","0.71073","MoKα","","0.0558","0.0436","","","0.1003","0.1079","","","","","","1.04","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054722","3.8912","0.001","7.1141","0.0012","7.8453","0.0016","90","","100.8","0.02","90","","213.33","0.08","226","2","226","2","","","","","","","","3","P 1 21 1","P 2yb","4","1D-226","But-2-ynoic acid","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.0615","0.0464","","","0.1004","0.1123","","","","","","1.044","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054723","3.9127","0.0007","7.1074","0.0008","7.8489","0.0011","90","","100.422","0.016","90","","214.67","0.06","262","2","262","2","","","","","","","","3","P 1 21 1","P 2yb","4","1D-262","But-2-ynoic acid","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","x-ray","0.71073","MoKα","","0.0679","0.046","","","0.1033","0.1229","","","","","","1.075","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054724","3.9417","0.0012","7.1096","0.0018","7.878","0.003","90","","100.25","0.03","90","","217.25","0.12","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","1D-298","But-2-ynoic acid","","- C4 H4 O2 -","- C4 H4 O2 -","- C8 H8 O4 -","2","1","","Saraswatula, Viswanadha G.; Bhattacharya, Suman; Saha, Binoy K.","Can the thermal expansion be controlled by varying the hydrogen bond dimensionality in polymorphs?","New J. Chem.","2015","39","5","3345","","10.1039/C5NJ00196J","","","0.71073","MoKα","","0.0992","0.0513","","","0.0987","0.1218","","","","","","1.012","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054725","8.9476","0.0008","10.2758","0.0009","12.1482","0.0011","98.043","0.004","95.114","0.004","110.648","0.004","1023.3","0.16","150","2","150","2","","","","","","","","5","P -1","-P 1","2","phthalonitrile","","","- C20 H28 N2 O S2 -","- C20 H28 N2 O S2 -","- C40 H56 N4 O2 S4 -","2","1","","Tarakci, Deniz Kutlu; Berber, Savaş; Zorlu, Yunus; Atilla, Devrim; Ahsen, Vefa; Dumoulin, Fabienne","The synthesis of an octasubstituted monohydroxylated phthalocyanine designed to investigate the effect of the presence of active moieties","New J. Chem.","2015","39","5","3929","","10.1039/C5NJ00229J","","","0.71073","MoKα","","0.0557","0.0512","","","0.1429","0.1467","","","","","","1.059","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054726","8.8012","0.0005","13.0262","0.0008","25.0491","0.0015","90","","90","","90","","2871.8","0.3","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H15 N4 O6 P -","- C10 H15 N4 O6 P -","- C80 H120 N32 O48 P8 -","8","1","","Gholivand, Khodayar; Molaei, Foroogh","Synthesis and structural study of some new phosphorus(v) hydrazide compounds: spectroscopic evidence and a theoretical approach","New J. Chem.","2015","39","5","3747","","10.1039/C5NJ00135H","","","0.71073","MoKα","","0.0434","0.034","","","0.0871","0.0925","","","","","","1.062","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054727","5.757","0.0002","8.9928","0.0003","14.7059","0.0006","78.99","0.001","86.504","0.001","87.806","0.001","745.67","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H15 N2 O5 P -","- C14 H15 N2 O5 P -","- C28 H30 N4 O10 P2 -","2","1","","Gholivand, Khodayar; Molaei, Foroogh","Synthesis and structural study of some new phosphorus(v) hydrazide compounds: spectroscopic evidence and a theoretical approach","New J. Chem.","2015","39","5","3747","","10.1039/C5NJ00135H","","","0.71073","MoKα","","0.0339","0.032","","","0.089","0.091","","","","","","1.041","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054728","12.2908","0.0007","7.0588","0.0004","17.6586","0.001","90","","109.425","0.001","90","","1444.82","0.14","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H15 N4 O5 P -","- C10 H15 N4 O5 P -","- C40 H60 N16 O20 P4 -","4","1","","Gholivand, Khodayar; Molaei, Foroogh","Synthesis and structural study of some new phosphorus(v) hydrazide compounds: spectroscopic evidence and a theoretical approach","New J. Chem.","2015","39","5","3747","","10.1039/C5NJ00135H","","","0.71073","MoKα","","0.0394","0.0361","","","0.0826","0.0849","","","","","","1.001","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054729","11.2664","0.0018","13.069","0.002","13.687","0.002","90","","90.327","0.001","90","","2015.2","0.5","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H19 Cl N4 O4 -","- C20 H19 Cl N4 O4 -","- C80 H76 Cl4 N16 O16 -","4","1","","Senwar, Kishna Ram; Sharma, Pankaj; Nekkanti, Shalini; Manda, Sathish; Kamal, Ahmed; Balasubramanian, Sridhar; Nagula, Shankaraiah","One-pot ‘click’ reaction from spiro-epoxides catalyzed by Cu(I)-pyrrolidinyl-oxazole-carboxamide","New J. Chem.","2015","","","","","10.1039/C4NJ02131B","","","0.71073","MoKα","","0.0616","0.0512","","","0.1374","0.1475","","","","","","1.025","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054730","14.632","0.005","15.057","0.005","15.61","0.005","85.153","0.005","63.131","0.005","86.091","0.005","3055.1","1.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C68 H64 Cl6 N4 O4 Sn -","- C68 H64 Cl6 N4 O4 Sn -","- C136 H128 Cl12 N8 O8 Sn2 -","2","1","","Dey, Soumyajit; Mondal, Pritam; Rath, Sankar Prasad","Aggregation-Controlled Excimer Emission in an Axial Anthracene-Sn(IV)Porphyrin-Anthracene Triad in Solid and Solution Phases","New J. Chem.","2015","","","","","10.1039/C4NJ02405B","","","0.71069","MoKα","","0.0612","0.0455","","","0.0962","0.109","","","","","","1.031","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054731","12.2454","0.0014","14.3018","0.0016","14.9082","0.0017","71.876","0.002","69.05","0.003","71.933","0.003","2258.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H31 Cl Ni O3 P2 -","- C18 H31 Cl Ni O3 P2 -","- C72 H124 Cl4 Ni4 O12 P8 -","4","2","","García-Eleno, Marco A.; Padilla-Mata, Esteban; Estudiante-Negrete, Fabiola; Pichal-Cerda, Francisco; Hernández-Ortega, Simón; Toscano, Rubén A.; Morales-Morales, David","Single step, high yield synthesis of para-hydroxy functionalized POCOP ligands and their Ni(ii) pincer derivatives","New J. Chem.","2015","39","5","3361","","10.1039/C5NJ00052A","","","0.71073","MoKα","","0.0684","0.0458","","","0.1007","0.1118","","","","","","1.026","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054732","10.159","0.0011","20.23","0.002","13.9587","0.0015","90","","102.917","0.002","90","","2796.2","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22.5 H40 Cl2 Ni O3 P2 -","- C22.5 H40 Cl2 Ni O3 P2 -","- C90 H160 Cl8 Ni4 O12 P8 -","4","1","","García-Eleno, Marco A.; Padilla-Mata, Esteban; Estudiante-Negrete, Fabiola; Pichal-Cerda, Francisco; Hernández-Ortega, Simón; Toscano, Rubén A.; Morales-Morales, David","Single step, high yield synthesis of para-hydroxy functionalized POCOP ligands and their Ni(ii) pincer derivatives","New J. Chem.","2015","39","5","3361","","10.1039/C5NJ00052A","","","0.71073","MoKα","","0.07","0.0506","","","0.1141","0.1233","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054733","15.125","0.002","10.058","0.001","17.403","0.002","90","","90.493","0.002","90","","2647.4","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H23 Cl Ni O3 P2 -","- C30 H23 Cl Ni O3 P2 -","- C120 H92 Cl4 Ni4 O12 P8 -","4","1","","García-Eleno, Marco A.; Padilla-Mata, Esteban; Estudiante-Negrete, Fabiola; Pichal-Cerda, Francisco; Hernández-Ortega, Simón; Toscano, Rubén A.; Morales-Morales, David","Single step, high yield synthesis of para-hydroxy functionalized POCOP ligands and their Ni(ii) pincer derivatives","New J. Chem.","2015","39","5","3361","","10.1039/C5NJ00052A","","","0.71073","MoKα","","0.063","0.0413","","","0.0808","0.0861","","","","","","0.886","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054734","8.0299","0.0015","27.236","0.005","15.128","0.003","90","","101.306","0.004","90","","3244.3","1.1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H43 Cl Ni O4 P2 -","- C29 H43 Cl Ni O4 P2 -","- C116 H172 Cl4 Ni4 O16 P8 -","4","1","","García-Eleno, Marco A.; Padilla-Mata, Esteban; Estudiante-Negrete, Fabiola; Pichal-Cerda, Francisco; Hernández-Ortega, Simón; Toscano, Rubén A.; Morales-Morales, David","Single step, high yield synthesis of para-hydroxy functionalized POCOP ligands and their Ni(ii) pincer derivatives","New J. Chem.","2015","39","5","3361","","10.1039/C5NJ00052A","","","0.71073","MoKα","","0.1174","0.0525","","","0.0691","0.0817","","","","","","0.826","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054735","12.2454","0.0014","14.3018","0.0016","14.9082","0.0017","71.876","0.002","69.05","0.003","71.933","0.003","2258.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H31 Cl Ni O3 P2 -","- C18 H31 Cl Ni O3 P2 -","- C72 H124 Cl4 Ni4 O12 P8 -","4","2","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.0684","0.0458","","","0.1007","0.1118","","","","","","1.026","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054736","10.159","0.0011","20.23","0.002","13.9587","0.0015","90","","102.917","0.002","90","","2796.2","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22.5 H40 Cl2 Ni O3 P2 -","- C22.5 H40 Cl2 Ni O3 P2 -","- C90 H160 Cl8 Ni4 O12 P8 -","4","1","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.07","0.0506","","","0.1141","0.1233","","","","","","1.032","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7054737","15.125","0.002","10.058","0.001","17.403","0.002","90","","90.493","0.002","90","","2647.4","0.5","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H23 Cl Ni O3 P2 -","- C30 H23 Cl Ni O3 P2 -","- C120 H92 Cl4 Ni4 O12 P8 -","4","1","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.063","0.0413","","","0.0808","0.0861","","","","","","0.886","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054738","8.0299","0.0015","27.236","0.005","15.128","0.003","90","","101.306","0.004","90","","3244.3","1.1","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H43 Cl Ni O4 P2 -","- C29 H43 Cl Ni O4 P2 -","- C116 H172 Cl4 Ni4 O16 P8 -","4","1","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.1174","0.0525","","","0.0691","0.0817","","","","","","0.826","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054739","6.7436","0.0003","8.14","0.0003","13.7971","0.0005","103.904","0.004","97.539","0.003","95.474","0.004","722.45","0.05","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H13 N2 O8 V -","- C12 H13 N2 O8 V -","- C24 H26 N4 O16 V2 -","2","1","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","1.54184","CuKα","","0.0402","0.0395","","","0.1105","0.1114","","","","","","1.044","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054740","7.9144","0.0003","12.5749","0.0007","13.4045","0.0006","88.379","0.003","89.985","0.002","74.931","0.003","1287.63","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H9 N2 O6 V -","- C12 H9 N2 O6 V -","- C48 H36 N8 O24 V4 -","4","2","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.1365","0.0532","","","0.1162","0.1504","","","","","","0.964","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054741","7.8481","0.0002","6.421","0.0001","13.8887","0.0003","90","","95.055","0.002","90","","697.17","0.03","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C12 H11 N2 O8 V -","- C12 H11 N2 O8 V -","- C24 H22 N4 O16 V2 -","2","0.5","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","1.54184","CuKα","","0.0335","0.0333","","","0.0913","0.0916","","","","","","1.089","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054742","8.1855","0.0002","6.5443","0.0002","13.8669","0.0003","90","","97.755","0.002","90","","736.03","0.03","150","2","150","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C12 H12 N3 O7 V -","- C12 H12 N3 O7 V -","- C24 H24 N6 O14 V2 -","2","0.5","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","1.54184","CuKα","","0.0367","0.0362","","","0.1009","0.1018","","","","","","1.058","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054743","14.4966","0.0003","7.3713","0.0002","14.6252","0.0003","90","","118.696","0.001","90","","1370.88","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N3 O6 V -","- C12 H10 N3 O6 V -","- C48 H40 N12 O24 V4 -","4","1","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.0412","0.032","","","0.0866","0.0933","","","","","","1.063","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054744","8.1715","0.0001","29.4539","0.0005","6.6398","0.0001","90","","90","","90","","1598.08","0.04","293","2","293","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C14 H16 N3 O7 V -","- C14 H16 N3 O7 V -","- C56 H64 N12 O28 V4 -","4","0.5","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.0429","0.0323","","","0.0825","0.0879","","","","","","1.054","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054745","9.3492","0.0009","12.426","0.0005","6.436","0.0007","90","","129.421","0.017","90","","577.59","0.17","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C10 H8 N3 O6 V -","- C10 H8 N3 O6 V -","- C20 H16 N6 O12 V2 -","2","0.5","","Koleša-Dobravc, Tanja; Meden, Anton; Perdih, Franc","Influence of noncovalent interactions on the structures of metal‒organic hybrids based on a [VO2(2,6-pydc)]−tecton with cations of imidazole, pyridine and its derivatives","New J. Chem.","2015","39","6","4265","","10.1039/C5NJ00164A","","","0.71073","MoKα","","0.0232","0.0226","","","0.0535","0.0548","","","","","","1.102","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054746","10.7251","0.0002","11.4534","0.0002","16.074","0.0003","95.3842","0.0007","108.666","0.0007","97.8766","0.0008","1832.96","0.06","295","","295","","","","","","","","","7","P -1","-P 1","2","","","","- C20 H46 Co2 K2 N8 O12 S3 -","- C20 H46 Co2 K2 N8 O12 S3 -","- C40 H92 Co4 K4 N16 O24 S6 -","2","1","","Strianese, Maria; Mirra, Silvia; Bertolasi, Valerio; Milione, Stefano; Pellecchia, Claudio","Organometallic sulfur complexes: reactivity studies of hydrogen sulfide anion with cobaloximes","New J. Chem.","2015","","","","","10.1039/C5NJ00206K","","","0.71073","MoKα","","0.049","0.0355","","","0.092","0.0971","","","","","","1.047","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054747","13.3088","0.0002","6.012","0.0001","19.833","0.0002","90","","108.647","0.0014","90","","1503.59","0.04","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-((4-phenylpiperazin-1-yl)methyl)phenylboronic acid","","- C17 H21 B N2 O2 -","- C17 H21 B N2 O2 -","- C68 H84 B4 N8 O8 -","4","1","","Adamczyk-Woźniak, Agnieszka; Czerwińska, Karolina; Madura, Izabela D.; Matuszewska, Alicja; Sporzyński, Andrzej; Żubrowska-Zembrzuska, Anna","Piperazine derivatives of boronic acids ‒ potential bifunctional biologically active compounds","New J. Chem.","2015","39","6","4308","","10.1039/C5NJ00084J","","","0.7107","MoKα","","0.0365","0.0345","","","0.0919","0.0931","","","","","","1.043","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054748","12.1978","0.0003","19.2053","0.0005","15.5424","0.0004","90","","96","0.003","90","","3621.05","0.16","100","2","100.15","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","2-((4-(2-methoxyphenyl)piperazin-1-yl)methyl)phenylboronic acid","","- C18 H23 B N2 O3 -","- C18 H23 B N2 O3 -","- C144 H184 B8 N16 O24 -","8","1","","Adamczyk-Woźniak, Agnieszka; Czerwińska, Karolina; Madura, Izabela D.; Matuszewska, Alicja; Sporzyński, Andrzej; Żubrowska-Zembrzuska, Anna","Piperazine derivatives of boronic acids ‒ potential bifunctional biologically active compounds","New J. Chem.","2015","39","6","4308","","10.1039/C5NJ00084J","","","1.5418","CuKα","","0.0458","0.0392","","","0.102","0.1059","","","","","","1.058","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054749","7.9155","0.0004","10.313","0.0004","11.8333","0.0007","88.456","0.004","72.897","0.005","69.37","0.004","860.88","0.08","120","2","120","","","","","","","","","6","P -1","-P 1","2","","2-((4-(2,3-dichlorophenyl)piperazin-1-yl)methyl)phenylboronic acid","","- C17 H19 B Cl2 N2 O2 -","- C17 H19 B Cl2 N2 O2 -","- C34 H38 B2 Cl4 N4 O4 -","2","1","","Adamczyk-Woźniak, Agnieszka; Czerwińska, Karolina; Madura, Izabela D.; Matuszewska, Alicja; Sporzyński, Andrzej; Żubrowska-Zembrzuska, Anna","Piperazine derivatives of boronic acids ‒ potential bifunctional biologically active compounds","New J. Chem.","2015","39","6","4308","","10.1039/C5NJ00084J","","","1.54184","CuKα","","0.0502","0.0488","","","0.1264","0.129","","","","","","1.034","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054750","10.32568","0.00006","9.10656","0.0001","18.03844","0.00012","90","","90.7068","0.0006","90","","1696.05","0.02","100","2","100.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-((4-(4-nitrophenyl)piperazin-1-yl)methyl)phenylboronic acid","","- C17 H20 B N3 O4 -","- C17 H20 B N3 O4 -","- C68 H80 B4 N12 O16 -","4","1","","Adamczyk-Woźniak, Agnieszka; Czerwińska, Karolina; Madura, Izabela D.; Matuszewska, Alicja; Sporzyński, Andrzej; Żubrowska-Zembrzuska, Anna","Piperazine derivatives of boronic acids ‒ potential bifunctional biologically active compounds","New J. Chem.","2015","39","6","4308","","10.1039/C5NJ00084J","","","1.5418","CuKα","","0.0372","0.0364","","","0.0976","0.0984","","","","","","1.062","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054751","12.87751","0.00017","10.18562","0.00012","10.36536","0.00014","90","","90","","90","","1359.58","0.03","100","2","100.15","","","","","","","","","5","P n a 21","P 2c -2n","33","","2-((4-methylpiperazin-1-yl)methyl)phenylboronic acid","","- C12 H21 B N2 O3 -","- C12 H21 B N2 O3 -","- C48 H84 B4 N8 O12 -","4","1","","Adamczyk-Woźniak, Agnieszka; Czerwińska, Karolina; Madura, Izabela D.; Matuszewska, Alicja; Sporzyński, Andrzej; Żubrowska-Zembrzuska, Anna","Piperazine derivatives of boronic acids ‒ potential bifunctional biologically active compounds","New J. Chem.","2015","39","6","4308","","10.1039/C5NJ00084J","","","1.5418","CuKα","","0.0381","0.0373","","","0.1052","0.1064","","","","","","1.089","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054752","24.60371","0.00016","11.76829","0.00007","17.52165","0.00011","90","","93.8287","0.0006","90","","5061.96","0.05","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-((4-benzhydrylpiperazin-1-yl)methyl)phenylboronic acid","","- C27 H33 B N2 O3 -","- C27 H33 B N2 O3 -","- C216 H264 B8 N16 O24 -","8","2","","Adamczyk-Woźniak, Agnieszka; Czerwińska, Karolina; Madura, Izabela D.; Matuszewska, Alicja; Sporzyński, Andrzej; Żubrowska-Zembrzuska, Anna","Piperazine derivatives of boronic acids ‒ potential bifunctional biologically active compounds","New J. Chem.","2015","39","6","4308","","10.1039/C5NJ00084J","","","1.5418","CuKα","","0.0386","0.0358","","","0.0888","0.0911","","","","","","1.027","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054753","10.1897","0.0005","10.3703","0.0005","10.5504","0.0005","90","","107.526","0.003","90","","1063.11","0.09","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- Cs6 O16 P4 Y2 -","- Cs6 O16 P4 Y2 -","- Cs12 O32 P8 Y4 -","2","1","","Wang, Ying; Lian, Zhipeng; Su, Xin; Yang, Zhihua; Pan, Shilie; Yan, Qingfeng; Zhang, Fangfang","Cs6RE2(PO4)4(RE = Y and Gd): two new members of the alkali rare-earth double phosphates","New J. Chem.","2015","39","6","4328","","10.1039/C5NJ00109A","","","0.71073","MoKα","","0.0327","0.0277","","","0.045","0.0468","","","","","","0.966","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054754","10.2819","0.0004","10.4257","0.0004","10.5785","0.0004","90","","107.649","0.002","90","","1080.6","0.07","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- Cs6 Gd2 O16 P4 -","- Cs6 Gd2 O16 P4 -","- Cs12 Gd4 O32 P8 -","2","1","","Wang, Ying; Lian, Zhipeng; Su, Xin; Yang, Zhihua; Pan, Shilie; Yan, Qingfeng; Zhang, Fangfang","Cs6RE2(PO4)4(RE = Y and Gd): two new members of the alkali rare-earth double phosphates","New J. Chem.","2015","39","6","4328","","10.1039/C5NJ00109A","","","0.71073","MoKα","","0.0264","0.0245","","","0.0531","0.0542","","","","","","1.067","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054755","9.0342","0.0018","8.2698","0.0017","11.623","0.002","90","","100.9","0.03","90","","852.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 N2 O10 Zn2 -","- C16 H14 N2 O10 Zn2 -","- C32 H28 N4 O20 Zn4 -","2","0.5","","Wang, Fengqin; Dong, Caifu; Wang, Chengmiao; Yu, Zongchao; Guo, Shukun; Wang, Zechuan; Zhao, Yongnan; Li, Guodong","Fluorescence detection of aromatic amines and photocatalytic degradation of rhodamine B under UV light irradiation by luminescent metal‒organic frameworks","New J. Chem.","2015","39","6","4437","","10.1039/C4NJ02356K","","","0.71073","MoKα","","0.0321","0.027","","","0.073","0.0747","","","","","","1.085","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054756","7.7683","0.0016","8.6089","0.0017","8.6695","0.0017","84.04","0.03","76.23","0.03","66.04","0.03","514.6","0.2","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H11 Cd N O7 -","- C8 H11 Cd N O7 -","- C16 H22 Cd2 N2 O14 -","2","1","","Wang, Fengqin; Dong, Caifu; Wang, Chengmiao; Yu, Zongchao; Guo, Shukun; Wang, Zechuan; Zhao, Yongnan; Li, Guodong","Fluorescence detection of aromatic amines and photocatalytic degradation of rhodamine B under UV light irradiation by luminescent metal‒organic frameworks","New J. Chem.","2015","39","6","4437","","10.1039/C4NJ02356K","","","0.71073","MoKα","","0.0244","0.0228","","","0.0598","0.0601","","","","","","1.069","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054757","7.4698","0.0015","9.5364","0.0019","18.73","0.004","90","","90.05","0.03","90","","1334.2","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H5 Cl4 N3 O2 -","- C11 H5 Cl4 N3 O2 -","- C44 H20 Cl16 N12 O8 -","4","1","","Poorfreidoni, Alireza; Ranjbar-Karimi, Reza; Kia, Reza","Regiochemistry of nucleophilic substitution of pentachloropyridine with N and O bidentate nucleophiles","New J. Chem.","2015","39","6","4398","","10.1039/C5NJ00418G","","","0.71073","MoKα","","0.0361","0.0278","","","0.0663","0.0676","","","","","","0.855","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054758","22.662","0.005","11.13","0.003","18.004","0.004","90","","134.54","0.02","90","","3236.7","1.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H30 B2 F8 Fe N6 S6 -","- C18 H30 B2 F7.92 Fe N6 S6 -","- C72 H120 B8 F31.68 Fe4 N24 S24 -","4","0.5","","Pilia, Luca; Espa, Davide; Concas, Giorgio; Congiu, Francesco; Marchiò, Luciano; Laura Mercuri, M.; Serpe, Angela; Deplano, Paola","Tuning the oxidation state and magnetic and coordination behaviour of iron and cobalt complexes by O/S variation in mono-thio and dithio-oxamide chelating ligands","New J. Chem.","2015","39","6","4716","","10.1039/C5NJ00425J","","","0.71073","MoKα","","0.17","0.0482","","","0.0592","0.0711","","","","","","0.974","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054759","9.978","0.001","12.495","0.001","17.672","0.002","90","","97.174","0.005","90","","2186","0.4","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 B Cl2 F4 Fe N4 O2 S2 -","- C12 H20 B Cl2 F4 Fe N4 O2 S2 -","- C48 H80 B4 Cl8 F16 Fe4 N16 O8 S8 -","4","1","","Pilia, Luca; Espa, Davide; Concas, Giorgio; Congiu, Francesco; Marchiò, Luciano; Laura Mercuri, M.; Serpe, Angela; Deplano, Paola","Tuning the oxidation state and magnetic and coordination behaviour of iron and cobalt complexes by O/S variation in mono-thio and dithio-oxamide chelating ligands","New J. Chem.","2015","39","6","4716","","10.1039/C5NJ00425J","","","0.71073","MoKα","","0.0473","0.0331","","","0.086","0.0899","","","","","","1.004","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054760","9.59","0.01","31.06","0.02","12.91","0.02","90","","97.82","0.03","90","","3810","8","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C34 H30 Fe N6 O P S5 -","- C34 H30 Fe N6 O P S5 -","- C136 H120 Fe4 N24 O4 P4 S20 -","4","1","","Pilia, Luca; Espa, Davide; Concas, Giorgio; Congiu, Francesco; Marchiò, Luciano; Laura Mercuri, M.; Serpe, Angela; Deplano, Paola","Tuning the oxidation state and magnetic and coordination behaviour of iron and cobalt complexes by O/S variation in mono-thio and dithio-oxamide chelating ligands","New J. Chem.","2015","39","6","4716","","10.1039/C5NJ00425J","","","0.71073","MoKα","","0.1011","0.0563","","","0.1305","0.147","","","","","","1.007","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054761","8.487","0.004","13.97","0.006","16.988","0.009","73.85","0.01","77.69","0.02","76.69","0.02","1858.6","1.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H30 Fe I5.6 N6 S6 -","- C18 H30 Fe I5.6 N6 S6 -","- C36 H60 Fe2 I11.2 N12 S12 -","2","1","","Pilia, Luca; Espa, Davide; Concas, Giorgio; Congiu, Francesco; Marchiò, Luciano; Laura Mercuri, M.; Serpe, Angela; Deplano, Paola","Tuning the oxidation state and magnetic and coordination behaviour of iron and cobalt complexes by O/S variation in mono-thio and dithio-oxamide chelating ligands","New J. Chem.","2015","39","6","4716","","10.1039/C5NJ00425J","","","0.71073","MoKα","","0.1622","0.0796","","","0.178","0.2016","","","","","","1.021","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7054762","14.543","0.001","42.417","0.003","14.52","0.001","90","","115.476","0.001","90","","8086","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H60 Co2 I14 N12 S12 -","- C36 H60 Co2 I14.03 N12 S12 -","- C144 H240 Co8 I56.12 N48 S48 -","4","0.5","","Pilia, Luca; Espa, Davide; Concas, Giorgio; Congiu, Francesco; Marchiò, Luciano; Laura Mercuri, M.; Serpe, Angela; Deplano, Paola","Tuning the oxidation state and magnetic and coordination behaviour of iron and cobalt complexes by O/S variation in mono-thio and dithio-oxamide chelating ligands","New J. Chem.","2015","39","6","4716","","10.1039/C5NJ00425J","","","0.71073","MoKα","","0.082","0.0596","","","0.178","0.1999","","","","","","1.043","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054763","13.9246","0.0019","22.628","0.003","25.869","0.004","90","","90","","90","","8151","2","143","2","143","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C40 H67 N3 P Sc -","- C40 H67 N3 P Sc -","- C320 H536 N24 P8 Sc8 -","8","1","","Lv, Yingdong; Zhou, Jiliang; Leng, Xuebing; Chen, Yaofeng","Substitution reaction of triphenylphosphine oxide with rare-earth metal phosphido methyl complexes","New J. Chem.","2015","39","10","7582","","10.1039/C5NJ00335K","","","0.71073","MoKα","","0.1215","0.0569","","","0.1285","0.1567","","","","","","1.02","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054764","10.7097","0.0015","13.537","0.002","20.887","0.003","90","","93.806","0.003","90","","3021.5","0.8","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H47 N3 P Sc -","- C30 H47 N3 P Sc -","- C120 H188 N12 P4 Sc4 -","4","1","","Lv, Yingdong; Zhou, Jiliang; Leng, Xuebing; Chen, Yaofeng","Substitution reaction of triphenylphosphine oxide with rare-earth metal phosphido methyl complexes","New J. Chem.","2015","39","10","7582","","10.1039/C5NJ00335K","","","0.71073","MoKα","","0.1183","0.0728","","","0.1917","0.2312","","","","","","1.041","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054765","9.591","0.0008","23.0001","0.0019","17.0175","0.0015","90","","97.618","0.002","90","","3720.8","0.5","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H51 Lu N3 O P -","- C40 H51 Lu N3 O P -","- C160 H204 Lu4 N12 O4 P4 -","4","1","","Lv, Yingdong; Zhou, Jiliang; Leng, Xuebing; Chen, Yaofeng","Substitution reaction of triphenylphosphine oxide with rare-earth metal phosphido methyl complexes","New J. Chem.","2015","39","10","7582","","10.1039/C5NJ00335K","","","0.71073","MoKα","","0.0674","0.0371","","","0.0693","0.0786","","","","","","0.984","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054766","27.73","0.004","9.8425","0.0015","27.805","0.004","90","","92.963","0.003","90","","7578.7","1.9","140","2","140","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H52 Cl N3 O P Sc -","- C40 H52 Cl N3 O P Sc -","- C320 H416 Cl8 N24 O8 P8 Sc8 -","8","2","","Lv, Yingdong; Zhou, Jiliang; Leng, Xuebing; Chen, Yaofeng","Substitution reaction of triphenylphosphine oxide with rare-earth metal phosphido methyl complexes","New J. Chem.","2015","39","10","7582","","10.1039/C5NJ00335K","","","0.71073","MoKα","","0.1325","0.0769","","","0.214","0.2659","","","","","","0.947","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054767","10.5072","0.0008","21.5995","0.0009","11.2524","0.0005","90","","90.578","0.004","90","","2553.6","0.2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","51352","","- C26 H18 Br2 Cl N5 O -","- C26 H18 Br2 Cl N5 O -","- C104 H72 Br8 Cl4 N20 O4 -","4","1","","Manivannan, Ramalingam; Satheshkumar, Angupillai; El-Mossalamy, El-Sayed H.; Al-Harbi, Laila M.; Kosa, Samia A.; Elango, Kuppanagounder P.","Design, synthesis and characterization of indole based anion sensing receptors","New J. Chem.","2015","39","5","3936","","10.1039/C4NJ01728E","","","0.71073","MoKα","","0.1388","0.0567","","","0.1304","0.1855","","","","","","1.043","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054768","10.7139","0.0018","11.257","0.0015","13.736","0.002","90","","108.196","0.005","90","","1573.8","0.4","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","M-bis(hexafluoroacetylacetonato)(tris(o-tolyl)phosphino)palladium(II)","","- C31 H23 F12 O4 P Pd -","- C31 H23 F12 O4 P Pd -","- C62 H46 F24 O8 P2 Pd2 -","2","1","","Lennartson, Anders; Håkansson, Mikael","A missing link between chiral four- and five-coordinate complexes","New J. Chem.","2015","39","5","3353","","10.1039/C5NJ00265F","","x-ray","0.71073","MoKα","","0.0195","0.0186","","","0.0464","0.0469","","","","","","1.041","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054769","11.351","0.0014","14.4276","0.0017","19.814","0.002","90","","95.639","0.005","90","","3229.2","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","rac-bis(hexafluoroacetylacetonato)(tris(o-tolyl)phosphino)palladium(II)","","- C31 H23 F12 O4 P Pd -","- C31 H23 F12 O4 P Pd -","- C124 H92 F48 O16 P4 Pd4 -","4","1","","Lennartson, Anders; Håkansson, Mikael","A missing link between chiral four- and five-coordinate complexes","New J. Chem.","2015","39","5","3353","","10.1039/C5NJ00265F","","x-ray","0.71073","MoKα","","0.0237","0.0208","","","0.053","0.0539","","","","","","1.036","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054770","7.074","0.002","9.8727","0.0004","17.1493","0.0008","81.198","0.002","89.999","0.008","69.007","0.018","1103.1","0.3","293","2","293","2","","","","","","","","4","P 1","P 1","1","","","","- C29 H21 N3 O2 -","- C29 H21 N3 O2 -","- C58 H42 N6 O4 -","2","2","","Maria Xavier, A. John; Samy, N. Arockia; Paul, M. Wilson Bosco; Brainard, B.; Letticia, M.; Alexander, V.","A new heterometallic terbium(iii)‒ruthenium(ii) complex and its terbium(iii)‒zinc(ii) analog: syntheses, characterization, luminescence, and electrochemical properties","New J. Chem.","2015","39","6","4284","","10.1039/C5NJ00082C","","","0.71073","MoKα","","0.0566","0.0404","","","0.0971","0.1201","","","","","","1.092","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054771","13.3096","0.0007","14.3661","0.0007","20.6457","0.0008","90","","126.685","0.002","90","","3165.7","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","complex 1","","- C55 H68 N16 O15 Zn2 -","- C55 H68 N16 O15 Zn2 -","- C110 H136 N32 O30 Zn4 -","2","0.5","","Wang, Zhi Nan; Wang, Xuan; Wei, Si-Yue; Wang, Jixiao; Bai, Feng Ying; Xing, Yong Heng; Sun, Lixian","Triazine -polycarboxylate acids complexes: synthesis, structure and photocatalytic activity","New J. Chem.","2015","","","","","10.1039/C5NJ00173K","","","0.71073","MoKα","","0.084","0.0545","","","0.1689","0.1937","","","","","","1.025","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054772","14.3744","0.0017","14.6435","0.0018","15.5621","0.0018","90","","95.256","0.002","90","","3261.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","complex 2","","- C27 H32 Co N8 O7 -","- C27 H32 Co N8 O7 -","- C108 H128 Co4 N32 O28 -","4","1","","Wang, Zhi Nan; Wang, Xuan; Wei, Si-Yue; Wang, Jixiao; Bai, Feng Ying; Xing, Yong Heng; Sun, Lixian","Triazine -polycarboxylate acids complexes: synthesis, structure and photocatalytic activity","New J. Chem.","2015","","","","","10.1039/C5NJ00173K","","","0.71073","MoKα","","0.2398","0.0994","","","0.1814","0.2198","","","","","","1.04","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054773","9.491","0.002","13.025","0.003","16.033","0.003","106.161","0.004","91.155","0.004","109.772","0.003","1777.1","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H36 N10 O8 Zn -","- C32 H36 N10 O8 Zn -","- C64 H72 N20 O16 Zn2 -","2","1","","Wang, Zhi Nan; Wang, Xuan; Wei, Si-Yue; Wang, Jixiao; Bai, Feng Ying; Xing, Yong Heng; Sun, Lixian","Triazine -polycarboxylate acids complexes: synthesis, structure and photocatalytic activity","New J. Chem.","2015","","","","","10.1039/C5NJ00173K","","","0.71073","MoKα","","0.1205","0.0632","","","0.13","0.157","","","","","","1.027","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054774","10.075","0.0007","11.0795","0.0006","14.6868","0.0009","68.567","0.005","89.823","0.005","73.381","0.005","1452.82","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H58 Cu4 N20 O28 -","- C42 H58 Cu4 N20 O28 -","- C42 H58 Cu4 N20 O28 -","1","0.5","","Wang, Zhi Nan; Wang, Xuan; Wei, Si-Yue; Wang, Jixiao; Bai, Feng Ying; Xing, Yong Heng; Sun, Lixian","Triazine -polycarboxylate acids complexes: synthesis, structure and photocatalytic activity","New J. Chem.","2015","","","","","10.1039/C5NJ00173K","","","0.71073","MoKα","","0.0726","0.0444","","","0.0987","0.1144","","","","","","1.022","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054775","10.7306","0.0005","16.1771","0.0007","15.2453","0.0007","90","","95.132","0.004","90","","2635.8","0.2","223","2","223","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H44 N O Sc Si2 -","- C23 H44 N O Sc Si2 -","- C92 H176 N4 O4 Sc4 Si8 -","4","1","","Deng, Meng; Chi, Shuhui; Luo, Yunjie","Rare-earth metal bis(alkyl) complexes bearing pyrrolidinyl-functionalized cyclopentadienyl, indenyl and fluorenyl ligands: synthesis, characterization and the ligand effect on isoprene polymerization","New J. Chem.","2015","39","10","7575","","10.1039/C5NJ00279F","","","0.7107","MoKα","","0.0605","0.0447","","","0.1096","0.1164","","","","","","1.028","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054776","10.1323","0.0004","11.1789","0.0004","30.7457","0.0011","90","","96.195","0.004","90","","3462.2","0.2","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H52 N O Si3 Y -","- C31 H52 N O Si3 Y -","- C124 H208 N4 O4 Si12 Y4 -","4","1","","Deng, Meng; Chi, Shuhui; Luo, Yunjie","Rare-earth metal bis(alkyl) complexes bearing pyrrolidinyl-functionalized cyclopentadienyl, indenyl and fluorenyl ligands: synthesis, characterization and the ligand effect on isoprene polymerization","New J. Chem.","2015","39","10","7575","","10.1039/C5NJ00279F","","","0.7107","MoKα","","0.0673","0.0418","","","0.0847","0.0912","","","","","","1.024","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054777","10.0861","0.0005","11.1647","0.0006","30.639","0.002","90","","96.377","0.005","90","","3428.9","0.3","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H52 Lu N O Si3 -","- C31 H52 Lu N O Si3 -","- C124 H208 Lu4 N4 O4 Si12 -","4","1","","Deng, Meng; Chi, Shuhui; Luo, Yunjie","Rare-earth metal bis(alkyl) complexes bearing pyrrolidinyl-functionalized cyclopentadienyl, indenyl and fluorenyl ligands: synthesis, characterization and the ligand effect on isoprene polymerization","New J. Chem.","2015","39","10","7575","","10.1039/C5NJ00279F","","","0.7107","MoKα","","0.0874","0.0741","","","0.2001","0.2048","","","","","","1.133","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054778","8.7284","0.0015","17.138","0.003","20.293","0.004","90","","90.986","0.004","90","","3035.1","1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","L1","","- C35 H37 N3 O2 S -","- C35 H37 N3 O2 S -","- C140 H148 N12 O8 S4 -","4","1","","Yang, Meipan; Meng, Wenfei; Ding, Qingli; Su, Na; Liu, Xiaojing; Zhang, Ming; Yang, Bingqin","Novel fluorescent probes based on rhodamine for naked-eye detection of Fe3+and their application of imaging in living cells","New J. Chem.","2015","39","6","4790","","10.1039/C5NJ00226E","","","0.71073","MoKα","","0.1756","0.0804","","","0.1809","0.226","","","","","","1.028","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054779","9.0224","0.0008","11.6701","0.001","30.389","0.003","90","","90","","90","","3199.7","0.5","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H39 N3 O2 S -","- C37 H39 N3 O2 S -","- C148 H156 N12 O8 S4 -","4","1","","Yang, Meipan; Meng, Wenfei; Ding, Qingli; Su, Na; Liu, Xiaojing; Zhang, Ming; Yang, Bingqin","Novel fluorescent probes based on rhodamine for naked-eye detection of Fe3+and their application of imaging in living cells","New J. Chem.","2015","39","6","4790","","10.1039/C5NJ00226E","","","0.71073","MoKα","","0.0722","0.058","","","0.118","0.1245","","","","","","1.063","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054780","18.6062","0.0018","18.6062","0.0018","30.69","0.03","90","","90","","120","","9201","9","100","2","100","2","","","","","","","","6","R -3 :H","-R 3","148","[Cu3(L)(CO3)(ClO4)3](ClO4)","","","- C52 H69 Cl4 Cu3 N9 O22 -","- C52 H69 Cl4 Cu3 N9 O22 -","- C312 H414 Cl24 Cu18 N54 O132 -","6","0.333333","","Massoud, Salah S.; Louka, Febee R.; Al-Hasan, Mustafa A.; Vicente, Ramon; Mautner, Franz A.","Magneto-structural properties of carbonato-bridged copper(ii) complexes: fixation of atmospheric CO2","New J. Chem.","2015","39","8","5944","","10.1039/C5NJ00285K","","","0.71073","MoKα","","0.0841","0.077","","","0.1849","0.1895","","","","","","1.177","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054781","10.5041","0.0011","23.516","0.003","18.0212","0.0016","90","","101.48","0.02","90","","4362.4","0.9","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Cu2(L2)2(CO3)](ClO4)2.H2O","","","- C31 H74 Cl2 Cu2 N8 O12 -","- C31 H74 Cl2 Cu2 N8 O12 -","- C124 H296 Cl8 Cu8 N32 O48 -","4","1","","Massoud, Salah S.; Louka, Febee R.; Al-Hasan, Mustafa A.; Vicente, Ramon; Mautner, Franz A.","Magneto-structural properties of carbonato-bridged copper(ii) complexes: fixation of atmospheric CO2","New J. Chem.","2015","39","8","5944","","10.1039/C5NJ00285K","","","0.71073","MoKα","","0.0754","0.0601","","","0.1441","0.1542","","","","","","1.017","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054782","7.395","0.0008","10.783","0.0011","12.36","0.0014","102.279","0.001","90.428","0.001","106.08","0.002","923.05","0.17","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H20 Cu N4 O7 -","- C17 H20 Cu N4 O7 -","- C34 H40 Cu2 N8 O14 -","2","1","","Zhang, WeiChuan; Lu, Xiaoming; Wang, Guo; Cheng, Yifeng; Zhang, Bo","Methyl-substituted enhancement of antitumor activity in square-planar metal complex and analysis of ΔE, ΔG, CV, UV-vis and luminescence","New J. Chem.","2015","39","6","4869","","10.1039/C4NJ01953A","","","0.71073","MoKα","","0.1552","0.121","","","0.2882","0.325","","","","","","1.028","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054783","7.2802","0.0007","11.725","0.001","11.8101","0.0012","119.471","0.002","101.922","0.001","91.086","0.001","850.09","0.14","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H16 Cl Cu N3 O4 -","- C15 H16 Cl Cu N3 O4 -","- C30 H32 Cl2 Cu2 N6 O8 -","2","1","","Zhang, WeiChuan; Lu, Xiaoming; Wang, Guo; Cheng, Yifeng; Zhang, Bo","Methyl-substituted enhancement of antitumor activity in square-planar metal complex and analysis of ΔE, ΔG, CV, UV-vis and luminescence","New J. Chem.","2015","39","6","4869","","10.1039/C4NJ01953A","","","0.71073","MoKα","","0.0412","0.0358","","","0.0915","0.0948","","","","","","1.136","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054784","8.287","0.0017","9.193","0.0018","9.926","0.002","90","","102.89","0.03","90","","737.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C2 H6 Cl N5 O4 -","- C2 H6 Cl N5 O4 -","- C8 H24 Cl4 N20 O16 -","4","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia","3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties","New J. Chem.","2015","39","7","5265","","10.1039/C5NJ00182J","","","0.71073","MoKα","","0.0403","0.0371","","","0.1101","0.1141","","","","","","1.059","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054785","13.797","0.004","6.5463","0.0019","14.572","0.005","90","","103.617","0.004","90","","1279.1","0.7","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H8 N8 O7 -","- C8 H8 N8 O7 -","- C32 H32 N32 O28 -","4","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia","3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties","New J. Chem.","2015","39","7","5265","","10.1039/C5NJ00182J","","","0.71073","MoKα","","0.0644","0.0497","","","0.1211","0.1333","","","","","","1.003","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7054786","10.84","0.002","6.6164","0.0013","18.342","0.004","90","","92.26","0.03","90","","1314.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 N8 O9 -","- C8 H8 N8 O9 -","- C32 H32 N32 O36 -","4","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia","3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties","New J. Chem.","2015","39","7","5265","","10.1039/C5NJ00182J","","","0.71073","MoKα","","0.0366","0.0344","","","0.1012","0.1038","","","","","","1.053","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054787","8.5269","0.0007","6.265","0.0004","12.7601","0.0011","90","","112.003","0.002","90","","632.01","0.09","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C2 H6 N6 O3 -","- C2 H6 N6 O3 -","- C8 H24 N24 O12 -","4","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia","3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties","New J. Chem.","2015","39","7","5265","","10.1039/C5NJ00182J","","","0.71073","MoKα","","0.113","0.0851","","","0.2642","0.3002","","","","","","1.046","","","","has coordinates,has disorder","180101","2020-10-21","18:00:00",""
"7054788","5.101","0.0004","7.9797","0.0006","24.095","0.002","90","","91.788","0.002","90","","980.3","0.13","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 N8 O4 -","- C6 H8 N8 O4 -","- C24 H32 N32 O16 -","4","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia","3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties","New J. Chem.","2015","39","7","5265","","10.1039/C5NJ00182J","","","0.71073","MoKα","","0.0396","0.0335","","","0.0785","0.0827","","","","","","1.028","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054789","6.4007","0.0004","7.6439","0.0005","10.1075","0.0008","70.985","0.001","87.798","0.002","85.279","0.002","465.92","0.06","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C3 H6 N8 O6 -","- C3 H6 N8 O6 -","- C6 H12 N16 O12 -","2","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Cheng, Zi-Yuan; Xu, Cai-Xia","3,4-Diamino-1,2,4-triazole based energetic salts: synthesis, characterization, and energetic properties","New J. Chem.","2015","39","7","5265","","10.1039/C5NJ00182J","","","0.71073","MoKα","","0.1525","0.1101","","","0.2824","0.3047","","","","","","1.094","","","","has coordinates","180101","2020-10-21","18:00:00",""
"7054790","12.9857","0.0008","7.8019","0.0004","19.1976","0.0012","90","","101.655","0.005","90","","1904.9","0.2","296","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 Cl Fe N3 O5 S -","- C17 H17 Cl Fe N3 O5 S -","- C68 H68 Cl4 Fe4 N12 O20 S4 -","4","1","","Bal-Demirci, Tülay; Congur, Gulsah; Erdem, Arzum; Erdem-Kuruca, Serap; Özdemir, Namık; Akgün-Dar, Kadriye; Varol, Başak; Ülküseven, Bahri","Iron(iii) and nickel(ii) complexes as potential anticancer agents: synthesis, physicochemical and structural properties, cytotoxic activity and DNA interactions","New J. Chem.","2015","39","7","5643","","10.1039/C5NJ00594A","","","0.71073","MoKα","","0.1523","0.0598","","","0.1075","0.1277","","","","","","0.875","","","","has coordinates","143721","2020-10-21","18:00:00",""
"7054791","6.5112","0.0016","8.2566","0.0017","19.598","0.005","90","","90","","90","","1053.6","0.4","289","2","289","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","C-catena(bis((μ2-chloro)-chloro-(2-(2-methylaminoethyl)pyridine)-copper(II)))","","- C8 H12 Cl2 Cu N2 -","- C8 H12 Cl2 Cu N2 -","- C32 H48 Cl8 Cu4 N8 -","4","1","","Lennartson, Anders; Håkansson, Mikael","Absolute asymmetric synthesis of five-coordinate complexes","New J. Chem.","2015","39","8","5936","","10.1039/C5NJ00254K","","x-ray","0.71073","MoKα","","0.0253","0.024","","","0.0518","0.052","","","","","","0.994","","","","has coordinates","153248","2020-10-21","18:00:00",""
"7054792","5.7841","0.0014","13.342","0.002","16.26","0.003","90","","90","","90","","1254.8","0.4","289","2","289","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","A-catena(aqua-dichloro-caffein-copper(II))","","- C8 H12 Cl2 Cu N4 O3 -","- C8 H10 Cl2 Cu N4 O3 -","- C32 H40 Cl8 Cu4 N16 O12 -","4","1","","Lennartson, Anders; Håkansson, Mikael","Absolute asymmetric synthesis of five-coordinate complexes","New J. Chem.","2015","39","8","5936","","10.1039/C5NJ00254K","","x-ray","0.71073","MoKα","","0.0286","0.0276","","","0.0715","0.0719","","","","","","1.069","","","","has coordinates","153248","2020-10-21","18:00:00",""
"7054793","26.231","0.003","15.548","0.002","16.869","0.003","90","","90","","90","","6879.8","1.7","289","2","289","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","Λ-bis(2,2'-bipridine-N,N')-(saccharinato-N)-copper(II) saccharinate dihydrate","","- C34 H28 Cu N6 O8 S2 -","- C34 H24 Cu N6 O8 S2 -","- C272 H192 Cu8 N48 O64 S16 -","8","1","","Lennartson, Anders; Håkansson, Mikael","Absolute asymmetric synthesis of five-coordinate complexes","New J. Chem.","2015","39","8","5936","","10.1039/C5NJ00254K","","x-ray","0.71073","MoKα","","0.0441","0.0384","","","0.0924","0.095","","","","","","0.975","","","","has coordinates","153248","2020-10-21","18:00:00",""
"7054794","15.5295","0.0008","23.5505","0.0012","33.0018","0.0018","90","","90","","90","","12069.7","1.1","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C40 H77 Li N5 O Si6 Y -","- C40 H77 Li N5 O Si6 Y -","- C320 H616 Li8 N40 O8 Si48 Y8 -","8","1","","Yuan, Qingbing; Zhou, Shuangliu; Zhu, Xiancui; Wei, Yun; Wang, Shaowu; Mu, Xiaolong; Yao, Fangshi; Zhang, Guangchao; Chen, Zheng","Heterometallic rare-earth metal complexes with imino-functionalized 8-hydroxyquinolyl ligands: synthesis, characterization and catalytic activity towards hydrophosphinylation of trans-β-nitroalkene","New J. Chem.","2015","39","10","7626","","10.1039/C5NJ00409H","","","0.71073","MoKα","","0.1428","0.0564","","","0.1075","0.1193","","","","","","1.069","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054795","15.5306","0.001","23.5561","0.0015","32.975","0.002","90","","90","","90","","12063.6","1.3","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C40 H77 Er Li N5 O Si6 -","- C40 H77 Er Li N5 O Si6 -","- C320 H616 Er8 Li8 N40 O8 Si48 -","8","1","","Yuan, Qingbing; Zhou, Shuangliu; Zhu, Xiancui; Wei, Yun; Wang, Shaowu; Mu, Xiaolong; Yao, Fangshi; Zhang, Guangchao; Chen, Zheng","Heterometallic rare-earth metal complexes with imino-functionalized 8-hydroxyquinolyl ligands: synthesis, characterization and catalytic activity towards hydrophosphinylation of trans-β-nitroalkene","New J. Chem.","2015","39","10","7626","","10.1039/C5NJ00409H","","","0.71073","MoKα","","0.0815","0.042","","","0.1063","0.1167","","","","","","1.059","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054796","15.5608","0.0014","23.561","0.002","33.081","0.003","90","","90","","90","","12128.4","1.9","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C40 H77 Dy Li N5 O Si6 -","- C40 H77 Dy Li N5 O Si6 -","- C320 H616 Dy8 Li8 N40 O8 Si48 -","8","1","","Yuan, Qingbing; Zhou, Shuangliu; Zhu, Xiancui; Wei, Yun; Wang, Shaowu; Mu, Xiaolong; Yao, Fangshi; Zhang, Guangchao; Chen, Zheng","Heterometallic rare-earth metal complexes with imino-functionalized 8-hydroxyquinolyl ligands: synthesis, characterization and catalytic activity towards hydrophosphinylation of trans-β-nitroalkene","New J. Chem.","2015","39","10","7626","","10.1039/C5NJ00409H","","","0.71073","MoKα","","0.1452","0.0689","","","0.2024","0.2316","","","","","","0.998","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054797","16.5667","0.0012","17.4682","0.0012","22.5078","0.0016","90","","104.071","0.001","90","","6318.1","0.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H82 Li N6 O2 Si4 Sm -","- C56 H82 Li N6 O2 Si4 Sm -","- C224 H328 Li4 N24 O8 Si16 Sm4 -","4","1","","Yuan, Qingbing; Zhou, Shuangliu; Zhu, Xiancui; Wei, Yun; Wang, Shaowu; Mu, Xiaolong; Yao, Fangshi; Zhang, Guangchao; Chen, Zheng","Heterometallic rare-earth metal complexes with imino-functionalized 8-hydroxyquinolyl ligands: synthesis, characterization and catalytic activity towards hydrophosphinylation of trans-β-nitroalkene","New J. Chem.","2015","39","10","7626","","10.1039/C5NJ00409H","","","0.71073","MoKα","","0.0846","0.0442","","","0.0982","0.1151","","","","","","1.022","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054798","16.4571","0.0015","17.6102","0.0016","22.308","0.002","90","","104.279","0.001","90","","6265.4","1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H82 Er Li N6 O2 Si4 -","- C56 H82 Er Li N6 O2 Si4 -","- C224 H328 Er4 Li4 N24 O8 Si16 -","4","1","","Yuan, Qingbing; Zhou, Shuangliu; Zhu, Xiancui; Wei, Yun; Wang, Shaowu; Mu, Xiaolong; Yao, Fangshi; Zhang, Guangchao; Chen, Zheng","Heterometallic rare-earth metal complexes with imino-functionalized 8-hydroxyquinolyl ligands: synthesis, characterization and catalytic activity towards hydrophosphinylation of trans-β-nitroalkene","New J. Chem.","2015","39","10","7626","","10.1039/C5NJ00409H","","","0.71073","MoKα","","0.0524","0.0363","","","0.1034","0.1163","","","","","","1.071","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054799","16.4885","0.0009","17.569","0.001","22.3191","0.0012","90","","104.437","0.001","90","","6261.4","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H82 Li N6 O2 Si4 Yb -","- C56 H82 Li N6 O2 Si4 Yb -","- C224 H328 Li4 N24 O8 Si16 Yb4 -","4","1","","Yuan, Qingbing; Zhou, Shuangliu; Zhu, Xiancui; Wei, Yun; Wang, Shaowu; Mu, Xiaolong; Yao, Fangshi; Zhang, Guangchao; Chen, Zheng","Heterometallic rare-earth metal complexes with imino-functionalized 8-hydroxyquinolyl ligands: synthesis, characterization and catalytic activity towards hydrophosphinylation of trans-β-nitroalkene","New J. Chem.","2015","39","10","7626","","10.1039/C5NJ00409H","","","0.71073","MoKα","","0.0809","0.0394","","","0.0661","0.077","","","","","","1.009","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054800","22.6209","0.0013","12.2218","0.0007","16.4211","0.0009","90","","128.697","0.001","90","","3543.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H19 N2 O3.5 Pb -","- C20 H19 N2 O3.5 Pb -","- C160 H152 N16 O28 Pb8 -","8","1","","Chen, Ling; Yan, Cheng; Pan, Mei; Fan, Yuan-Zhong; Zhang, Lu-Yin; Yin, Shao-Yun; Hou, Ya-Jun; Wu, Kai; Jiang, Ji-Jun; Su, Cheng-Yong","Semidirected versus holodirected coordination and single-component white light luminescence in Pb(ii) complexes","New J. Chem.","2015","39","7","5287","","10.1039/C5NJ00720H","","","0.71","MoKα","","0.0459","0.0307","","","0.0575","0.0619","","","","","","1.039","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7054801","10.0789","0.0002","21.1453","0.0003","13.7167","0.0002","90","","102.148","0.002","90","","2857.86","0.08","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C60 H48 Cl2 N6 O14 Pb4 -","- C60 H48 Cl2 N6 O14 Pb4 -","- C120 H96 Cl4 N12 O28 Pb8 -","2","0.5","","Chen, Ling; Yan, Cheng; Pan, Mei; Fan, Yuan-Zhong; Zhang, Lu-Yin; Yin, Shao-Yun; Hou, Ya-Jun; Wu, Kai; Jiang, Ji-Jun; Su, Cheng-Yong","Semidirected versus holodirected coordination and single-component white light luminescence in Pb(ii) complexes","New J. Chem.","2015","39","7","5287","","10.1039/C5NJ00720H","","","0.71","MoKα","","0.0505","0.0379","","","0.063","0.0688","","","","","","0.989","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054802","15.6793","0.0004","21.2137","0.0005","26.0127","0.0005","90","","99.137","0.001","90","","8542.5","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C96 H76 N22 O8 Pb -","- C96 H76 N22 O8 Pb -","- C384 H304 N88 O32 Pb4 -","4","1","","Chen, Ling; Yan, Cheng; Pan, Mei; Fan, Yuan-Zhong; Zhang, Lu-Yin; Yin, Shao-Yun; Hou, Ya-Jun; Wu, Kai; Jiang, Ji-Jun; Su, Cheng-Yong","Semidirected versus holodirected coordination and single-component white light luminescence in Pb(ii) complexes","New J. Chem.","2015","39","7","5287","","10.1039/C5NJ00720H","","","0.71073","MoKα","","0.0571","0.0438","","","0.1074","0.1157","","","","","","1.022","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054803","13.0328","0.0005","14.6898","0.0005","16.6176","0.0008","94.303","0.003","108.155","0.004","108.11","0.003","2820.8","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C51 H43 Cl2 N8 O7 Pb Zn -","- C51 H43 Cl2 N8 O7 Pb Zn -","- C102 H86 Cl4 N16 O14 Pb2 Zn2 -","2","1","","Chen, Ling; Yan, Cheng; Pan, Mei; Fan, Yuan-Zhong; Zhang, Lu-Yin; Yin, Shao-Yun; Hou, Ya-Jun; Wu, Kai; Jiang, Ji-Jun; Su, Cheng-Yong","Semidirected versus holodirected coordination and single-component white light luminescence in Pb(ii) complexes","New J. Chem.","2015","39","7","5287","","10.1039/C5NJ00720H","","","1.54178","CuKα","","0.0968","0.0855","","","0.2694","0.2925","","","","","","1.086","","","","has coordinates","143727","2020-10-21","18:00:00",""
"7054804","10.5471","0.0005","11.2905","0.0006","13.1499","0.0006","71.518","0.004","69.935","0.004","87.015","0.004","1392.18","0.13","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C60 H90 O4 S2 Sm2 -","- C60 H90 O4 S2 Sm2 -","- C60 H90 O4 S2 Sm2 -","1","0.5","","Klementyeva, Svetlana V.; Arleth, Nicholas; Meyer, Karsten; Konchenko, Sergey N.; Roesky, Peter W.","Dithionite and sulfinate complexes from the reaction of SO2with decamethylsamarocene","New J. Chem.","2015","39","10","7589","","10.1039/C5NJ00318K","","","0.71073","MoKα","","0.0278","0.0242","","","0.0571","0.0579","","","","","","0.986","","","","has coordinates","162062","2020-10-21","18:00:00",""
"7054805","12.415","0.002","12.471","0.003","17.87","0.003","97.595","0.016","101.297","0.015","112.448","0.015","2441.3","0.9","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C94 H136 O12 S6 Sm4 -","- C94 H136 O12 S6 Sm4 -","- C94 H136 O12 S6 Sm4 -","1","0.5","","Klementyeva, Svetlana V.; Arleth, Nicholas; Meyer, Karsten; Konchenko, Sergey N.; Roesky, Peter W.","Dithionite and sulfinate complexes from the reaction of SO2with decamethylsamarocene","New J. Chem.","2015","39","10","7589","","10.1039/C5NJ00318K","","","0.71073","MoKα","","0.1352","0.0867","","","0.1991","0.2163","","","","","","0.941","","","","has coordinates","162062","2020-10-21","18:00:00",""
"7054806","8.5615","0.0003","20.6022","0.0009","11.7388","0.0006","90","","100.794","0.004","90","","2033.92","0.16","100","2","100.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H30 O2 S Sm -","- C20 H30 O2 S Sm -","- C80 H120 O8 S4 Sm4 -","4","1","","Klementyeva, Svetlana V.; Arleth, Nicholas; Meyer, Karsten; Konchenko, Sergey N.; Roesky, Peter W.","Dithionite and sulfinate complexes from the reaction of SO2with decamethylsamarocene","New J. Chem.","2015","39","10","7589","","10.1039/C5NJ00318K","","","0.71073","MoKα","","0.0656","0.0466","","","0.119","0.1272","","","","","","1.044","","","","has coordinates,has disorder","162062","2020-10-21","18:00:00",""
"7054807","11.8154","0.0004","12.3472","0.0004","12.4497","0.0004","76.608","0.002","72.242","0.002","74.217","0.002","1642.46","0.1","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C67 H98 O8 S4 Sm2 -","- C67 H97 O8 S4 Sm2 -","- C67 H97 O8 S4 Sm2 -","1","0.5","","Klementyeva, Svetlana V.; Arleth, Nicholas; Meyer, Karsten; Konchenko, Sergey N.; Roesky, Peter W.","Dithionite and sulfinate complexes from the reaction of SO2with decamethylsamarocene","New J. Chem.","2015","39","10","7589","","10.1039/C5NJ00318K","","","0.71073","MoKα","","0.0319","0.0302","","","0.0815","0.0825","","","","","","1.094","","","","has coordinates","162062","2020-10-21","18:00:00",""
"7054808","11.0828","0.0016","8.3612","0.0012","25.823","0.004","90","","92.896","0.003","90","","2389.8","0.6","100","2","99.85","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H36 N2 O12 S2 -","- C18 H36 N2 O12 S2 -","- C72 H144 N8 O48 S8 -","4","2","","Adokoh, Christian K.; Obuah, Collins; Kinfe, Henok H.; Zinyemba, Orpah; Darkwa, James","Novel bio-friendly and non-toxic thiocarbohydrate stabilizers of gold nanoparticles","New J. Chem.","2015","39","7","5249","","10.1039/C5NJ00293A","","","0.71073","MoKα","","0.0838","0.0498","","","0.1113","0.1343","","","","","","1.013","","","","has coordinates","143730","2020-10-21","18:00:00",""
"7054809","12.5424","0.0001","22.7691","0.0003","24.9695","0.0002","90","","90","","90","","7130.77","0.12","173","2","173.15","","","","","","","","","5","P b c 21","P 2c -2b","29","","1","","- C68 H120 N2 Si4 U2 -","- C68 H120 N2 Si4 U2 -","- C272 H480 N8 Si16 U8 -","4","1","","Kahan, Rachel J.; Cloke, F. Geoffrey N.; Roe, S. Mark; Nief, François","Activation of carbon dioxide by new mixed sandwich uranium(iii) complexes incorporating cyclooctatetraenyl and pyrrolide, phospholide, or arsolide ligands","New J. Chem.","2015","39","10","7602","","10.1039/C5NJ00590F","","","0.71073","MoKα","","0.0468","0.0334","","","0.0775","0.0982","","","","","","1.223","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7054810","11.8517","0.0002","14.9317","0.0002","22.2479","0.0003","90","","91.366","0.002","90","","3936","0.1","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","1.THF","","- C38 H68 N O Si2 U -","- C38 H68 N O Si2 U -","- C152 H272 N4 O4 Si8 U4 -","4","1","","Kahan, Rachel J.; Cloke, F. Geoffrey N.; Roe, S. Mark; Nief, François","Activation of carbon dioxide by new mixed sandwich uranium(iii) complexes incorporating cyclooctatetraenyl and pyrrolide, phospholide, or arsolide ligands","New J. Chem.","2015","39","10","7602","","10.1039/C5NJ00590F","","x-ray","1.54184","CuKα","","0.0587","0.0539","","","0.1503","0.1539","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054811","11.8847","0.0007","14.9475","0.0008","22.5236","0.0014","90","","89.568","0.005","90","","4001.1","0.4","173","","173","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","2THF","","","- C38 H68 O P Si2 U -","- C38 H68 O P Si2 U -","- C152 H272 O4 P4 Si8 U4 -","4","1","","Kahan, Rachel J.; Cloke, F. Geoffrey N.; Roe, S. Mark; Nief, François","Activation of carbon dioxide by new mixed sandwich uranium(iii) complexes incorporating cyclooctatetraenyl and pyrrolide, phospholide, or arsolide ligands","New J. Chem.","2015","39","10","7602","","10.1039/C5NJ00590F","","x-ray","0.71073","Mo/Ka","","0.0429","0.0298","","","0.0641","0.07","","","","","","1.047","","","","has coordinates,has disorder","162082","2020-10-21","18:00:00",""
"7054812","11.9699","0.0002","14.9384","0.0002","22.3338","0.0004","90","","90.538","0.001","90","","3993.36","0.11","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","3.THF","","- C38 H68 As O Si2 U -","- C38 H68 As O Si2 U -","- C152 H272 As4 O4 Si8 U4 -","4","1","","Kahan, Rachel J.; Cloke, F. Geoffrey N.; Roe, S. Mark; Nief, François","Activation of carbon dioxide by new mixed sandwich uranium(iii) complexes incorporating cyclooctatetraenyl and pyrrolide, phospholide, or arsolide ligands","New J. Chem.","2015","39","10","7602","","10.1039/C5NJ00590F","","x-ray","0.71073","MoKα","","0.0686","0.0396","","","0.0909","0.1146","","","","","","1.12","","","","has coordinates","162082","2020-10-21","18:00:00",""
"7054813","12.961","0.0009","14.6337","0.001","22.2106","0.0016","97.035","0.006","97.053","0.006","102.983","0.007","4024.5","0.5","173.15","","173.15","","","","","","","","","6","P -1","-P 1","2","4","4","","- C70 H120 N2 O5 Si4 U2 -","- C70 H120 N2 O5 Si4 U2 -","- C140 H240 N4 O10 Si8 U4 -","2","1","","Kahan, Rachel J.; Cloke, F. Geoffrey N.; Roe, S. Mark; Nief, François","Activation of carbon dioxide by new mixed sandwich uranium(iii) complexes incorporating cyclooctatetraenyl and pyrrolide, phospholide, or arsolide ligands","New J. Chem.","2015","39","10","7602","","10.1039/C5NJ00590F","","","0.71073","MoKα","","0.1155","0.0703","","","0.1751","0.1944","","","","","","1.012","","","","has coordinates","162082","2020-10-21","18:00:00",""
"7054814","22.3131","0.0004","15.0442","0.0003","22.7699","0.0004","90","","96.826","0.001","90","","7589.3","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","5","","- C70 H120 O5 P2 Si4 U2 -","- C70 H120 O5 P2 Si4 U2 -","- C280 H480 O20 P8 Si16 U8 -","4","1","","Kahan, Rachel J.; Cloke, F. Geoffrey N.; Roe, S. Mark; Nief, François","Activation of carbon dioxide by new mixed sandwich uranium(iii) complexes incorporating cyclooctatetraenyl and pyrrolide, phospholide, or arsolide ligands","New J. Chem.","2015","39","10","7602","","10.1039/C5NJ00590F","","x-ray","0.71073","MoKα","","0.0922","0.0484","","","0.0717","0.0816","","","","","","1.018","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054815","5.7245","0.0008","11.1337","0.0017","12.3817","0.0019","66.474","0.002","87.523","0.002","89.655","0.002","722.82","0.19","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C11 H18 F4 I N O -","- C11 H18 F4 I N O -","- C22 H36 F8 I2 N2 O2 -","2","1","","Pang, Xue; Jin, Wei Jun","Exploring the halogen bond specific solvent effects in halogenated solvent systems by ESR probe","New J. Chem.","2015","39","7","5477","","10.1039/C5NJ00300H","","","0.71073","MoKα","","0.0206","0.0197","","","0.0469","0.0475","","","","","","1.059","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054816","9.9973","0.0002","12.1216","0.0002","13.5814","0.0003","96.247","0.001","105.047","0.001","108.529","0.001","1473.76","0.05","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H26 N3 Ni O P S3 -","- C30 H26 N3 Ni O P S3 -","- C60 H52 N6 Ni2 O2 P2 S6 -","2","1","","Sathiyaraj, Ethiraj; Gurumoorthy, Govindasamy; Thirumaran, Subbiah","Nickel(ii) dithiocarbamate complexes containing the pyrrole moiety for sensing anions and synthesis of nickel sulfide and nickel oxide nanoparticles","New J. Chem.","2015","39","7","5336","","10.1039/C4NJ02250E","","","0.71073","MoKα","","0.0397","0.0315","","","0.0827","0.0894","","","","","","0.957","","","","has coordinates","143732","2020-10-21","18:00:00",""
"7054817","12.8102","0.0003","12.3291","0.0003","10.2865","0.0002","90","","112.007","0.001","90","","1506.26","0.06","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H14 N2 -","- C21 H14 N2 -","- C84 H56 N8 -","4","1","","Sontakke, Vyankat A.; Kate, Anup N.; Ghosh, Sougata; More, Piyush; Gonnade, Rajesh; Kumbhar, Navanath M.; Kumbhar, Anupa A.; Chopade, Balu A.; Shinde, Vaishali S.","Synthesis, DNA interaction and anticancer activity of 2-anthryl substituted benzimidazole derivatives","New J. Chem.","2015","39","6","4882","","10.1039/C4NJ02415J","","","0.71073","MoKα","","0.1088","0.0809","","","0.2133","0.2479","","","","","","1","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054818","9.3823","0.0011","20.167","0.002","16.4339","0.0019","90","","99.864","0.002","90","","3063.5","0.6","163","2","163","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H49 Ir Lu N Si -","- C28 H47 Ir Lu N Si -","- C112 H188 Ir4 Lu4 N4 Si4 -","4","1","","Shima, Takanori; Yanagi, Takako; Hou, Zhaomin","Rare-earth‒iridium heterobimetallic complexes with bridging imido and silylmethyl ligands: synthesis, structure and reactivity","New J. Chem.","2015","39","10","7608","","10.1039/C5NJ00598A","","","0.71073","MoKα","","0.1231","0.0631","","","0.1233","0.1379","","","","","","0.913","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054819","9.6879","0.001","10.9527","0.0011","18.836","0.002","73.159","0.001","85.811","0.002","78.961","0.001","1877.2","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C35 H60 Ir N2 Sc Si2 -","- C35 H60 Ir N2 Sc Si2 -","- C70 H120 Ir2 N4 Sc2 Si4 -","2","1","","Shima, Takanori; Yanagi, Takako; Hou, Zhaomin","Rare-earth‒iridium heterobimetallic complexes with bridging imido and silylmethyl ligands: synthesis, structure and reactivity","New J. Chem.","2015","39","10","7608","","10.1039/C5NJ00598A","","","0.71073","MoKα","","0.0784","0.0733","","","0.2075","0.2178","","","","","","1.142","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054820","46.05","0.03","9.62","0.006","19.635","0.013","90","","90.619","0.011","90","","8698","10","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C45 H62 Ir Lu N3 Si -","- C45 H60 Ir Lu N3 Si -","- C360 H480 Ir8 Lu8 N24 Si8 -","8","1","","Shima, Takanori; Yanagi, Takako; Hou, Zhaomin","Rare-earth‒iridium heterobimetallic complexes with bridging imido and silylmethyl ligands: synthesis, structure and reactivity","New J. Chem.","2015","39","10","7608","","10.1039/C5NJ00598A","","","0.71073","MoKα","","0.1749","0.0524","","","0.0809","0.1112","","","","","","0.885","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054821","12.688","0.007","15.745","0.009","20.071","0.011","90","","95.867","0.009","90","","3989","4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H59 Ir Lu N3 Si -","- C42 H57 Ir Lu N3 Si -","- C168 H228 Ir4 Lu4 N12 Si4 -","4","1","","Shima, Takanori; Yanagi, Takako; Hou, Zhaomin","Rare-earth‒iridium heterobimetallic complexes with bridging imido and silylmethyl ligands: synthesis, structure and reactivity","New J. Chem.","2015","39","10","7608","","10.1039/C5NJ00598A","","","0.71073","MoKα","","0.1017","0.0424","","","0.0698","0.0824","","","","","","0.963","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054822","9.431","0.002","10.568","0.003","18.813","0.005","85.387","0.004","79.968","0.003","74.367","0.003","1777","0.8","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H54 Ir Lu N2 O Si -","- C36 H52 Ir Lu N2 O Si -","- C72 H104 Ir2 Lu2 N4 O2 Si2 -","2","1","","Shima, Takanori; Yanagi, Takako; Hou, Zhaomin","Rare-earth‒iridium heterobimetallic complexes with bridging imido and silylmethyl ligands: synthesis, structure and reactivity","New J. Chem.","2015","39","10","7608","","10.1039/C5NJ00598A","","","0.71073","MoKα","","0.0972","0.0715","","","0.1669","0.1743","","","","","","0.924","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054823","9.776","0.002","13.149","0.003","16.983","0.003","101.28","0.03","105.35","0.03","108.19","0.03","1905.5","1","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H57 Ho N6 -","- C36 H57 Ho N6 -","- C72 H114 Ho2 N12 -","2","1","","Sroor, Farid M.; Hrib, Cristian G.; Hilfert, Liane; Busse, Sabine; Edelmann, Frank T.","Synthesis and catalytic activity of homoleptic lanthanide-tris(cyclopropylethinyl)amidinates","New J. Chem.","2015","39","10","7595","","10.1039/C5NJ00555H","","","0.71073","MoKα","","0.0379","0.0343","","","0.0891","0.0908","","","","","","1.04","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054824","9.7257","0.0019","10.383","0.002","10.558","0.002","70.77","0.03","65.92","0.03","70.83","0.03","895.5","0.4","153","2","153","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H28 N2 -","- C21 H28 N2 -","- C42 H56 N4 -","2","1","","Sroor, Farid M.; Hrib, Cristian G.; Hilfert, Liane; Busse, Sabine; Edelmann, Frank T.","Synthesis and catalytic activity of homoleptic lanthanide-tris(cyclopropylethinyl)amidinates","New J. Chem.","2015","39","10","7595","","10.1039/C5NJ00555H","","","0.71073","MoKα","","0.0717","0.0535","","","0.1411","0.1512","","","","","","1.071","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054825","6.4203","0.0011","18.901","0.003","6.5776","0.0011","90","","104.022","0.004","90","","774.4","0.2","293","2","293","2","","","","","","","Synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N4 O8 -","- C14 H16 N4 O8 -","- C28 H32 N8 O16 -","2","0.5","","Briceño, Alexander; Leal, Dayana; Díaz de Delgado, Graciela","A novel example of double reactivity by either photochemical [2+2] or thermal additions of an ionic organic supramolecular assembly","New J. Chem.","2015","39","6","4965","","10.1039/C5NJ00678C","","","0.7107","MoKα","","0.0563","0.0462","","","0.114","0.1214","","","","","","1.071","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054826","7.646","0.005","7.48","0.005","13.756","0.01","90","","96.521","0.019","90","","781.6","0.9","293","2","293","2","","","","","","","Synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 N2 O4 -","- C7 H8 N2 O4 -","- C28 H32 N8 O16 -","4","1","","Briceño, Alexander; Leal, Dayana; Díaz de Delgado, Graciela","A novel example of double reactivity by either photochemical [2+2] or thermal additions of an ionic organic supramolecular assembly","New J. Chem.","2015","39","6","4965","","10.1039/C5NJ00678C","","","0.7107","MoKα","","0.114","0.0799","","","0.1967","0.2158","","","","","","1.16","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054827","13.4467","0.0001","20.6731","0.0002","25.1841","0.0002","83.205","0.001","74.743","0.001","77.61","0.001","6582.53","0.1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C59 H104 B2 N12 Yb -","- C59 H104 B2 N12 Yb -","- C236 H416 B8 N48 Yb4 -","4","2","","Kühling, Marcel; Wickleder, Claudia; Ferguson, Michael J.; Hrib, Cristian G.; McDonald, Robert; Suta, Markus; Hilfert, Liane; Takats, Josef; Edelmann, Frank T.","Investigation of the “bent sandwich-like” divalent lanthanide hydro-tris(pyrazolyl)borates Ln(TpiPr2)2(Ln = Sm, Eu, Tm, Yb)","New J. Chem.","2015","39","10","7617","","10.1039/C5NJ00568J","","","0.71073","MoKα","","0.0524","0.0363","","","0.064","0.0689","","","","","","1.028","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054828","12.9942","0.001","13.6332","0.001","20.9744","0.0016","104.267","0.0008","94.869","0.0008","115.641","0.0007","3167.5","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H95 B2 N13 Sm -","- C56 H95 B2 N13 Sm -","- C112 H190 B4 N26 Sm2 -","2","1","","Kühling, Marcel; Wickleder, Claudia; Ferguson, Michael J.; Hrib, Cristian G.; McDonald, Robert; Suta, Markus; Hilfert, Liane; Takats, Josef; Edelmann, Frank T.","Investigation of the “bent sandwich-like” divalent lanthanide hydro-tris(pyrazolyl)borates Ln(TpiPr2)2(Ln = Sm, Eu, Tm, Yb)","New J. Chem.","2015","39","10","7617","","10.1039/C5NJ00568J","","","0.71073","MoKα","","0.0334","0.0271","","","0.0645","0.0678","","","","","","1.051","","","","has coordinates","162113","2020-10-21","18:00:00",""
"7054829","13.9188","0.0009","16.8238","0.0011","21.9614","0.0015","90","","90.3416","0.001","90","","5142.5","0.6","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C47 H79 B N11 Sm -","- C47 H79 B N11 Sm -","- C188 H316 B4 N44 Sm4 -","4","1","","Kühling, Marcel; Wickleder, Claudia; Ferguson, Michael J.; Hrib, Cristian G.; McDonald, Robert; Suta, Markus; Hilfert, Liane; Takats, Josef; Edelmann, Frank T.","Investigation of the “bent sandwich-like” divalent lanthanide hydro-tris(pyrazolyl)borates Ln(TpiPr2)2(Ln = Sm, Eu, Tm, Yb)","New J. Chem.","2015","39","10","7617","","10.1039/C5NJ00568J","","","0.71073","MoKα","","0.0399","0.0287","","","0.0662","0.0715","","","","","","1.024","","","","has coordinates","162113","2020-10-21","18:00:00",""
"7054830","9.979","0.005","12.906","0.007","13.397","0.007","94.04","0.005","94.595","0.005","105.072","0.005","1653.2","1.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H24 F3 Ir N6 -","- C36 H24 F3 Ir N6 -","- C72 H48 F6 Ir2 N12 -","2","1","","Huixia, Xu; Peng, Sun; Dan, Zhao; Tingting, Yang; Yuying, Hao; Hua, Wang; Heping, Shi; Bingshe, Xu","Synthesis and photoelectric performances of blue-green emitting iridium phenylpyridine complexes using N,N′-heteroaromatic ancillary ligands","New J. Chem.","2015","39","7","5293","","10.1039/C5NJ00195A","","","0.71073","MoKα","","0.0543","0.0418","","","0.0781","0.0815","","","","","","1.009","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054831","9.307","0.007","12.792","0.009","13.798","0.01","96.684","0.007","98.707","0.007","109.386","0.006","1507.1","1.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H20 F3 Ir N6 -","- C30 H20 F3 Ir N6 -","- C60 H40 F6 Ir2 N12 -","2","1","","Huixia, Xu; Peng, Sun; Dan, Zhao; Tingting, Yang; Yuying, Hao; Hua, Wang; Heping, Shi; Bingshe, Xu","Synthesis and photoelectric performances of blue-green emitting iridium phenylpyridine complexes using N,N′-heteroaromatic ancillary ligands","New J. Chem.","2015","39","7","5293","","10.1039/C5NJ00195A","","","0.71073","MoKα","","0.0568","0.0424","","","0.0856","0.09","","","","","","1.026","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054832","13.163","0.007","20.032","0.011","23.737","0.013","90","","90","","90","","6259","6","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C35 H24 F Ir N6 -","- C35 H24 F Ir N6 -","- C280 H192 F8 Ir8 N48 -","8","1","","Huixia, Xu; Peng, Sun; Dan, Zhao; Tingting, Yang; Yuying, Hao; Hua, Wang; Heping, Shi; Bingshe, Xu","Synthesis and photoelectric performances of blue-green emitting iridium phenylpyridine complexes using N,N′-heteroaromatic ancillary ligands","New J. Chem.","2015","39","7","5293","","10.1039/C5NJ00195A","","","0.71073","MoKα","","0.078","0.0421","","","0.0713","0.0791","","","","","","1.002","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054833","6.4945","0.0007","11.1068","0.001","11.7301","0.0013","101.467","0.009","102.098","0.009","106.947","0.009","760.24","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H32 N2 Ni O2 S4 -","- C32 H32 N2 Ni O2 S4 -","- C32 H32 N2 Ni O2 S4 -","1","0.5","","Yadav, Manoj Kumar; Rajput, Gunjan; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Rare intermolecular M⋯H‒C anagostic interactions in homoleptic Ni(ii)‒Pd(ii) dithiocarbamate complexes","New J. Chem.","2015","39","7","5493","","10.1039/C5NJ00452G","","","0.71073","MoKα","","0.0629","0.0431","","","0.1045","0.1142","","","","","","0.964","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054834","6.7086","0.001","10.3187","0.0018","10.8136","0.0012","74.967","0.012","84.813","0.01","72.281","0.014","688.59","0.19","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H29 N3 Pd S4 -","- C29 H29 N3 Pd S4 -","- C29 H29 N3 Pd S4 -","1","0.5","","Yadav, Manoj Kumar; Rajput, Gunjan; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Rare intermolecular M⋯H‒C anagostic interactions in homoleptic Ni(ii)‒Pd(ii) dithiocarbamate complexes","New J. Chem.","2015","39","7","5493","","10.1039/C5NJ00452G","","","0.71073","MoKα","","0.1217","0.0931","","","0.2176","0.2487","","","","","","1.022","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054835","7.0268","0.001","10.6267","0.0018","13.7577","0.0016","104.768","0.012","103.014","0.011","105.644","0.014","907.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H38 N4 Ni O6 S4 -","- C34 H38 N4 Ni O6 S4 -","- C34 H38 N4 Ni O6 S4 -","1","0.5","","Yadav, Manoj Kumar; Rajput, Gunjan; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Rare intermolecular M⋯H‒C anagostic interactions in homoleptic Ni(ii)‒Pd(ii) dithiocarbamate complexes","New J. Chem.","2015","39","7","5493","","10.1039/C5NJ00452G","","","0.71073","MoKα","","0.1042","0.0573","","","0.1103","0.1286","","","","","","0.986","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054836","8.3049","0.0006","21.4036","0.0011","9.147","0.0007","90","","103.609","0.007","90","","1580.27","0.19","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H32 N2 Ni O2 S4 -","- C32 H32 N2 Ni O2 S4 -","- C64 H64 N4 Ni2 O4 S8 -","2","0.5","","Yadav, Manoj Kumar; Rajput, Gunjan; Prasad, Lal Bahadur; Drew, Michael G. B.; Singh, Nanhai","Rare intermolecular M⋯H‒C anagostic interactions in homoleptic Ni(ii)‒Pd(ii) dithiocarbamate complexes","New J. Chem.","2015","39","7","5493","","10.1039/C5NJ00452G","","","0.71073","MoKα","","0.1422","0.074","","","0.1471","0.1741","","","","","","1.013","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054837","9.6624","0.0013","9.8119","0.0011","15.7422","0.0018","90","","104.595","0.004","90","","1444.3","0.3","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3-tert-butyl-1,4-dihydro-1-phenyl-1,2,4-benzotriazin-4-yl","","- C17 H18 N3 -","- C17 H18 N3 -","- C68 H72 N12 -","4","1","","Takahashi, Yusuke; Miura, Youhei; Yoshioka, Naoki","Synthesis and properties of the 3-tert-butyl-7-trifluoromethyl-1,4-dihydro-1-phenyl-1,2,4-benzotriazin-4-yl radical","New J. Chem.","2015","39","6","4783","","10.1039/C5NJ00393H","","","0.71073","MoKα","","0.0929","0.0523","","","0.1345","0.1683","","","","","","0.86","","","","has coordinates","138791","2020-10-21","18:00:00",""
"7054838","5.592","0.002","18.904","0.007","15.882","0.005","90","","92.487","0.011","90","","1677.3","1","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","","3-tert-butyl-7-trifluoromethyl-1,4-dihydro-1-phenyl-1,2,4-benzotriazin-4-yl","","- C18 H17 F3 N3 -","- C18 H17 F3 N3 -","- C72 H68 F12 N12 -","4","1","","Takahashi, Yusuke; Miura, Youhei; Yoshioka, Naoki","Synthesis and properties of the 3-tert-butyl-7-trifluoromethyl-1,4-dihydro-1-phenyl-1,2,4-benzotriazin-4-yl radical","New J. Chem.","2015","39","6","4783","","10.1039/C5NJ00393H","","","0.71073","MoKα","","0.1132","0.0662","","","0.1736","0.2069","","","","","","1.06","","","","has coordinates,has disorder","138791","2020-10-21","18:00:00",""
"7054839","11.0722","0.0003","22.891","0.0007","19.0774","0.0006","90","","98.033","0.001","90","","4787.8","0.2","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Ti","","- C19 H33 Cl4 N O Ti -","- C19 H33 Cl4 N O Ti -","- C152 H264 Cl32 N8 O8 Ti8 -","8","1","","Roymuhury, Sagnik K.; Chakraborty, Debashis; Ramkumar, Venkatachalam","Zwitterionic group 4 aminophenolate catalysts for the polymerization of lactides and ethylene","New J. Chem.","2015","39","7","5218","","10.1039/C5NJ00486A","","","0.71073","MoKα","","0.0482","0.0367","","","0.0923","0.0994","","","","","","1.052","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054840","29.4978","0.0015","11.1493","0.0005","21.1407","0.0009","90","","112.578","0.002","90","","6419.9","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","zr1","","- C28 H41 Cl4 N2 O Zr -","- C28 H41 Cl4 N2 O Zr -","- C224 H328 Cl32 N16 O8 Zr8 -","8","1","","Roymuhury, Sagnik K.; Chakraborty, Debashis; Ramkumar, Venkatachalam","Zwitterionic group 4 aminophenolate catalysts for the polymerization of lactides and ethylene","New J. Chem.","2015","39","7","5218","","10.1039/C5NJ00486A","","","0.71073","MoKα","","0.0517","0.0415","","","0.1146","0.1238","","","","","","1.034","","","","has coordinates,has disorder","143736","2020-10-21","18:00:00",""
"7054841","21.5507","0.0013","11.4122","0.0006","10.7699","0.0006","90","","95.411","0.002","90","","2637","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H32 Cl4 N2 O2 Zr -","- C21 H34 Cl4 N2 O2 Zr -","- C84 H136 Cl16 N8 O8 Zr4 -","4","1","","Roymuhury, Sagnik K.; Chakraborty, Debashis; Ramkumar, Venkatachalam","Zwitterionic group 4 aminophenolate catalysts for the polymerization of lactides and ethylene","New J. Chem.","2015","39","7","5218","","10.1039/C5NJ00486A","","","0.71073","MoKα","","0.0535","0.0414","","","0.0956","0.1021","","","","","","1.074","","","","has coordinates","143736","2020-10-21","18:00:00",""
"7054842","20.6487","0.0009","10.3507","0.0004","14.0719","0.0007","90","","99.266","0.002","90","","2968.3","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tbu_hf","","- C52.14 H80.16 Cl6 Hf N2 O2 -","- C52.14 H80.16 Cl6 Hf N2 O2 -","- C104.28 H160.32 Cl12 Hf2 N4 O4 -","2","0.5","","Roymuhury, Sagnik K.; Chakraborty, Debashis; Ramkumar, Venkatachalam","Zwitterionic group 4 aminophenolate catalysts for the polymerization of lactides and ethylene","New J. Chem.","2015","39","7","5218","","10.1039/C5NJ00486A","","","0.71073","MoKα","","0.0507","0.0362","","","0.0888","0.1133","","","","","","1.177","","","","has coordinates,has disorder","143736","2020-10-21","18:00:00",""
"7054843","5.6074","0.0006","14.7841","0.0016","20.027","0.002","90","","90","","90","","1660.2","0.3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H17 Br O2 S -","- C18 H17 Br O2 S -","- C72 H68 Br4 O8 S4 -","4","1","","Ren, Qiao; Gao, Tao; Li, Wenjun; Wan, Li; Hu, Yimin; Peng, Yanhong; Sun, Shaofa; Hu, Liqiang; Wu, Minghu; Guo, Haibing; Wang, Jian","A highly enantioselective Michael reaction between α,β-unsaturated ketones and malonic acid half-thioesters","New J. Chem.","2015","39","7","5100","","10.1039/C5NJ00719D","","","0.71073","MoKα","","0.032","0.029","","","0.0599","0.0608","","","","","","1.016","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054844","12.385","0.003","12.928","0.003","15.373","0.004","95.319","0.003","111.299","0.003","105.141","0.003","2165","0.9","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H55 B F2 N2 O2 -","- C52 H55 B F2 N2 O2 -","- C104 H110 B2 F4 N4 O4 -","2","1","","Richards, Gary James; Gobo, Yuki; Yamamura, Masaki; Nabeshima, Tatsuya","Biphenyl appended BODIPY derivatives showing combined environmental polarity and heavy metal cation sensing functionality","New J. Chem.","2015","39","8","5886","","10.1039/C5NJ00611B","","","0.71073","MoKα","","0.0686","0.0512","","","0.1198","0.1316","","","","","","1.012","","","","has coordinates,has disorder","153253","2020-10-21","18:00:00",""
"7054845","14.0234","0.0006","28.7145","0.0013","11.204","0.0005","90","","115.449","0.002","90","","4073.8","0.3","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H45 B F2 N2 O4 -","- C48 H45 B F2 N2 O4 -","- C192 H180 B4 F8 N8 O16 -","4","0.5","","Richards, Gary James; Gobo, Yuki; Yamamura, Masaki; Nabeshima, Tatsuya","Biphenyl appended BODIPY derivatives showing combined environmental polarity and heavy metal cation sensing functionality","New J. Chem.","2015","39","8","5886","","10.1039/C5NJ00611B","","","0.71073","MoKα","","0.0589","0.0457","","","0.1026","0.1103","","","","","","1.021","","","","has coordinates,has disorder","153253","2020-10-21","18:00:00",""
"7054846","8.2271","0.0012","13.429","0.002","13.894","0.002","90","","101.83","0.003","90","","1502.4","0.4","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H10 N2 O6 -","- C17 H10 N2 O6 -","- C68 H40 N8 O24 -","4","1","","Das, Avijit Kumar; Goswami, Shyamaprosad; Quah, Ching Kheng; Fun, Hoong-Kun","Neighbouring group participation of thiol through aldehyde group assisted thiolysis of active ether: ratiometric and vapor phase fast detection of hydrogen sulfide in mixed aqueous media","New J. Chem.","2015","39","7","5669","","10.1039/C5NJ00689A","","","0.71073","MoKα","","0.0583","0.0393","","","0.1099","0.1257","","","","","","1.047","","","","has coordinates","143724","2020-10-21","18:00:00",""
"7054847","21.9055","0.0019","4.6272","0.0004","13.7499","0.0012","90","","92.655","0.002","90","","1392.2","0.2","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 N2 O5 -","- C16 H10 N2 O5 -","- C64 H40 N8 O20 -","4","1","","Das, Avijit Kumar; Goswami, Shyamaprosad; Quah, Ching Kheng; Fun, Hoong-Kun","Neighbouring group participation of thiol through aldehyde group assisted thiolysis of active ether: ratiometric and vapor phase fast detection of hydrogen sulfide in mixed aqueous media","New J. Chem.","2015","39","7","5669","","10.1039/C5NJ00689A","","","0.71073","MoKα","","0.0763","0.0508","","","0.1392","0.1603","","","","","","1.048","","","","has coordinates","143724","2020-10-21","18:00:00",""
"7054848","9.56","0.004","12.62","0.005","21.55","0.008","88.897","0.007","84.185","0.007","87.425","0.007","2583.7","1.8","150","2","150.03","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H12 Cu6 F36 N12 -","- C36 H12 Cu6 F36 N12 -","- C72 H24 Cu12 F72 N24 -","2","1","","Jayaratna, Naleen B.; Hettiarachchi, Champika V.; Yousufuddin, Muhammed; Rasika Dias, H. V.","Isolable arene sandwiched copper(i) pyrazolates","New J. Chem.","2015","39","7","5092","","10.1039/C5NJ01002K","","","0.71073","MoKα","","0.05","0.0374","","","0.0968","0.1056","","","","","","1.025","","","","has coordinates,has disorder","143729","2020-10-21","18:00:00",""
"7054849","19.975","0.002","19.975","0.002","13.2744","0.0014","90","","90","","120","","4586.9","0.8","150","2","150","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C24 H15 Cu3 F18 N6 -","- C24 H15 Cu3 F18 N6 -","- C144 H90 Cu18 F108 N36 -","6","0.333333","","Jayaratna, Naleen B.; Hettiarachchi, Champika V.; Yousufuddin, Muhammed; Rasika Dias, H. V.","Isolable arene sandwiched copper(i) pyrazolates","New J. Chem.","2015","39","7","5092","","10.1039/C5NJ01002K","","","0.71073","MoKα","","0.0341","0.0275","","","0.0634","0.0659","","","","","","1.032","","","","has coordinates","203907","2020-10-21","18:00:00",""
"7054850","11.7936","0.0011","12.4534","0.0011","12.7263","0.0011","109.803","0.002","117.447","0.002","95.807","0.002","1484.7","0.2","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H11 Cu3 F18 N6 -","- C25 H11 Cu3 F18 N6 -","- C50 H22 Cu6 F36 N12 -","2","1","","Jayaratna, Naleen B.; Hettiarachchi, Champika V.; Yousufuddin, Muhammed; Rasika Dias, H. V.","Isolable arene sandwiched copper(i) pyrazolates","New J. Chem.","2015","39","7","5092","","10.1039/C5NJ01002K","","","0.71073","MoKα","","0.0235","0.0223","","","0.0569","0.0576","","","","","","1.04","","","","has coordinates,has disorder","143729","2020-10-21","18:00:00",""
"7054851","10.0903","0.0005","10.8463","0.0005","21.9151","0.0011","90","","93.491","0.004","90","","2394","0.2","150.01","0.1","150.01","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H37 K O2 Si2 -","- C19 H37 K O2 Si2 -","- C76 H148 K4 O8 Si8 -","4","1","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","x-ray","0.71073","MoKα","","0.0642","0.0549","","","0.1377","0.1456","","","","","","1.053","","","","has coordinates,has disorder","162066","2020-10-21","18:00:00",""
"7054852","10.7116","0.0019","11.485","0.003","13.285","0.003","72.517","0.019","83.217","0.015","79.146","0.017","1527.7","0.6","100.03","0.11","100.03","0.11","","","","","","","","5","P -1","-P 1","2","","","","- C44 H84 I2 La2 Si8 -","- C44 H84 I2 La2 Si8 -","- C44 H84 I2 La2 Si8 -","1","0.5","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","","0.71073","MoKα","","0.1663","0.0976","","","0.1642","0.2255","","","","","","1.06","","","","has coordinates","162066","2020-10-21","18:00:00",""
"7054853","10.7177","0.0007","11.5326","0.0007","13.3332","0.0008","72.794","0.005","83.327","0.005","78.87","0.005","1541.59","0.17","150.02","0.11","150.02","0.11","","","","","","","","5","P -1","-P 1","2","","","","- C44 H84 Ce2 I2 Si8 -","- C44 H84 Ce2 I2 Si8 -","- C44 H84 Ce2 I2 Si8 -","1","0.5","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","","0.71073","MoKα","","0.0676","0.0534","","","0.0887","0.0949","","","","","","1.086","","","","has coordinates","162066","2020-10-21","18:00:00",""
"7054854","11.0319","0.0004","16.0851","0.0011","20.1692","0.0007","90","","90","","90","","3579","0.3","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H50 I La O Si4 -","- C26 H50 I La O Si4 -","- C104 H200 I4 La4 O4 Si16 -","4","1","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","","0.71073","MoKα","","0.0527","0.0453","","","0.081","0.0846","","","","","","1.097","","","","has coordinates,has disorder","162066","2020-10-21","18:00:00",""
"7054855","10.5085","0.0005","11.3227","0.0004","23.7712","0.0008","90.523","0.003","98.515","0.003","104.372","0.003","2706.58","0.19","150.01","0.1","150.01","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C52 H84 Ce2 I2 -","- C52 H84 Ce2 I2 -","- C104 H168 Ce4 I4 -","2","1","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","","0.71073","MoKα","","0.0561","0.0393","","","0.0641","0.0728","","","","","","1.025","","","","has coordinates","162066","2020-10-21","18:00:00",""
"7054856","11.8979","0.0007","14.6707","0.0007","37.397","0.002","90","","90","","90","","6527.7","0.6","150.01","0.11","150.01","0.11","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H45 Ce I2 O2 Si3 -","- C22 H45 Ce I2 O2 Si3 -","- C176 H360 Ce8 I16 O16 Si24 -","8","1","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","","0.71073","MoKα","","0.1065","0.0589","","","0.07","0.0802","","","","","","1.073","","","","has coordinates","162066","2020-10-21","18:00:00",""
"7054857","16.9173","0.0004","13.045","0.0003","20.6985","0.0006","90","","92.959","0.002","90","","4561.8","0.2","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H66 Ce I O Si6 -","- C32 H66 Ce I O Si6 -","- C128 H264 Ce4 I4 O4 Si24 -","4","1","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","","0.71073","MoKα","","0.057","0.0416","","","0.0725","0.0802","","","","","","1.024","","","","has coordinates","162066","2020-10-21","18:00:00",""
"7054858","38.4377","0.0014","17.9044","0.0005","25.5605","0.0007","90","","109.755","0.003","90","","16555.6","0.9","150.02","0.1","150.02","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H65 Ce N2 Si7 -","- C26 H65 Ce N2 Si7 -","- C416 H1040 Ce16 N32 Si112 -","16","2","","Ortu, Fabrizio; Fowler, Jonathan M.; Burton, Matthew; Formanuik, Alasdair; Mills, David P.","A structural investigation of heteroleptic lanthanide substituted cyclopentadienyl complexes","New J. Chem.","2015","39","10","7633","","10.1039/C5NJ00761E","","x-ray","0.71073","MoKα","","0.1311","0.0957","","","0.2443","0.2851","","","","","","1.025","","","","has coordinates","162066","2020-10-21","18:00:00",""
"7054859","19.1506","0.0011","8.9975","0.0005","24.1828","0.0014","90","","108.305","0.001","90","","3956","0.4","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H61 Al N O Y -","- C35 H61 Al N O Y -","- C140 H244 Al4 N4 O4 Y4 -","4","1","","Schädle, Dorothea; Enders, Markus; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Anwander, Reiner","Reactivity of halfsandwich rare-earth metal methylaluminates toward potassium (2,4,6-tri-tert-butylphenyl)amide and 1-adamantylamine","New J. Chem.","2015","39","10","7640","","10.1039/C5NJ00800J","","","0.71073","MoKα","","0.0577","0.0413","","","0.0893","0.095","","","","","","1.031","","","","has coordinates","162052","2020-10-21","18:00:00",""
"7054860","9.1367","0.0003","12.1049","0.0004","13.2803","0.0004","77.756","0.001","81.137","0.001","88.071","0.001","1418.24","0.08","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H42 Al2 Lu N -","- C26 H42 Al2 Lu N -","- C52 H84 Al4 Lu2 N2 -","2","1","","Schädle, Dorothea; Enders, Markus; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Anwander, Reiner","Reactivity of halfsandwich rare-earth metal methylaluminates toward potassium (2,4,6-tri-tert-butylphenyl)amide and 1-adamantylamine","New J. Chem.","2015","39","10","7640","","10.1039/C5NJ00800J","","","0.71073","MoKα","","0.0153","0.0143","","","0.0367","0.0372","","","","","","1.106","","","","has coordinates","162052","2020-10-21","18:00:00",""
"7054861","12.109","0.0003","13.67","0.0003","13.7168","0.0003","105.191","0.001","113.695","0.001","106.489","0.001","1801.47","0.08","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H56 Al Lu N2 -","- C39 H56 Al Lu N2 -","- C78 H112 Al2 Lu2 N4 -","2","1","","Schädle, Dorothea; Enders, Markus; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Anwander, Reiner","Reactivity of halfsandwich rare-earth metal methylaluminates toward potassium (2,4,6-tri-tert-butylphenyl)amide and 1-adamantylamine","New J. Chem.","2015","39","10","7640","","10.1039/C5NJ00800J","","","0.71073","MoKα","","0.022","0.0179","","","0.0407","0.042","","","","","","1.034","","","","has coordinates","162052","2020-10-21","18:00:00",""
"7054862","6.8749","0.0003","19.6763","0.0008","12.1047","0.0005","90","","124.608","0.002","90","","1347.7","0.1","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H26 Al N -","- C13 H25.9992 Al N -","- C52 H103.997 Al4 N4 -","4","1","","Schädle, Dorothea; Enders, Markus; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Anwander, Reiner","Reactivity of halfsandwich rare-earth metal methylaluminates toward potassium (2,4,6-tri-tert-butylphenyl)amide and 1-adamantylamine","New J. Chem.","2015","39","10","7640","","10.1039/C5NJ00800J","","","0.71073","MoKα","","0.0417","0.0383","","","0.103","0.1049","","","","","","1.113","","","","has coordinates,has disorder","162052","2020-10-21","18:00:00",""
"7054863","9.4592","0.0004","12.2445","0.0005","14.0256","0.0006","68.379","0.002","80.349","0.001","82.208","0.002","1483.98","0.11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H46 Al N2 Y -","- C32 H46 Al N2 Y -","- C64 H92 Al2 N4 Y2 -","2","1","","Schädle, Dorothea; Enders, Markus; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Anwander, Reiner","Reactivity of halfsandwich rare-earth metal methylaluminates toward potassium (2,4,6-tri-tert-butylphenyl)amide and 1-adamantylamine","New J. Chem.","2015","39","10","7640","","10.1039/C5NJ00800J","","","0.71073","MoKα","","0.0382","0.0346","","","0.0913","0.0933","","","","","","1.035","","","","has coordinates","162052","2020-10-21","18:00:00",""
"7054864","49.6386","0.0013","12.3116","0.0003","35.9711","0.0016","90","","131.598","0.001","90","","16439.4","1","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C76 H142 Al2 N2 Y2 -","- C76 H142 Al2 N2 Y2 -","- C608 H1136 Al16 N16 Y16 -","8","1","","Schädle, Dorothea; Enders, Markus; Schädle, Christoph; Maichle-Mössmer, Cäcilia; Törnroos, Karl W.; Anwander, Reiner","Reactivity of halfsandwich rare-earth metal methylaluminates toward potassium (2,4,6-tri-tert-butylphenyl)amide and 1-adamantylamine","New J. Chem.","2015","39","10","7640","","10.1039/C5NJ00800J","","","0.71073","MoKα","","0.0819","0.0687","","","0.1523","0.1579","","","","","","1.165","","","","has coordinates","162052","2020-10-21","18:00:00",""
"7054865","10.9907","0.0006","11.3474","0.0006","15.5308","0.0008","78.443","0.001","85.233","0.001","72.758","0.001","1811.81","0.17","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H32 Bi2 Cl10 N4 O2 -","- C24 H32 Bi2 Cl10 N4 O2 -","- C48 H64 Bi4 Cl20 N8 O4 -","2","1","","Adonin, Sergey A.; Rakhmanova, Marianna E.; Smolentsev, Anton I.; Korolkov, Ilya V.; Sokolov, Maxim N.; Fedin, Vladimir P.","Binuclear Bi(iii) halide complexes with 4,4′-ethylenepyridinium cations: luminescence tuning by reversible solvation","New J. Chem.","2015","39","7","5529","","10.1039/C5NJ00889A","","","0.71073","","","0.0166","0.0137","","","0.0336","0.0347","","","","","","1.056","","","","has coordinates","143726","2020-10-21","18:00:00",""
"7054866","9.9694","0.0004","10.7558","0.0005","10.8145","0.0005","63.208","0.001","68.53","0.001","81.138","0.001","963.23","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H32 Bi2 Br10 N4 O2 -","- C24 H32.02 Bi2 Br10 N4 O2 -","- C24 H32.02 Bi2 Br10 N4 O2 -","1","0.5","","Adonin, Sergey A.; Rakhmanova, Marianna E.; Smolentsev, Anton I.; Korolkov, Ilya V.; Sokolov, Maxim N.; Fedin, Vladimir P.","Binuclear Bi(iii) halide complexes with 4,4′-ethylenepyridinium cations: luminescence tuning by reversible solvation","New J. Chem.","2015","39","7","5529","","10.1039/C5NJ00889A","","","0.71073","","","0.0313","0.0223","","","0.0474","0.0491","","","","","","1.028","","","","has coordinates","143726","2020-10-21","18:00:00",""
"7054867","11.126","0.009","8.548","0.007","13.382","0.01","90","","96.17","0.014","90","","1265.3","1.7","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H12 Cl N2 O3 -","- C12 H12 Cl N2 O3 -","- C48 H48 Cl4 N8 O12 -","4","2","","Xia, Ai-Bao; Zhang, Xiao-Long; Wang, Tao; Du, Xiao-Hua; Xu, Dan-Qian; Xu, Zhen-Yuan","Enantioselective synthesis of functionalized 3,4-disubstituted dihydro-2(1H)-quinolinones via Michael‒hemiaminalization/oxidation reaction","New J. Chem.","2015","39","7","5088","","10.1039/C4NJ01718H","","","0.71073","MoKα","","0.0437","0.0368","","","0.1001","0.1049","","","","","","1.068","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054868","8.7793","0.0015","8.4442","0.0015","23.81","0.004","90","","97.312","0.006","90","","1750.8","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 F2 N2 O3 S -","- C18 H18 F2 N2 O3 S -","- C72 H72 F8 N8 O12 S4 -","4","1","","Zhang, Hui-Zhen; Jeyakkumar, Ponmani; Vijaya Kumar, Kannekanti; Zhou, Cheng-He","Synthesis of novel sulfonamide azoles via C‒N cleavage of sulfonamides by azole ring and relational antimicrobial study","New J. Chem.","2015","39","7","5776","","10.1039/C4NJ01932F","","","0.71073","MoKα","","0.0524","0.0468","","","0.1367","0.1432","","","","","","1.04","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054869","12.9357","0.0016","19.6992","0.0007","7.3342","0.0009","90","","139.81","0.03","90","","1206.1","0.8","291","2","291.15","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C11 H14 N2 O3 S -","- C11 H14 N2 O3 S -","- C44 H56 N8 O12 S4 -","4","1","","Zhang, Hui-Zhen; Jeyakkumar, Ponmani; Vijaya Kumar, Kannekanti; Zhou, Cheng-He","Synthesis of novel sulfonamide azoles via C‒N cleavage of sulfonamides by azole ring and relational antimicrobial study","New J. Chem.","2015","39","7","5776","","10.1039/C4NJ01932F","","","1.54184","CuKα","","0.0425","0.0398","","","0.1014","0.106","","","","","","1.044","","","","has coordinates","143720","2020-10-21","18:00:00",""
"7054870","8.3155","0.0002","11.8276","0.0003","17.5749","0.0005","88.157","0.001","89.051","0.001","75.447","0.001","1672.15","0.08","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H53 N3 Si6 Te U -","- C18 H53 N3 Si6 Te U -","- C36 H106 N6 Si12 Te2 U2 -","2","1","","Smiles, Danil E.; Wu, Guang; Hayton, Trevor W.","Reactivity of [U(CH2SiMe2NSiMe3)(NR2)2] (R = SiMe3) with elemental chalcogens: towards a better understanding of chalcogen atom transfer in the actinides","New J. Chem.","2015","39","10","7563","","10.1039/C5NJ00739A","","","0.71073","MoKα","","0.0264","0.0213","","","0.0464","0.0479","","","","","","0.979","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054871","15.6285","0.0012","20.3969","0.0016","14.6493","0.0013","90","","100.297","0.004","90","","4594.6","0.7","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C26 H74 K N3 O2 S2 Si6 U -","- C26 H74 K N3 O2 S2 Si6 U -","- C104 H296 K4 N12 O8 S8 Si24 U4 -","4","1","","Smiles, Danil E.; Wu, Guang; Hayton, Trevor W.","Reactivity of [U(CH2SiMe2NSiMe3)(NR2)2] (R = SiMe3) with elemental chalcogens: towards a better understanding of chalcogen atom transfer in the actinides","New J. Chem.","2015","39","10","7563","","10.1039/C5NJ00739A","","","0.71073","MoKα","","0.0224","0.0174","","","0.0385","0.0399","","","","","","1.02","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054872","20.835","0.003","14.682","0.002","23.143","0.003","90","","115.188","0.006","90","","6406.3","1.5","143","1","143","1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C61 H87 Ce F3 K N6 O6 S -","- C61 H87 Ce F3 K N6 O6 S -","- C244 H348 Ce4 F12 K4 N24 O24 S4 -","4","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.0798","0.0611","","","0.1329","0.1482","","","","","","1.098","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054873","14.4458","0.0009","14.7681","0.0009","15.4079","0.001","92.43","0.003","91.434","0.003","110.149","0.003","3080.4","0.3","143","1","143","1","","","","","","","","6","P -1","-P 1","2","","","","- C63 H86 Ce K N6 O4 -","- C63 H86 Ce K N6 O4 -","- C126 H172 Ce2 K2 N12 O8 -","2","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.0239","0.0215","","","0.0541","0.0559","","","","","","1.174","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054874","12.1981","0.0009","13.1778","0.001","19.5063","0.0013","97.217","0.004","96.618","0.004","98.276","0.004","3049.8","0.4","143","1","143","1","","","","","","","","6","P -1","-P 1","2","","","","- C71 H92 Ce K N6 O4 -","- C64 H84 Ce K N6 O4 -","- C128 H168 Ce2 K2 N12 O8 -","2","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.0429","0.0345","","","0.0781","0.0817","","","","","","1.061","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054875","11.3184","0.0008","13.5855","0.0011","23.2211","0.0017","85.902","0.004","76.841","0.004","77.042","0.004","3387.5","0.4","143","1","143","1","","","","","","","","6","P -1","-P 1","2","","","","- C64 H96 Ce K N6 O4 -","- C53 H84 Ce K N6 O4 -","- C106 H168 Ce2 K2 N12 O8 -","2","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.0524","0.0462","","","0.1361","0.1434","","","","","","0.777","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7054876","11.7314","0.0012","16.311","0.0015","24.948","0.002","90","","97.884","0.005","90","","4728.7","0.8","143","1","143","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H68 Ce K N6 O4 -","- C45 H68 Ce K N6 O4 -","- C180 H272 Ce4 K4 N24 O16 -","4","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.0335","0.0279","","","0.0732","0.075","","","","","","1.188","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054877","26.329","0.003","14.3707","0.0013","33.138","0.003","90","","109.328","0.005","90","","11832","2","143","1","143","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C57 H84 Ce K N4 O4 -","- C57 H84 Ce K N4 O4 -","- C456 H672 Ce8 K8 N32 O32 -","8","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.0774","0.0623","","","0.1331","0.1386","","","","","","1.287","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054878","49.697","0.005","49.697","0.005","10.6526","0.0012","90","","90","","120","","22785","4","143","1","143","1","","","","","","","","6","R -3 :H","-R 3","148","","","","- C45 H74 Ce K N6 O4 -","- C43 H72 Ce K N6 O4 -","- C774 H1296 Ce18 K18 N108 O72 -","18","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.1606","0.0649","","","0.1335","0.171","","","","","","0.8","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7054879","10.5168","0.0005","14.2353","0.0007","19.0676","0.001","94.568","0.003","100.046","0.002","110.486","0.003","2602.3","0.2","100","1","100","1","","","","","","","","6","P -1","-P 1","2","","","","- C49.5 H76 Ce K N6 O4 -","- C49.5 H76 Ce K N6 O4 -","- C99 H152 Ce2 K2 N12 O8 -","2","1","","Kim, Jee Eon; Carroll, Patrick J.; Schelter, Eric J.","Structural variation in cerium aryloxide complexes templated by hemilabile K±-amine interactions","New J. Chem.","2015","39","8","6076","","10.1039/C5NJ00848D","","","0.71073","MoKα","","0.0294","0.0262","","","0.0633","0.065","","","","","","1.088","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7054880","12.8015","0.0006","21.5451","0.0008","13.7718","0.0008","90","","112.598","0.006","90","","3506.8","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H29 F2 Ir N2 O4 -","- C43 H29 F2 Ir N2 O4 -","- C172 H116 F8 Ir4 N8 O16 -","4","1","","Niu, Zhi-Gang; Zheng, Tao; Su, You-Hui; Wang, Peng-Jiang; Li, Xiao-Yan; Cui, Feng; Liang, Jiao; Li, Gao-Nan","Highly phosphorescent iridium(iii) complexes based on 2-(biphenyl-4-yl)benzo[d]oxazole derivatives: synthesis, structures, properties and DFT calculations","New J. Chem.","2015","39","8","6025","","10.1039/C5NJ00975H","","","0.71","MoKα","","0.0769","0.048","","","0.1051","0.1186","","","","","","1.026","","","","has coordinates","153249","2020-10-21","18:00:00",""
"7054881","11.2055","0.0003","12.7447","0.0005","14.5575","0.0005","65.313","0.004","87.69","0.002","77.97","0.003","1844.91","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H35 Ir N2 O4 -","- C45 H35 Ir N2 O4 -","- C90 H70 Ir2 N4 O8 -","2","1","","Niu, Zhi-Gang; Zheng, Tao; Su, You-Hui; Wang, Peng-Jiang; Li, Xiao-Yan; Cui, Feng; Liang, Jiao; Li, Gao-Nan","Highly phosphorescent iridium(iii) complexes based on 2-(biphenyl-4-yl)benzo[d]oxazole derivatives: synthesis, structures, properties and DFT calculations","New J. Chem.","2015","39","8","6025","","10.1039/C5NJ00975H","","","1.54184","CuKα","","0.029","0.0245","","","0.0579","0.0606","","","","","","1.077","","","","has coordinates","153249","2020-10-21","18:00:00",""
"7054882","10.0973","0.0003","24.018","0.0009","14.6736","0.0004","90","","100.473","0.003","90","","3499.3","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H31 Ir N2 O4 -","- C43 H31 Ir N2 O4 -","- C172 H124 Ir4 N8 O16 -","4","1","","Niu, Zhi-Gang; Zheng, Tao; Su, You-Hui; Wang, Peng-Jiang; Li, Xiao-Yan; Cui, Feng; Liang, Jiao; Li, Gao-Nan","Highly phosphorescent iridium(iii) complexes based on 2-(biphenyl-4-yl)benzo[d]oxazole derivatives: synthesis, structures, properties and DFT calculations","New J. Chem.","2015","39","8","6025","","10.1039/C5NJ00975H","","","0.71073","MoKα","","0.059","0.0385","","","0.0698","0.0765","","","","","","1.065","","","","has coordinates","153249","2020-10-21","18:00:00",""
"7054883","14.8134","0.00016","14.8134","0.00016","17.0733","0.0004","90","","90","","90","","3746.51","0.1","120","0.1","120","0.1","","","","","","","","7","P 42/n","-P 4bc","86","","","","- C43.5 H27 Cl2 F4 Ir N2 O4 -","- C43.5 H27 Cl2 F4 Ir N2 O4 -","- C174 H108 Cl8 F16 Ir4 N8 O16 -","4","","","Niu, Zhi-Gang; Zheng, Tao; Su, You-Hui; Wang, Peng-Jiang; Li, Xiao-Yan; Cui, Feng; Liang, Jiao; Li, Gao-Nan","Highly phosphorescent iridium(iii) complexes based on 2-(biphenyl-4-yl)benzo[d]oxazole derivatives: synthesis, structures, properties and DFT calculations","New J. Chem.","2015","39","8","6025","","10.1039/C5NJ00975H","","","0.71073","MoKα","","0.0485","0.0329","","","0.0796","0.0901","","","","","","1.054","","","","has coordinates","212110","2020-10-21","18:00:00",""
"7054884","18.1422","0.0004","18.1422","0.0004","25.8426","0.0005","90","","90","","120","","7366.3","0.3","293","2","293","2","","","","","","","","5","R -3","-R 3","148","","","","- C45 H33 Cl6 N9 Zn3 -","- C45 H33 Cl6 N9 Zn3 -","- C270 H198 Cl36 N54 Zn18 -","6","","","Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong","Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand","New J. Chem.","2015","39","8","6016","","10.1039/C5NJ00222B","","","1.54184","CuKα","","0.0608","0.0516","","","0.1505","0.1574","","","","","","1.072","","","","has coordinates","153250","2020-10-21","18:00:00",""
"7054885","16.1561","0.0008","16.1561","0.0008","31.8535","0.0014","90","","90","","120","","7200.5","0.6","160","10","160","10","","","","","","","","6","R -3","-R 3","148","","","","- C92 H68 Cd6 Cl18 N18 O0.5 -","- C92 H68 Cd6 Cl18 N18 O0.5 -","- C276 H204 Cd18 Cl54 N54 O1.5 -","3","","","Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong","Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand","New J. Chem.","2015","39","8","6016","","10.1039/C5NJ00222B","","x-ray","1.54184","CuKα","","0.1087","0.0766","","","0.1987","0.2267","","","","","","1.004","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7054886","17.976","0.002","17.976","0.002","27.338","0.003","90","","90","","120","","7650.4","1.5","293","2","293","2","","","","","","","","5","R -3","-R 3","148","","","","- C45 H33 Br8 Hg4 N9 -","- C45 H33 Br8 Hg4 N9 -","- C270 H198 Br48 Hg24 N54 -","6","","","Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong","Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand","New J. Chem.","2015","39","8","6016","","10.1039/C5NJ00222B","","","0.71073","MoKα","","0.1625","0.0791","","","0.1766","0.2219","","","","","","1.045","","","","has coordinates","153250","2020-10-21","18:00:00",""
"7054887","18.3083","0.0007","18.3083","0.0007","29.1307","0.0008","90","","90","","120","","8456.2","0.5","293","2","293","2","","","","","","","","5","R -3","-R 3","148","","","","- C45 H33 Hg4 I8 N9 -","- C45 H33 Hg4 I8 N9 -","- C270 H198 Hg24 I48 N54 -","6","","","Zhao, Jin'an; Peng, Kun; Guo, Yan; Zhang, Jin; Chen, Shufang; Hu, Jiyong","Photoluminescent and cytotoxic properties of multinuclear complexes and multinuclear-based polymers with group 12 metals and a tripodal ligand","New J. Chem.","2015","39","8","6016","","10.1039/C5NJ00222B","","","0.71073","MoKα","","0.0899","0.0516","","","0.118","0.1379","","","","","","1.03","","","","has coordinates","153250","2020-10-21","18:00:00",""
"7054888","6.1617","0.0008","10.5098","0.0013","17.3476","0.0017","90","","98.607","0.01","90","","1110.7","0.2","180","0.1","180","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H29 N2 P -","- C26 H29 N2 P -","- C52 H58 N4 P2 -","2","1","","Ma, Wangyang; Xu, Ling; Zhang, Wen-Xiong; Xi, Zhenfeng","Half-sandwich rare-earth metal tris(alkyl) ate complexes catalyzed phosphaguanylation reaction of phosphines with carbodiimides: an efficient synthesis of phosphaguanidines","New J. Chem.","2015","39","10","7649","","10.1039/C5NJ01136A","","","0.71073","MoKα","","0.0618","0.0508","","","0.1192","0.129","","","","","","1.039","","","","has coordinates","162057","2020-10-21","18:00:00",""
"7054889","9.1198","0.0005","9.6075","0.0005","14.3241","0.0008","94.951","0.002","98.05","0.003","92.029","0.002","1236.62","0.12","120","2","120","2","","","","","","","","6","P -1","-P 1","2","(iron(II)-benzenedisulfonate)(N-methylpyrrolidone)","","","- C21 H31 Fe N3 O9 S2 -","- C21 H31 Fe N3 O9 S2 -","- C42 H62 Fe2 N6 O18 S4 -","2","1","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Wickleder, Mathias S.","1,4-Benzenedisulfonic acid (H2BDS) as terephthalic acid analogue for the preparation of coordination polymers: the examples of M(BDS)(NMP)3(M = Mn, Fe, Co; NMP = N-methylpyrrolidone)","New J. Chem.","2015","39","8","6117","","10.1039/C5NJ00223K","","","0.71073","MoKα","","0.0278","0.0238","","","0.0689","0.0705","","","","","","1.069","","","","has coordinates","153259","2020-10-21","18:00:00",""
"7054890","9.1132","0.0011","9.5953","0.0012","14.2855","0.0017","94.791","0.005","98.229","0.005","91.873","0.006","1230.7","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","(cobalt(II)-benzenedisulfonate)(N-methylpyrrolidone)","","","- C21 H31 Co N3 O9 S2 -","- C21 H31 Co N3 O9 S2 -","- C42 H62 Co2 N6 O18 S4 -","2","1","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Wickleder, Mathias S.","1,4-Benzenedisulfonic acid (H2BDS) as terephthalic acid analogue for the preparation of coordination polymers: the examples of M(BDS)(NMP)3(M = Mn, Fe, Co; NMP = N-methylpyrrolidone)","New J. Chem.","2015","39","8","6117","","10.1039/C5NJ00223K","","","0.71073","MoKα","","0.0344","0.0264","","","0.0684","0.072","","","","","","1.024","","","","has coordinates","153259","2020-10-21","18:00:00",""
"7054891","9.1684","0.0003","9.6557","0.0003","14.3787","0.0005","95.2967","0.0017","97.8338","0.0017","92.5755","0.0017","1253.51","0.07","120","2","120","2","","","","","","","","6","P -1","-P 1","2","(manganese(II)-benzenedisulfonate)(N-methylpyrrolidone)","","","- C21 H31 Mn N3 O9 S2 -","- C21 H31 Mn N3 O9 S2 -","- C42 H62 Mn2 N6 O18 S4 -","2","1","","Zitzer, Christina; Muesmann, Thomas W. T.; Christoffers, Jens; Wickleder, Mathias S.","1,4-Benzenedisulfonic acid (H2BDS) as terephthalic acid analogue for the preparation of coordination polymers: the examples of M(BDS)(NMP)3(M = Mn, Fe, Co; NMP = N-methylpyrrolidone)","New J. Chem.","2015","39","8","6117","","10.1039/C5NJ00223K","","","0.71073","MoKα","","0.0482","0.03","","","0.0701","0.0745","","","","","","0.936","","","","has coordinates","153259","2020-10-21","18:00:00",""
"7054892","14.4054","0.0013","6.3686","0.0005","25.906","0.003","90","","101.775","0.01","90","","2326.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(3-methoxyphenyl)bezothiazole","","- C22.4 H17.6 N1.6 O1.6 S1.6 -","- C22.4 H17.6 N1.6 O1.6 S1.6 -","- C112 H88 N8 O8 S8 -","5","1.25","","Sharma, Pankaj; Gupta, Monika; Kant, Rajni; Gupta, Vivek K.","Formation of a nanorod shaped ionogel and its high catalytic activity for one-pot synthesis of benzothiazoles","New J. Chem.","2015","39","7","5116","","10.1039/C5NJ00454C","","","0.71073","MoKα","","0.2778","0.1935","","","0.4242","0.4848","","","","","","1.061","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7054893","6.4256","0.0002","12.2609","0.0004","13.0947","0.0005","94.561","0.002","101.729","0.002","94.97","0.002","1001.31","0.06","193","2","193","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C19 H16 Br N2 O7 Re -","- C19 H16 Br N2 O7 Re -","- C38 H32 Br2 N4 O14 Re2 -","2","1","","Carreño, Alexander; Gacitua, Manuel; Schott, Eduardo; Zarate, Ximena; Manriquez, Juan Manuel; Preite, Marcelo; Ladeira, Sonia; Castel, Annie; Pizarro, Nancy; Vega, Andrés; Chavez, Ivonne; Arratia-Perez, Ramiro","Experimental and theoretical studies of the ancillary ligand (E)-2-((3-amino-pyridin-4-ylimino)-methyl)-4,6-di-tert-butylphenol in the rhenium(i) core","New J. Chem.","2015","39","7","5725","","10.1039/C5NJ00772K","","x-ray","0.71073","MoKα","","0.0347","0.0326","","","0.0786","0.0795","","","","","","1.196","","","","has coordinates,has disorder","143728","2020-10-21","18:00:00",""
"7054894","7.2519","0.0003","11.3182","0.0005","13.2908","0.0007","91.507","0.002","98.145","0.003","94.768","0.002","1075.35","0.09","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(2E)-N-(3-methylphenyl)-2-{2-[(2-oxo-2H-chromen-3-yl)methoxy]benzylidene}hydrazinecarbothioamide","","- C25 H21 N3 O3 S -","- C25 H21 N3 O3 S -","- C50 H42 N6 O6 S2 -","2","1","","Hameed, Aminah; Shafiq, Zahid; Yaqub, Muhammad; Hussain, Mazhar; Ahmad, Hafiz Badaruddin; Tahir, Muhammad Nawaz; Naseer, Muhammad Moazzam","Robustness of a thioamide {⋯H‒N‒CS}2synthon: synthesis and the effect of substituents on the formation of layered to cage-like supramolecular networks in coumarin‒thiosemicarbazone hybrids","New J. Chem.","2015","39","8","6052","","10.1039/C5NJ00734H","","","0.71073","MoKα","","0.0453","0.0362","","","0.0969","0.1052","","","","","","1.023","","","","has coordinates","153257","2020-10-21","18:00:00",""
"7054895","13.2436","0.0006","18.3753","0.001","19.6353","0.0011","90","","102.698","0.002","90","","4661.5","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2E)-N-(2,4-dichlorophenyl)-2-(2,3,4,4a-tetrahydro-1H-xanthen-1-ylidene)hydrazinecarbothioamide","","- C52 H46 N6 O9 S2 -","- C52 H46 N6 O9 S2 -","- C208 H184 N24 O36 S8 -","4","1","","Hameed, Aminah; Shafiq, Zahid; Yaqub, Muhammad; Hussain, Mazhar; Ahmad, Hafiz Badaruddin; Tahir, Muhammad Nawaz; Naseer, Muhammad Moazzam","Robustness of a thioamide {⋯H‒N‒CS}2synthon: synthesis and the effect of substituents on the formation of layered to cage-like supramolecular networks in coumarin‒thiosemicarbazone hybrids","New J. Chem.","2015","39","8","6052","","10.1039/C5NJ00734H","","","0.71073","MoKα","","0.0767","0.0436","","","0.1013","0.12","","","","","","1.015","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7054896","16.0381","0.0011","9.7005","0.0007","15.3686","0.0009","90","","108.349","0.002","90","","2269.4","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(2E)-N-(2,4-dichlorophenyl)-2-{2-[(2-oxo-2H-chromen-3-yl)methoxy]benzylidene}hydrazinecarbothioamide","","- C24 H17 Cl2 N3 O3 S -","- C24 H17 Cl2 N3 O3 S -","- C96 H68 Cl8 N12 O12 S4 -","4","1","","Hameed, Aminah; Shafiq, Zahid; Yaqub, Muhammad; Hussain, Mazhar; Ahmad, Hafiz Badaruddin; Tahir, Muhammad Nawaz; Naseer, Muhammad Moazzam","Robustness of a thioamide {⋯H‒N‒CS}2synthon: synthesis and the effect of substituents on the formation of layered to cage-like supramolecular networks in coumarin‒thiosemicarbazone hybrids","New J. Chem.","2015","39","8","6052","","10.1039/C5NJ00734H","","","0.71073","MoKα","","0.0618","0.0394","","","0.0951","0.1076","","","","","","1.023","","","","has coordinates","153257","2020-10-21","18:00:00",""
"7054897","9.6658","0.0012","13.5399","0.0017","11.4516","0.0013","90","","98.777","0.012","90","","1481.2","0.3","295","2","295","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C28 H36 N4 Ni O10 -","- C28 H36 N4 Ni O10 -","- C56 H72 N8 Ni2 O20 -","2","1","","Wojciechowska, Agnieszka; Janczak, Jan; Staszak, Zbigniew; Duczmal, Marek; Zierkiewicz, Wiktor; Tokar, Jadwiga; Ozarowski, Andrew","Structural, spectroscopic, magnetic behavior and DFT investigations ofl-tyrosinato nickel(ii) coordination polymer","New J. Chem.","2015","39","9","6813","","10.1039/C5NJ00972C","","","0.71073","MoKα","","0.2051","0.0854","","","0.073","0.0944","","","","","","1.008","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054898","12.7123","0.001","20.3964","0.0015","24.7167","0.0019","90","","90","","90","","6408.7","0.8","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C28 H48 Si4 Th -","- C28 H48 Si4 Th -","- C224 H384 Si32 Th8 -","8","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0605","0.0372","","","0.074","0.0835","","","","","","1.022","","","","has coordinates","162127","2020-10-21","18:00:00",""
"7054899","12.6598","0.0012","20.3542","0.0018","24.645","0.002","90","","90","","90","","6350.5","1","473","2","473","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C28 H48 Si4 U -","- C28 H48 Si4 U -","- C224 H384 Si32 U8 -","8","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0362","0.0238","","","0.065","0.0838","","","","","","1.17","","","","has coordinates","162127","2020-10-21","18:00:00",""
"7054900","20.999","0.0012","25.1674","0.0015","17.8458","0.001","90","","114.316","0.001","90","","8594.7","0.9","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H64 Si6 Th -","- C34 H64 Si6 Th -","- C272 H512 Si48 Th8 -","8","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0462","0.0301","","","0.0601","0.0675","","","","","","1.035","","","","has coordinates","162127","2020-10-21","18:00:00",""
"7054901","23.381","0.003","21.17","0.003","18.125","0.002","90","","107.923","0.002","90","","8536.1","1.9","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C68 H128 Si12 U2 -","- C68 H128 Si12 U2 -","- C272 H512 Si48 U8 -","4","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0856","0.0421","","","0.0858","0.1127","","","","","","1.128","","","","has coordinates,has disorder","162127","2020-10-21","18:00:00",""
"7054902","11.358","0.002","11.657","0.002","19.603","0.004","87.12","0.03","82.38","0.03","77.39","0.03","2509.9","0.9","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H80 Ho Li O4 Si4 -","- C44 H80 Ho Li O4 Si4 -","- C88 H160 Ho2 Li2 O8 Si8 -","2","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0735","0.0491","","","0.0805","0.0859","","","","","","1.034","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054903","11.358","0.002","11.657","0.002","19.603","0.004","87.12","0.03","82.38","0.03","77.39","0.03","2509.9","0.9","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H80 Li O4 Si4 Tm -","- C44 H80 Li O4 Si4 Tm -","- C88 H160 Li2 O8 Si8 Tm2 -","2","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0408","0.039","","","0.1003","0.1015","","","","","","1.104","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054904","11.557","0.002","12.262","0.003","18.34","0.004","98.83","0.03","102.56","0.03","98.57","0.03","2461.5","1","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H78 La Li O6 Si4 -","- C40 H78 La Li O6 Si4 -","- C80 H156 La2 Li2 O12 Si8 -","2","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0467","0.0381","","","0.0917","0.0944","","","","","","1.047","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054905","11.532","0.002","12.286","0.003","18.388","0.004","98.82","0.03","102.49","0.03","99.04","0.03","2464.1","1","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H78 Li O6 Pr Si4 -","- C40 H78 Li O6 Pr Si4 -","- C80 H156 Li2 O12 Pr2 Si8 -","2","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0304","0.0267","","","0.0648","0.0662","","","","","","1.044","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054906","11.428","0.002","12.216","0.002","18.406","0.004","98.84","0.03","102.36","0.03","99.44","0.03","2428","0.9","133","2","133","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H78 Gd Li O6 Si4 -","- C40 H78 Gd Li O6 Si4 -","- C80 H156 Gd2 Li2 O12 Si8 -","2","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0379","0.0333","","","0.0865","0.0883","","","","","","1.049","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054907","11.445","0.002","12.219","0.002","18.477","0.004","99.13","0.03","102.2","0.03","99.68","0.03","2438.5","0.9","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H78 Li O6 Si4 Y -","- C40 H78 Li O6 Si4 Y -","- C80 H156 Li2 O12 Si8 Y2 -","2","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0697","0.0467","","","0.0949","0.1018","","","","","","0.978","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054908","11.471","0.002","12.051","0.002","18.459","0.004","99.79","0.03","101.72","0.03","100.05","0.03","2403.7","0.9","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H78 Li Lu O6 Si4 -","- C40 H78 Li Lu O6 Si4 -","- C80 H156 Li2 Lu2 O12 Si8 -","2","1","","Rausch, Janek; Apostolidis, Christos; Walter, Olaf; Lorenz, Volker; Hrib, Cristian G.; Hilfert, Liane; Kühling, Marcel; Busse, Sabine; Edelmann, Frank T.","One ligand fits all: lanthanide and actinide sandwich complexes comprising the 1,4-bis(trimethylsilyl)cyclooctatetraenyl (=COT′′) ligand","New J. Chem.","2015","39","10","7656","","10.1039/C5NJ00991J","","","0.71073","MoKα","","0.0597","0.0557","","","0.1447","0.1473","","","","","","1.093","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054909","12.111","0.0004","7.1701","0.0003","13.5948","0.0005","90","","98.151","0.003","90","","1168.61","0.08","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H22 Ni O4 S4 -","- C22 H22 Ni O4 S4 -","- C44 H44 Ni2 O8 S8 -","2","1","","Yadav, Manoj Kumar; Rajput, Gunjan; Srivastava, Khushboo; Singh, Rakesh K.; Mishra, Rajnikant; Drew, Michael G. B.; Singh, Nanhai","Anti-leishmanial activity of Ni(ii), Pd(ii) and Pt(ii) β-oxodithioester complexes","New J. Chem.","2015","39","8","6358","","10.1039/C5NJ00765H","","","0.71073","MoKα","","0.045","0.0343","","","0.0729","0.0781","","","","","","0.946","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054910","12.2291","0.0009","4.016","0.0004","23.0003","0.0015","75.3","0.007","84.316","0.006","69.691","0.008","1024.62","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H16 F2 Ni O2 S4 -","- C20 H16 F2 Ni O2 S4 -","- C40 H32 F4 Ni2 O4 S8 -","2","1","","Yadav, Manoj Kumar; Rajput, Gunjan; Srivastava, Khushboo; Singh, Rakesh K.; Mishra, Rajnikant; Drew, Michael G. B.; Singh, Nanhai","Anti-leishmanial activity of Ni(ii), Pd(ii) and Pt(ii) β-oxodithioester complexes","New J. Chem.","2015","39","8","6358","","10.1039/C5NJ00765H","","","0.71073","MoKα","","0.0904","0.0545","","","0.1001","0.1191","","","","","","0.993","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054911","24.946","0.004","5.8062","0.001","17.003","0.003","90","","91.8","0.013","90","","2461.5","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 Ni O2 S4 -","- C28 H22 Ni O2 S4 -","- C112 H88 Ni4 O8 S16 -","4","1","","Yadav, Manoj Kumar; Rajput, Gunjan; Srivastava, Khushboo; Singh, Rakesh K.; Mishra, Rajnikant; Drew, Michael G. B.; Singh, Nanhai","Anti-leishmanial activity of Ni(ii), Pd(ii) and Pt(ii) β-oxodithioester complexes","New J. Chem.","2015","39","8","6358","","10.1039/C5NJ00765H","","","0.71073","MoKα","","0.1046","0.0664","","","0.1555","0.178","","","","","","1.007","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054912","17.4781","0.0005","17.4781","0.0005","15.3714","0.0004","90","","90","","90","","4695.7","0.2","293","2","293","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C22 H22 O4 Pd S4 -","- C22 H22 O4 Pd S4 -","- C176 H176 O32 Pd8 S32 -","8","0.5","","Yadav, Manoj Kumar; Rajput, Gunjan; Srivastava, Khushboo; Singh, Rakesh K.; Mishra, Rajnikant; Drew, Michael G. B.; Singh, Nanhai","Anti-leishmanial activity of Ni(ii), Pd(ii) and Pt(ii) β-oxodithioester complexes","New J. Chem.","2015","39","8","6358","","10.1039/C5NJ00765H","","","0.71073","MoKα","","0.0526","0.0327","","","0.075","0.0811","","","","","","1.076","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054913","13.3438","0.0005","16.6915","0.0007","11.665","0.0005","90","","106.87","0.004","90","","2486.31","0.18","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 O2 Pt S4 -","- C28 H22 O2 Pt S4 -","- C112 H88 O8 Pt4 S16 -","4","1","","Yadav, Manoj Kumar; Rajput, Gunjan; Srivastava, Khushboo; Singh, Rakesh K.; Mishra, Rajnikant; Drew, Michael G. B.; Singh, Nanhai","Anti-leishmanial activity of Ni(ii), Pd(ii) and Pt(ii) β-oxodithioester complexes","New J. Chem.","2015","39","8","6358","","10.1039/C5NJ00765H","","","0.71073","MoKα","","0.0839","0.0498","","","0.0819","0.0942","","","","","","0.925","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054914","9.3992","0.0008","16.827","0.0011","10.9101","0.0009","90","","112.042","0.01","90","","1599.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-amino-4-(4-chlorophenyl)-6,6,8,8-tetrahydro-7, 7-dimethyl-5-oxo-4H-chromene-3-carbonitrile","","- C18 H17 Cl N2 O2 -","- C18 H17 Cl N2 O2 -","- C72 H68 Cl4 N8 O8 -","4","1","","Gupta, Manjulla; Gupta, Monika; Rajnikant, Rajnikant; Gupta, Vivek K.","Salicyldimine-based Schiff's complex of copper(ii) as an efficient catalyst for the synthesis of nitrogen and oxygen heterocycles","New J. Chem.","2015","39","5","3578","","10.1039/C4NJ02391A","","","0.71073","MoKα","","0.0794","0.0472","","","0.1039","0.1209","","","","","","1.028","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054915","7.2856","0.0005","18.1056","0.0011","27.2497","0.0014","90","","90","","90","","3594.5","0.4","171.2","","171.2","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(Z)-1-(4-(dimethylamino)phenyl)-2-(phenanthridin-6-yl)ethenol difluoroboron","","- C23 H19 B F2 N2 O -","- C23 H19 B F2 N2 O -","- C184 H152 B8 F16 N16 O8 -","8","1","","Wu, Ding-Er; Lu, Xiao-Lin; Xia, Min","Study on the solution and solid-state fluorescence of novel BF2complexes with (Z)-2-[phenanthridin-6(5H)-ylidene]-1-phenylethanone and its derivatives as ligands","New J. Chem.","2015","39","8","6465","","10.1039/C5NJ00926J","","","0.71073","MoKα","","0.0633","0.0414","","","0.0935","0.1039","","","","","","1.029","","","","has coordinates","153251","2020-10-21","18:00:00",""
"7054916","30.2538","0.0015","7.7757","0.0004","13.4669","0.0008","90","","90","","90","","3168","0.3","293","2","293.15","","","","","","","","","6","P n a 21","P 2c -2n","33","","(Z)-2-(phenanthridin-6-yl)-1-phenylethenol difluoroboron","","- C21 H14 B F2 N O -","- C21 H14 B F2 N O -","- C168 H112 B8 F16 N8 O8 -","8","2","","Wu, Ding-Er; Lu, Xiao-Lin; Xia, Min","Study on the solution and solid-state fluorescence of novel BF2complexes with (Z)-2-[phenanthridin-6(5H)-ylidene]-1-phenylethanone and its derivatives as ligands","New J. Chem.","2015","39","8","6465","","10.1039/C5NJ00926J","","","0.71073","MoKα","","0.0525","0.0372","","","0.0771","0.0848","","","","","","1.059","","","","has coordinates","153251","2020-10-21","18:00:00",""
"7054917","18.6008","0.001","9.9127","0.0005","18.2252","0.0009","90","","90","","90","","3360.4","0.3","150","0.2","150","0.2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C8 H40 N2 Na2 O27 V2 W4 -","- C8 H24 N2 Na2 O27 V2 W4 -","- C32 H96 N8 Na8 O108 V8 W16 -","4","0.5","","Abramov, Pavel A.; Peresypkina, Eugenia V.; Izarova, Natalia V.; Vicent, Cristian; Zhdanov, Artem A.; Kompankov, Nikolay B.; Gutsul, Tatiana; Sokolov, Maxim N.","Polyoxoanions assembled by the condensation of vanadate, tungstate and selenite: solution studies and crystal structures of the mixed metal derivatives (NMe4)2Na2[WVI4VV2O19]·8H2O and (NMe4)4.83[(SeIVWVI4.57VV4.43O33)2(WVI(O)(H2O))(VVO)2.6]·10.57H2O","New J. Chem.","2016","40","2","937","","10.1039/C5NJ00858A","","","0.71073","MoKα","","0.0569","0.0513","","","0.107","0.1095","","","","","","1.188","","","","has coordinates","177892","2020-10-21","18:00:00",""
"7054918","19.4257","0.0011","21.2136","0.0011","12.9194","0.0006","90","","90","","90","","5323.9","0.5","150","2","150","2","","","","","","","","7","P n n 2","P 2 -2n","34","","","","- C19.32 H81.1 N4.83 O81.17 Se2 V11.46 W10.14 -","- C19.32 H57.96 N4.83 O81.17 Se2 V11.46 W10.14 -","- C38.64 H115.92 N9.66 O162.34 Se4 V22.92 W20.28 -","2","0.5","","Abramov, Pavel A.; Peresypkina, Eugenia V.; Izarova, Natalia V.; Vicent, Cristian; Zhdanov, Artem A.; Kompankov, Nikolay B.; Gutsul, Tatiana; Sokolov, Maxim N.","Polyoxoanions assembled by the condensation of vanadate, tungstate and selenite: solution studies and crystal structures of the mixed metal derivatives (NMe4)2Na2[WVI4VV2O19]·8H2O and (NMe4)4.83[(SeIVWVI4.57VV4.43O33)2(WVI(O)(H2O))(VVO)2.6]·10.57H2O","New J. Chem.","2016","40","2","937","","10.1039/C5NJ00858A","","","1.54178","CuKα","","0.0693","0.0499","","","0.1306","0.1464","","","","","","1.062","","","","has coordinates,has disorder","192777","2020-10-21","18:00:00",""
"7054919","5.8652","0.0005","9.6315","0.0008","34.423","0.002","90","","94.403","0.007","90","","1938.8","0.3","175","","175","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H29 N O2 -","- C22 H29 N O2 -","- C88 H116 N4 O8 -","4","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.1074","0.0739","","0.0518","0.0467","0.0467","","","","","","1.1624","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054920","9.1728","0.0005","13.3311","0.0005","13.1709","0.0006","90","","107.107","0.005","90","","1539.33","0.13","175","","175","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 N O2 -","- C18 H21 N O2 -","- C72 H84 N4 O8 -","4","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.0719","0.0629","","0.0609","0.0599","0.0599","","","","","","0.9423","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054921","4.6306","0.0008","8.8802","0.0017","23.893","0.003","95.744","0.013","91.859","0.012","101.739","0.015","955.7","0.3","175","","175","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H26 N2 O3 -","- C21 H26 N2 O3 -","- C42 H52 N4 O6 -","2","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.2757","0.0836","","0.1788","0.0897","0.0897","","","","","","1.0036","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054922","9.6623","0.0003","13.1399","0.0004","13.4402","0.0004","96.42","0.003","103.728","0.003","92.257","0.003","1643.4","0.09","175","","175","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H21 N O -","- C21 H21 N O -","- C84 H84 N4 O4 -","4","2","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.0928","0.0678","","0.0752","0.0662","0.0662","","","","","","1.0757","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054923","5.0416","0.00018","13.6467","0.0005","31.0182","0.0011","90","","94.55","0.003","90","","2127.36","0.13","175","","175","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H27 N O6 -","- C25 H27 N O6 -","- C100 H108 N4 O24 -","4","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.0691","0.052","","0.062","0.0549","0.0549","","","","","","1.1293","","","","has coordinates,has disorder","204135","2020-10-21","18:00:00",""
"7054924","46.312","0.003","46.312","0.003","5.6266","0.0005","90","","90","","120","","10451.1","1.3","175","","175","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C29.166 H31.25 N1.08 -","- C29.1667 H31 N1.08333 -","- C525 H558 N19.5 -","18","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.2244","0.0713","","0.0893","0.0424","0.0424","","","","","","1.1478","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054925","8.2148","0.0003","9.5771","0.0003","12.8008","0.0005","73.643","0.003","73.317","0.003","89.653","0.003","922.58","0.06","175","","175","","","","","","","","","3","P -1","-P 1","2","","","","- C25 H23 N -","- C25 H23 N -","- C50 H46 N2 -","2","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.0941","0.063","","0.0737","0.0682","0.0682","","","","","","1.0521","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054926","19.8394","0.0007","8.7672","0.0003","13.8699","0.0006","90","","101.793","0.003","90","","2361.55","0.16","175","","175","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H29 N O5 -","- C29 H29 N O5 -","- C116 H116 N4 O20 -","4","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.1132","0.0714","","0.077","0.06","0.06","","","","","","1.1188","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054927","7.66","0.0006","8.1559","0.0006","20.1223","0.0013","91.773","0.005","94.378","0.006","112.4","0.007","1156.42","0.16","2175","","175","","","","","","","","","3","P -1","-P 1","2","","","","- C31 H31 N -","- C31 H31 N -","- C62 H62 N2 -","2","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","0.71073","MoKα","","0.0974","0.0617","","0.0817","0.063","0.063","","","","","","1.1063","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054928","20.21","0.004","4.7596","0.0011","20.15","0.003","90","","90.938","0.014","90","","1938","0.7","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 N -","- C27 H23 N -","- C108 H92 N4 -","4","1","","Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail","Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission","New J. Chem.","2015","39","8","6404","","10.1039/C5NJ01052G","","","1.54184","CuKα","","0.1535","0.0918","","0.1505","0.0952","0.0952","","","","","","1.0365","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054929","8.4814","0.0003","11.4048","0.0004","11.4291","0.0004","96.622","0.003","99.334","0.003","104.274","0.003","1043.17","0.07","200","0.1","200","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C22 H26 Cl Ir N2 O -","- C22 H26 Cl Ir N2 O -","- C44 H52 Cl2 Ir2 N4 O2 -","2","1","","Iglesias, Diego; Sabater, Sara; Azua, Arturo; Mata, Jose A.","Catalytic applications of magnetic nanoparticles functionalized using iridium N-heterocyclic carbene complexes","New J. Chem.","2015","39","8","6437","","10.1039/C5NJ00803D","","","1.5418","CuKα","","0.0289","0.0259","","","0.0634","0.0651","","","","","","1.057","","","","has coordinates","153245","2020-10-21","18:00:00",""
"7054930","7.315","0.004","7.088","0.004","20.776","0.013","90","","90.069","0.018","90","","1077.2","1.1","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 N4 O6 S2 -","- C20 H22 N4 O6 S2 -","- C40 H44 N8 O12 S4 -","2","0.5","","Calahorro, Antonio J.; Fernández, Belén; García-Gallarín, Celeste; Melguizo, Manuel; Fairen-Jimenez, David; Zaragoza, Guillermo; Salinas-Castillo, Alfonso; Gómez-Ruiz, Santiago; Rodríguez-Diéguez, Antonio","Towards a potential 4,4′-(1,2,4,5-tetrazine-3,6-diyl) dibenzoic spacer to construct metal‒organic frameworks","New J. Chem.","2015","39","8","6453","","10.1039/C5NJ00524H","","x-ray","0.7107","MoKα","","0.0866","0.0602","","","0.1379","0.1532","","","","","","1.016","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054931","5.97","0.001","6.738","0.0012","34.5","0.006","90","","94.68","0.005","90","","1383.2","0.4","100","2","100","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C16 H9 K N4 O4 -","- C16 H9 K N4 O4 -","- C64 H36 K4 N16 O16 -","4","0.5","","Calahorro, Antonio J.; Fernández, Belén; García-Gallarín, Celeste; Melguizo, Manuel; Fairen-Jimenez, David; Zaragoza, Guillermo; Salinas-Castillo, Alfonso; Gómez-Ruiz, Santiago; Rodríguez-Diéguez, Antonio","Towards a potential 4,4′-(1,2,4,5-tetrazine-3,6-diyl) dibenzoic spacer to construct metal‒organic frameworks","New J. Chem.","2015","39","8","6453","","10.1039/C5NJ00524H","","x-ray","1.54178","CuKα","","0.0474","0.0413","","","0.0972","0.1006","","","","","","1.148","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054932","10.225","0.005","13.53","0.006","15.503","0.008","90","","102.795","0.009","90","","2091.5","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 Co N5 O4 -","- C22 H19 Co N5 O4 -","- C88 H76 Co4 N20 O16 -","4","1","","Li, Xiaoju; Sun, Xiaofei; Li, Xinxiong; Xu, Xiahong","Syntheses and characterizations of six Co(ii) and Mn(ii) coordination polymers based on amino-substituted 5-aminoisophthalate and flexible bis(imidazolyl) ligands","New J. Chem.","2015","39","9","6844","","10.1039/C5NJ00706B","","","0.71073","MoKα","","0.0853","0.054","","","0.1043","0.1205","","","","","","1.078","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054933","6.63","0.004","10.167","0.005","12.475","0.007","109.11","0.03","103.7","0.02","100.43","0.03","740.7","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H14 Co N3 O5 -","- C15 H14 Co N3 O5 -","- C30 H28 Co2 N6 O10 -","2","1","","Li, Xiaoju; Sun, Xiaofei; Li, Xinxiong; Xu, Xiahong","Syntheses and characterizations of six Co(ii) and Mn(ii) coordination polymers based on amino-substituted 5-aminoisophthalate and flexible bis(imidazolyl) ligands","New J. Chem.","2015","39","9","6844","","10.1039/C5NJ00706B","","","0.71073","MoKα","","0.0487","0.0372","","","0.082","0.0878","","","","","","1.05","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054934","11.695","0.003","12.743","0.003","13.731","0.003","79.51","0.004","82.465","0.006","84.529","0.005","1989.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H38 Mn2 N10 O8 -","- C44 H38 Mn2 N10 O8 -","- C88 H76 Mn4 N20 O16 -","2","1","","Li, Xiaoju; Sun, Xiaofei; Li, Xinxiong; Xu, Xiahong","Syntheses and characterizations of six Co(ii) and Mn(ii) coordination polymers based on amino-substituted 5-aminoisophthalate and flexible bis(imidazolyl) ligands","New J. Chem.","2015","39","9","6844","","10.1039/C5NJ00706B","","","0.71073","MoKα","","0.0606","0.0522","","","0.1838","0.1925","","","","","","1.003","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054935","9.888","0.006","19.869","0.012","15.089","0.01","90","","101.072","0.012","90","","2909","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H34 Mn N6 O7 -","- C27 H34 Mn N6 O7 -","- C108 H136 Mn4 N24 O28 -","4","1","","Li, Xiaoju; Sun, Xiaofei; Li, Xinxiong; Xu, Xiahong","Syntheses and characterizations of six Co(ii) and Mn(ii) coordination polymers based on amino-substituted 5-aminoisophthalate and flexible bis(imidazolyl) ligands","New J. Chem.","2015","39","9","6844","","10.1039/C5NJ00706B","","","0.71073","MoKα","","0.1126","0.0691","","","0.1546","0.1784","","","","","","1.179","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054936","12.8113","0.001","7.8747","0.0006","15.8919","0.0017","90","","90.871","0.008","90","","1603.1","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Co N3 O5 -","- C16 H16 Co N3 O5 -","- C64 H64 Co4 N12 O20 -","4","1","","Li, Xiaoju; Sun, Xiaofei; Li, Xinxiong; Xu, Xiahong","Syntheses and characterizations of six Co(ii) and Mn(ii) coordination polymers based on amino-substituted 5-aminoisophthalate and flexible bis(imidazolyl) ligands","New J. Chem.","2015","39","9","6844","","10.1039/C5NJ00706B","","","0.71073","MoKα","","0.0362","0.0322","","","0.0845","0.088","","","","","","1.095","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054937","10.464","0.0019","11.5072","0.0012","16.689","0.002","90","","102.865","0.008","90","","1959.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 Mn N4 O4 -","- C21 H17 Mn N4 O4 -","- C84 H68 Mn4 N16 O16 -","4","1","","Li, Xiaoju; Sun, Xiaofei; Li, Xinxiong; Xu, Xiahong","Syntheses and characterizations of six Co(ii) and Mn(ii) coordination polymers based on amino-substituted 5-aminoisophthalate and flexible bis(imidazolyl) ligands","New J. Chem.","2015","39","9","6844","","10.1039/C5NJ00706B","","","0.71073","MoKα","","0.0472","0.0393","","","0.0924","0.0973","","","","","","1.09","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054938","8.0971","0.0001","12.4447","0.0002","13.3768","0.0003","87.181","0.002","80.232","0.001","88.15","0.001","1326.39","0.04","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H14 N2 O2 S2 -","- C12 H14 N2 O2 S2 -","- C48 H56 N8 O8 S8 -","4","2","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.051","0.032","","","0.0834","0.0867","","","","","","1.004","","","","has coordinates","139390","2020-10-21","18:00:00",""
"7054939","8.4275","0.0002","16.8324","0.0004","11.6886","0.0002","90","","97.869","0.002","90","","1642.47","0.06","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N2 O2 S2 -","- C17 H16 N2 O2 S2 -","- C68 H64 N8 O8 S8 -","4","1","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.0952","0.0394","","","0.0794","0.0854","","","","","","1.004","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054940","29.3586","0.0016","5.6119","0.0002","24.116","0.0015","90","","122.985","0.008","90","","3332.8","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H16 N2 O2 S2 -","- C17 H16 N2 O2 S2 -","- C136 H128 N16 O16 S16 -","8","1","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.1011","0.0444","","","0.0866","0.0915","","","","","","1.005","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054941","8.3288","0.0002","11.2945","0.0002","17.1609","0.0004","90","","100.643","0.002","90","","1586.55","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 F N2 O2 S2 -","- C16 H13 F N2 O2 S2 -","- C64 H52 F4 N8 O8 S8 -","4","1","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.0992","0.0612","","","0.1231","0.1402","","","","","","1.001","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054942","11.226","0.002","10.807","0.002","14.909","0.003","90","","110.24","0.03","90","","1697.1","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 N3 O4 S2 -","- C16 H13 N3 O4.088 S2 -","- C64 H52 N12 O16.352 S8 -","4","1","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.0572","0.046","","","0.1073","0.1126","","","","","","1.127","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054943","8.6156","0.0002","20.584","0.0004","9.6518","0.0002","90","","101.108","0.002","90","","1679.62","0.06","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 N2 O3 S2 -","- C17 H16 N2 O3 S2 -","- C68 H64 N8 O12 S8 -","4","1","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.06","0.0342","","","0.0756","0.079","","","","","","1.006","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054944","28.3814","0.0008","6.2777","0.0001","21.502","0.0007","90","","117.043","0.004","90","","3412.1","0.2","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H13 I N2 O2 S2 -","- C16 H13 I N2 O2 S2 -","- C128 H104 I8 N16 O16 S16 -","8","1","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.0449","0.0316","","","0.0746","0.0815","","","","","","1.001","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054945","11.0502","0.0003","11.554","0.0004","13.7697","0.0004","66.109","0.003","84.184","0.002","77.048","0.002","1566.4","0.09","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H14 N2 O2 S2 -","- C16 H14 N2 O2 S2 -","- C64 H56 N8 O8 S8 -","4","2","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","0.0783","0.0397","","","0.0798","0.0841","","","","","","1.007","","","","has coordinates","139390","2020-10-21","18:00:00",""
"7054946","7.9295","0.0016","11.306","0.002","14.113","0.003","90","","99.94","0.03","90","","1246.3","0.4","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","sulphonly compound","","","- C11 H12 N2 O2 S2 -","- C11 H12 N2 O2 S2 -","- C44 H48 N8 O8 S8 -","4","1","","Schneider, Thomas H.; Rieger, Max; Ansorg, Kay; Sobolev, Alexandre N.; Schirmeister, Tanja; Engels, Bernd; Grabowsky, Simon","Vinyl sulfone building blocks in covalently reversible reactions with thiols","New J. Chem.","2015","","","","","10.1039/C5NJ00368G","","","0.71073","MoKα","","","0.026495","","","","0.020287","0.027655","","","","","1.707","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054947","13.7002","0.0006","13.9301","0.0008","15.2548","0.0005","108.998","0.004","106.363","0.004","97.835","0.004","2556.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H148 N6 O9 Si4 Sm2 -","- C88 H148 N6 O9 Si4 Sm2 -","- C88 H148 N6 O9 Si4 Sm2 -","1","0.5","","Cheng, Hao; Xiao, Yang; Lu, Chengrong; Zhao, Bei; Wang, Yaorong; Yao, Yingming","Synthesis and characterization of bis(amidate) rare-earth metal amides and their application in catalytic addition of amines to carbodiimides","New J. Chem.","2015","39","10","7667","","10.1039/C5NJ00506J","","","0.71073","MoKα","","0.0432","0.0349","","","0.0979","0.1012","","","","","","1.128","","","","has coordinates,has disorder","162123","2020-10-21","18:00:00",""
"7054948","13.7","0.016","14","0.03","15.31","0.02","109.37","0.04","105.895","0.008","98.64","0.02","2569","7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C88 H148 N6 O9 Si4 Yb2 -","- C88 H148 N6 O9 Si4 Yb2 -","- C88 H148 N6 O9 Si4 Yb2 -","1","0.5","","Cheng, Hao; Xiao, Yang; Lu, Chengrong; Zhao, Bei; Wang, Yaorong; Yao, Yingming","Synthesis and characterization of bis(amidate) rare-earth metal amides and their application in catalytic addition of amines to carbodiimides","New J. Chem.","2015","39","10","7667","","10.1039/C5NJ00506J","","","0.71075","MoKα","","0.0601","0.0492","","","0.1178","0.1272","","","","","","1.085","","","","has coordinates,has disorder","162123","2020-10-21","18:00:00",""
"7054949","6.9927","0.0004","8.0857","0.0005","14.201","0.0009","101.016","0.001","95.091","0.001","101.324","0.001","766.12","0.08","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H15 Ca N O9 P2 -","- C10 H15 Ca N O9 P2 -","- C20 H30 Ca2 N2 O18 P4 -","2","1","","Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen","Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure","New J. Chem.","2015","39","8","6611","","10.1039/C5NJ00656B","","","0.71073","MoKα","","0.0378","0.0325","","","0.0847","0.0889","","","","","","1.038","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054950","6.0359","0.0006","8.0803","0.0008","16.5511","0.0015","93.878","0.002","95.273","0.001","102.285","0.002","782.25","0.13","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H17 N O10 P2 Sr -","- C10 H17 N O10 P2 Sr -","- C20 H34 N2 O20 P4 Sr2 -","2","1","","Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen","Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure","New J. Chem.","2015","39","8","6611","","10.1039/C5NJ00656B","","","0.71073","MoKα","","0.0503","0.0379","","","0.0874","0.0929","","","","","","1.015","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054951","5.4566","0.0007","8.6781","0.0012","16.081","0.002","92.8","0.002","92.173","0.002","105.253","0.002","732.76","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H15 Ba N O9 P2 -","- C10 H15 Ba N O9 P2 -","- C20 H30 Ba2 N2 O18 P4 -","2","1","","Luo, Hui; Ma, Chao; Jiao, Cheng-Qi; Sun, Zhen-Gang; Sun, Tong; Ma, Ming-Xue; Zhu, Yan-Yu; Li, Wen-Zhu; Wang, Mei-Ling; Zhang, Xiao-Wen","Synthesis, structures, luminescent and molecular recognition properties of three new alkaline earth metal carboxyphosphonates with a 3D supramolecular structure","New J. Chem.","2015","39","8","6611","","10.1039/C5NJ00656B","","","0.71","MoKα","","0.0595","0.0529","","","0.1508","0.1557","","","","","","1.028","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054952","15.0078","0.0008","15.5458","0.0008","18.4958","0.001","99.5345","0.0015","101.192","0.0016","113.02","0.0014","3754.1","0.4","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C74 H108 N12 O6 -","- C74 H107 N12 O6 -","- C148 H214 N24 O12 -","2","1","","Alavijeh, Nahid S.; Zadmard, Reza; Ramezanpour, Sorour; Balalaie, Saeed; Alavijeh, Mohammad S.; Rominger, Frank","Efficient synthesis of lower rim α-hydrazino tetrazolocalix[4]arenes via an Ugi-azide multicomponent reaction","New J. Chem.","2015","39","8","6578","","10.1039/C5NJ00845J","","","0.71073","MoKα","","0.1261","0.0877","","","0.2548","0.2872","","","","","","1.063","","","","has coordinates,has disorder","153252","2020-10-21","18:00:00",""
"7054953","8.3325","0.0002","10.9016","0.0002","12.7875","0.0003","102.314","0.001","94.699","0.001","91.958","0.001","1129.46","0.04","150","2","150","","","","","","","","","6","P -1","-P 1","2","","","","- C19 H33 Br Ni O2 P2 -","- C19 H33 Br Ni O2 P2 -","- C38 H66 Br2 Ni2 O4 P4 -","2","1","","Salah, Abderrahmen; Corpet, Martin; ul-Hassan Khan, Najm; Zargarian, Davit; Spasyuk, Denis M.","Synthesis of unsymmetrical 5,6-POCOP′-type pincer complexes of nickel(ii): impact of nickelacycle size on structures and spectroscopic properties","New J. Chem.","2015","39","8","6649","","10.1039/C5NJ00807G","","","1.54178","CuKα","","0.034","0.032","","","0.0854","0.0869","","","","","","1.049","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054954","8.4032","0.0003","16.9796","0.0007","21.371","0.0008","90","","105.376","0.002","90","","2940.1","0.2","150","2","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 Ni O5 P2 S -","- C26 H40 Ni O5 P2 S -","- C104 H160 Ni4 O20 P8 S4 -","4","1","","Salah, Abderrahmen; Corpet, Martin; ul-Hassan Khan, Najm; Zargarian, Davit; Spasyuk, Denis M.","Synthesis of unsymmetrical 5,6-POCOP′-type pincer complexes of nickel(ii): impact of nickelacycle size on structures and spectroscopic properties","New J. Chem.","2015","39","8","6649","","10.1039/C5NJ00807G","","","1.54178","CuKα","","0.0318","0.03","","","0.0835","0.0846","","","","","","1.048","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054955","8.0422","0.0008","16.7136","0.0017","17.4731","0.0017","90.793","0.004","90.658","0.003","97.963","0.004","2325.5","0.4","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H36 Ni O2 P2 -","- C22 H36 Ni O2 P2 -","- C88 H144 Ni4 O8 P8 -","4","2","","Salah, Abderrahmen; Corpet, Martin; ul-Hassan Khan, Najm; Zargarian, Davit; Spasyuk, Denis M.","Synthesis of unsymmetrical 5,6-POCOP′-type pincer complexes of nickel(ii): impact of nickelacycle size on structures and spectroscopic properties","New J. Chem.","2015","39","8","6649","","10.1039/C5NJ00807G","","x-ray","1.54178","CuKα","","0.0552","0.0543","","","0.144","0.145","","","","","","1.057","","","","has coordinates","153244","2020-10-21","18:00:00",""
"7054956","19.7665","0.0004","17.7155","0.0004","23.8071","0.0006","90","","90","","90","","8336.6","0.3","150","2","150","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C45 H56 B N Ni O2 P2 -","- C45 H56 B N Ni O2 P2 -","- C360 H448 B8 N8 Ni8 O16 P16 -","8","1","","Salah, Abderrahmen; Corpet, Martin; ul-Hassan Khan, Najm; Zargarian, Davit; Spasyuk, Denis M.","Synthesis of unsymmetrical 5,6-POCOP′-type pincer complexes of nickel(ii): impact of nickelacycle size on structures and spectroscopic properties","New J. Chem.","2015","39","8","6649","","10.1039/C5NJ00807G","","","1.54178","CuKα","","0.038","0.0371","","","0.0979","0.0985","","","","","","1.104","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054957","8.3833","0.0002","10.8596","0.0002","12.7379","0.0003","102.681","0.001","94.204","0.001","92.443","0.001","1126.26","0.04","150","2","150","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H36 Ni O2 P2 -","- C20 H36 Ni O2 P2 -","- C40 H72 Ni2 O4 P4 -","2","1","","Salah, Abderrahmen; Corpet, Martin; ul-Hassan Khan, Najm; Zargarian, Davit; Spasyuk, Denis M.","Synthesis of unsymmetrical 5,6-POCOP′-type pincer complexes of nickel(ii): impact of nickelacycle size on structures and spectroscopic properties","New J. Chem.","2015","39","8","6649","","10.1039/C5NJ00807G","","","1.54178","CuKα","","0.0412","0.0407","","","0.1124","0.113","","","","","","1.029","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054958","37.191","0.005","10.591","0.004","25.678","0.003","90","","133.522","0.012","90","","7334","3","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H48 N7 S Sc Si4 -","- C26.002 H48.0057 N7 S Sc Si4.001 -","- C208.016 H384.046 N56 S8 Sc8 Si32.008 -","8","1","","Otero, Antonio; Lara-Sánchez, Agustín; Castro-Osma, José A.; Márquez-Segovia, Isabel; Alonso-Moreno, Carlos; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Rodríguez, Ana M.","Synthesis and structural characterization of amido heteroscorpionate rare-earth metal complexes and hydroamination of aminoalkenes","New J. Chem.","2015","39","10","7672","","10.1039/C5NJ00930H","","","0.71073","MoKα","","0.2141","0.0621","","","0.1071","0.1492","","","","","","0.871","","","","has coordinates,has disorder","162042","2020-10-21","18:00:00",""
"7054959","7.4044","0.0004","13.0468","0.0006","21.5066","0.0011","90","","90","","90","","2077.62","0.18","100","0.1","100","0.1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Methylgallium betadiketonate","","- C23 H25 Ga N2 O2 -","- C23 H25 Ga N2 O2 -","- C92 H100 Ga4 N8 O8 -","4","1","","Knapp, Caroline E.; Marchand, Peter; Dyer, Caragh; Parkin, Ivan P.; Carmalt, Claire J.","Synthesis and characterisation of novel aluminium and gallium precursors for chemical vapour deposition","New J. Chem.","2015","39","8","6585","","10.1039/C5NJ00947B","","","0.71073","MoKα","","0.0364","0.0327","","","0.0695","0.0713","","","","","","1.012","","","","has coordinates","153255","2020-10-21","18:00:00",""
"7054960","11.3771","0.0003","11.4009","0.0003","14.2678","0.0004","90","","95.242","0.003","90","","1842.92","0.09","150","","150","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","chloro gallium bis(2-N-isopropylaminopentan-4-one)","","- C16 H28 Cl Ga N2 O2 -","- C16 H28 Cl Ga N2 O2 -","- C64 H112 Cl4 Ga4 N8 O8 -","4","0.5","","Knapp, Caroline E.; Marchand, Peter; Dyer, Caragh; Parkin, Ivan P.; Carmalt, Claire J.","Synthesis and characterisation of novel aluminium and gallium precursors for chemical vapour deposition","New J. Chem.","2015","39","8","6585","","10.1039/C5NJ00947B","","","0.71073","MoKα","","0.0346","0.0298","","","0.0703","0.0734","","","","","","1.065","","","","has coordinates","153255","2020-10-21","18:00:00",""
"7054961","14.0647","0.0004","14.4468","0.0004","15.8435","0.0005","90","","90","","90","","3219.24","0.16","150","","150","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Aluminium isopropoxide betadiketonate","","- C15 H25 Al N2 O3 -","- C15 H25 Al N2 O3 -","- C120 H200 Al8 N16 O24 -","8","1","","Knapp, Caroline E.; Marchand, Peter; Dyer, Caragh; Parkin, Ivan P.; Carmalt, Claire J.","Synthesis and characterisation of novel aluminium and gallium precursors for chemical vapour deposition","New J. Chem.","2015","39","8","6585","","10.1039/C5NJ00947B","","","1.54184","CuKα","","0.0568","0.0391","","","0.0902","0.0988","","","","","","1.017","","","","has coordinates","153255","2020-10-21","18:00:00",""
"7054962","10.304","0.002","12.582","0.003","17.04","0.003","90","","98.6","0.03","90","","2184.3","0.8","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H22 N4 O9 S2 Zn2 -","- C32 H22 N4 O9 S2 Zn2 -","- C64 H44 N8 O18 S4 Zn4 -","2","0.5","","Yin, Wen-Yu; Huang, Zuo-Long; Tang, Xiao-Yan; Wang, Jun; Cheng, Hong-Jian; Ma, Yun-Sheng; Yuan, Rong-Xin; Liu, Dong","Structural diversification and photocatalytic properties of zinc(ii) polymers modified by auxiliary N-containing ligands","New J. Chem.","2015","39","9","7130","","10.1039/C5NJ01005E","","","0.71073","MoKα","","0.0571","0.0482","","","0.1533","0.1602","","","","","","1.085","","","","has coordinates,has disorder","155210","2020-10-21","18:00:00",""
"7054963","13.7313","0.0019","10.4349","0.0014","18.476","0.0019","90","","130.704","0.007","90","","2006.9","0.5","291","2","291","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C42 H30 N6 O9 S2 Zn2 -","- C42 H30 N6 O9 S2 Zn2 -","- C84 H60 N12 O18 S4 Zn4 -","2","0.5","","Yin, Wen-Yu; Huang, Zuo-Long; Tang, Xiao-Yan; Wang, Jun; Cheng, Hong-Jian; Ma, Yun-Sheng; Yuan, Rong-Xin; Liu, Dong","Structural diversification and photocatalytic properties of zinc(ii) polymers modified by auxiliary N-containing ligands","New J. Chem.","2015","39","9","7130","","10.1039/C5NJ01005E","","","0.71073","MoKα","","0.0799","0.0702","","","0.1795","0.1874","","","","","","1.166","","","","has coordinates,has disorder","155210","2020-10-21","18:00:00",""
"7054964","20.434","0.004","9.921","0.002","14.065","0.003","90","","133.25","0.03","90","","2076.8","1.3","291","2","291","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C22 H14 N3 O4 S Zn -","- C22 H14 N3 O4 S Zn -","- C88 H56 N12 O16 S4 Zn4 -","4","1","","Yin, Wen-Yu; Huang, Zuo-Long; Tang, Xiao-Yan; Wang, Jun; Cheng, Hong-Jian; Ma, Yun-Sheng; Yuan, Rong-Xin; Liu, Dong","Structural diversification and photocatalytic properties of zinc(ii) polymers modified by auxiliary N-containing ligands","New J. Chem.","2015","39","9","7130","","10.1039/C5NJ01005E","","","0.71073","MoKα","","0.0691","0.0561","","","0.1207","0.1263","","","","","","1.096","","","","has coordinates","155210","2020-10-21","18:00:00",""
"7054965","10.3556","0.0008","10.9941","0.0008","22.5493","0.0017","96.459","0.002","90.358","0.002","98.278","0.002","2523.7","0.3","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H45 N9 O11 S2 Zn2 -","- C53 H45 N9 O11 S2 Zn2 -","- C106 H90 N18 O22 S4 Zn4 -","2","1","","Yin, Wen-Yu; Huang, Zuo-Long; Tang, Xiao-Yan; Wang, Jun; Cheng, Hong-Jian; Ma, Yun-Sheng; Yuan, Rong-Xin; Liu, Dong","Structural diversification and photocatalytic properties of zinc(ii) polymers modified by auxiliary N-containing ligands","New J. Chem.","2015","39","9","7130","","10.1039/C5NJ01005E","","","0.71073","MoKα","","0.0525","0.0422","","","0.137","0.1769","","","","","","1.093","","","","has coordinates","155210","2020-10-21","18:00:00",""
"7054966","10.95","0.002","6.8081","0.0014","11.381","0.002","90","","95.76","0.03","90","","844.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H9 Gd O8 -","- C4 H9 Gd O8 -","- C16 H36 Gd4 O32 -","4","1","","Liu, Sui-Jun; Zheng, Teng-Fei; Bao, Jun; Dong, Piao-Ping; Liao, Jin-Sheng; Chen, Jing-Lin; Wen, He-Rui; Xu, Jian; Bu, Xian-He","Two GdIIIcomplexes derived from dicarboxylate ligands as cryogenic magnetorefrigerants","New J. Chem.","2015","39","9","6970","","10.1039/C5NJ01229E","","","0.71073","MoKα","","0.0619","0.0561","","","0.1296","0.1329","","","","","","1.172","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054967","9.6867","0.0019","15.449","0.003","27.303","0.006","90","","90","","90","","4085.9","1.4","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C5 H10 Gd O10 -","- C5 H10 Gd O10 -","- C80 H160 Gd16 O160 -","16","0.5","","Liu, Sui-Jun; Zheng, Teng-Fei; Bao, Jun; Dong, Piao-Ping; Liao, Jin-Sheng; Chen, Jing-Lin; Wen, He-Rui; Xu, Jian; Bu, Xian-He","Two GdIIIcomplexes derived from dicarboxylate ligands as cryogenic magnetorefrigerants","New J. Chem.","2015","39","9","6970","","10.1039/C5NJ01229E","","","0.71073","MoKα","","0.0285","0.0244","","","0.0432","0.0444","","","","","","1.167","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054968","11.357","0.0007","11.8214","0.0007","19.0167","0.0012","90","","106.551","0.001","90","","2447.3","0.3","273","2","273","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H78 N4 O2 Sc2 Si4 -","- C36 H78 N4 O2 Sc2 Si4 -","- C72 H156 N8 O4 Sc4 Si8 -","2","0.5","","Long, Shiyu; Wang, Baoli; Xie, Hongyan; Yao, Changguang; Wu, Chunji; Cui, Dongmei","Rare-earth metal alkyl complexes bearing an alkoxy N-heterocyclic carbene ligand: synthesis, characterization, catalysis for isoprene polymerization","New J. Chem.","2015","39","10","7682","","10.1039/C5NJ00737B","","","0.71073","MoKα","","0.0414","0.0361","","","0.0954","0.0997","","","","","","1.051","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054969","25.04","0.003","10.6891","0.001","20.951","0.002","90","","103.216","0.002","90","","5459.1","1","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C40 H86 N4 O2 Si4 Y2 -","- C40 H86 N4 O2 Si4 Y2 -","- C160 H344 N16 O8 Si16 Y8 -","4","1","","Long, Shiyu; Wang, Baoli; Xie, Hongyan; Yao, Changguang; Wu, Chunji; Cui, Dongmei","Rare-earth metal alkyl complexes bearing an alkoxy N-heterocyclic carbene ligand: synthesis, characterization, catalysis for isoprene polymerization","New J. Chem.","2015","39","10","7682","","10.1039/C5NJ00737B","","","0.71073","MoKα","","0.0946","0.0552","","","0.0926","0.1045","","","","","","0.945","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054970","11.5419","0.0007","17.7218","0.001","14.0192","0.0008","90","","106.313","0.001","90","","2752.1","0.3","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H86 Lu2 N4 O2 Si4 -","- C40 H86 Lu2 N4 O2 Si4 -","- C80 H172 Lu4 N8 O4 Si8 -","2","0.5","","Long, Shiyu; Wang, Baoli; Xie, Hongyan; Yao, Changguang; Wu, Chunji; Cui, Dongmei","Rare-earth metal alkyl complexes bearing an alkoxy N-heterocyclic carbene ligand: synthesis, characterization, catalysis for isoprene polymerization","New J. Chem.","2015","39","10","7682","","10.1039/C5NJ00737B","","","0.71073","MoKα","","0.0622","0.0592","","","0.1322","0.1331","","","","","","1.351","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7054971","11.5311","0.0007","11.8604","0.0007","19.0343","0.0012","90","","106.182","0.001","90","","2500.1","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H78 Lu2 N4 O2 Si4 -","- C36 H78 Lu2 N4 O2 Si4 -","- C72 H156 Lu4 N8 O4 Si8 -","2","0.5","","Long, Shiyu; Wang, Baoli; Xie, Hongyan; Yao, Changguang; Wu, Chunji; Cui, Dongmei","Rare-earth metal alkyl complexes bearing an alkoxy N-heterocyclic carbene ligand: synthesis, characterization, catalysis for isoprene polymerization","New J. Chem.","2015","39","10","7682","","10.1039/C5NJ00737B","","","0.71073","MoKα","","0.018","0.0167","","","0.043","0.0438","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054972","13.3583","0.0013","14.9883","0.0015","14.5687","0.0015","90","","91.521","0.002","90","","2915.9","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H90 N4 O2 Si4 Y2 -","- C48 H90 N4 O2 Si4 Y2 -","- C96 H180 N8 O4 Si8 Y4 -","2","0.5","","Long, Shiyu; Wang, Baoli; Xie, Hongyan; Yao, Changguang; Wu, Chunji; Cui, Dongmei","Rare-earth metal alkyl complexes bearing an alkoxy N-heterocyclic carbene ligand: synthesis, characterization, catalysis for isoprene polymerization","New J. Chem.","2015","39","10","7682","","10.1039/C5NJ00737B","","","0.71073","MoKα","","0.1091","0.0553","","","0.0908","0.1068","","","","","","0.958","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054973","37.484","0.0011","7.0935","0.0002","6.2089","0.0002","90","","97.497","0.002","90","","1636.79","0.09","296","2","296","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C19 H13 Br N3 O -","- C19 H13 Br N3 O -","- C76 H52 Br4 N12 O4 -","4","1","","İkiz, Mesut; İspir, Esin; Aytar, Emine; Ulusoy, Mahmut; Karabuğa, Şemistan; Aslantaş, Mehmet; Çelik, Ömer","Chemical fixation of CO2into cyclic carbonates by azo-containing Schiff base metal complexes","New J. Chem.","2015","39","10","7786","","10.1039/C5NJ00571J","","","0.71073","MoKα","","0.0334","0.0289","","","0.0626","0.0643","","","","","","1.008","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054974","34.9897","0.0007","8.3586","0.0002","11.8489","0.0003","90","","105.303","0.001","90","","3342.52","0.14","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H26 Br2 N6 O2 Zn -","- C38 H26 Br2 N6 O2 Zn -","- C152 H104 Br8 N24 O8 Zn4 -","4","0.5","","İkiz, Mesut; İspir, Esin; Aytar, Emine; Ulusoy, Mahmut; Karabuğa, Şemistan; Aslantaş, Mehmet; Çelik, Ömer","Chemical fixation of CO2into cyclic carbonates by azo-containing Schiff base metal complexes","New J. Chem.","2015","39","10","7786","","10.1039/C5NJ00571J","","","0.71073","MoKα","","0.0728","0.038","","","0.0825","0.0938","","","","","","1.018","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054975","11.7172","0.0003","11.9846","0.0003","20.1196","0.0006","89.976","0.001","81.043","0.001","79.874","0.001","2746.33","0.13","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H51 Ag2 N15 O16 -","- C54 H51 Ag2 N15 O16 -","- C108 H102 Ag4 N30 O32 -","2","1","","Wu, Huilu; Zhang, Jiawen; Chen, Chengyong; Zhang, Han; Peng, Hongping; Wang, Fei; Yang, Zaihui","Synthesis, crystal structure, and DNA-binding studies of different coordinate binuclear silver(i) complexes with benzimidazole open-chain ether ligands","New J. Chem.","2015","39","9","7172","","10.1039/C5NJ01684C","","","0.71073","MoKα","","0.0534","0.039","","","0.112","0.1248","","","","","","1.062","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054976","7.0952","0.0001","12.8978","0.0003","15.0574","0.0004","110.583","0.001","102.763","0.001","97.589","0.001","1224.46","0.05","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H44 Ag2 N14 O18 -","- C48 H44 Ag2 N14 O18 -","- C48 H44 Ag2 N14 O18 -","1","0.5","","Wu, Huilu; Zhang, Jiawen; Chen, Chengyong; Zhang, Han; Peng, Hongping; Wang, Fei; Yang, Zaihui","Synthesis, crystal structure, and DNA-binding studies of different coordinate binuclear silver(i) complexes with benzimidazole open-chain ether ligands","New J. Chem.","2015","39","9","7172","","10.1039/C5NJ01684C","","","0.71073","MoKα","","0.0245","0.0223","","","0.0731","0.0781","","","","","","1.031","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054977","13.373","0.0003","14.8244","0.0004","17.3282","0.0004","86.867","0.001","89.715","0.001","87.875","0.001","3427.75","0.14","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H56 Ag2 N14 O16 -","- C72 H56 Ag2 N14 O16 -","- C144 H112 Ag4 N28 O32 -","2","1","","Wu, Huilu; Zhang, Jiawen; Chen, Chengyong; Zhang, Han; Peng, Hongping; Wang, Fei; Yang, Zaihui","Synthesis, crystal structure, and DNA-binding studies of different coordinate binuclear silver(i) complexes with benzimidazole open-chain ether ligands","New J. Chem.","2015","39","9","7172","","10.1039/C5NJ01684C","","","0.71073","MoKα","","0.0877","0.0487","","","0.1228","0.19","","","","","","1.179","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054978","11.727","0.003","24.744","0.006","9.764","0.003","90","","98.883","0.005","90","","2799.3","1.3","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 Cl Co N10 O11.5 -","- C20 H27 Cl Co N10 O11.5 -","- C80 H108 Cl4 Co4 N40 O46 -","4","1","","Safin, Damir A.; Szell, Patrick M. J.; Keller, Antonin; Korobkov, Ilia; Bryce, David L.; Murugesu, Muralee","Interaction of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine (TPymT) with CoX2(X = Cl, Br) in water: trapping of new self-assembled water‒chloride/bromide clusters in a [Co(bpca)2]+host (bpca = bis(2-pyrimidylcarbonyl)amidate anion)","New J. Chem.","2015","39","9","7147","","10.1039/C5NJ01125F","","","0.71073","MoKα","","0.1222","0.0609","","","0.1231","0.1468","","","","","","1.015","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7054979","11.7712","0.0005","24.6598","0.0011","9.8817","0.0005","90","","99.559","0.002","90","","2828.6","0.2","200","2","200","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 Br Co N10 O11.5 -","- C20 H27 Br Co N10 O11.5 -","- C80 H108 Br4 Co4 N40 O46 -","4","1","","Safin, Damir A.; Szell, Patrick M. J.; Keller, Antonin; Korobkov, Ilia; Bryce, David L.; Murugesu, Muralee","Interaction of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine (TPymT) with CoX2(X = Cl, Br) in water: trapping of new self-assembled water‒chloride/bromide clusters in a [Co(bpca)2]+host (bpca = bis(2-pyrimidylcarbonyl)amidate anion)","New J. Chem.","2015","39","9","7147","","10.1039/C5NJ01125F","","","0.71073","MoKα","","0.0761","0.0559","","","0.1277","0.137","","","","","","1.064","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7054980","14.3506","0.0015","11.464","0.0005","13.8015","0.0012","90","","118.252","0.012","90","","2000.1","0.4","291.89","0.1","291.89","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 N4 O6 S -","- C19 H18 N4 O6 S -","- C76 H72 N16 O24 S4 -","4","1","","Zhu, Xin; Lin, Qi; Lou, Jin-Chao; Lu, Tao-Tao; Zhang, You-Ming; Wei, Tai-Bao","Colorimetric probes designed to provide high sensitivity and single selectivity for CN−in aqueous solution","New J. Chem.","2015","39","9","7206","","10.1039/C5NJ01158B","","","0.71073","MoKα","","0.0978","0.0581","","","0.1227","0.1527","","","","","","1.032","","","","has coordinates","155219","2020-10-21","18:00:00",""
"7054981","16.709","0.003","20.059","0.004","31.916","0.006","90","","90","","90","","10697","4","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C35 H78 Cl Mo6 N3 O18 -","- C35 H78 Cl Mo6 N3 O18 -","- C280 H624 Cl8 Mo48 N24 O144 -","8","1","","Li, Qiang; Zhang, Jin; Wang, Longsheng; Hao, Jian; Yin, Panchao; Wei, Yongge","Nucleophilic substitution reaction for rational post-functionalization of polyoxometalates","New J. Chem.","2016","40","2","906","","10.1039/C5NJ01090J","","","0.71073","MoKα","","0.0686","0.0565","","","0.1417","0.1487","","","","","","1.044","","","","has coordinates,has disorder","177884","2020-10-21","18:00:00",""
"7054982","16.882","0.003","20.088","0.004","31.929","0.006","90","","90","","90","","10828","4","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C35 H78 I Mo6 N3 O18 -","- C35 H78 I Mo6 N3 O18 -","- C280 H624 I8 Mo48 N24 O144 -","8","1","","Li, Qiang; Zhang, Jin; Wang, Longsheng; Hao, Jian; Yin, Panchao; Wei, Yongge","Nucleophilic substitution reaction for rational post-functionalization of polyoxometalates","New J. Chem.","2016","40","2","906","","10.1039/C5NJ01090J","","","0.71073","MoKα","","0.0883","0.0657","","","0.142","0.1528","","","","","","1.114","","","","has coordinates,has disorder","177884","2020-10-21","18:00:00",""
"7054983","16.779","0.003","20.069","0.004","31.884","0.006","90","","90","","90","","10737","4","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C35 H78 Cl0.5 Mo6 N3.5 O19.5 -","- C35 H78 Cl0.5 Mo6 N3.5 O19.5 -","- C280 H624 Cl4 Mo48 N28 O156 -","8","1","","Li, Qiang; Zhang, Jin; Wang, Longsheng; Hao, Jian; Yin, Panchao; Wei, Yongge","Nucleophilic substitution reaction for rational post-functionalization of polyoxometalates","New J. Chem.","2016","40","2","906","","10.1039/C5NJ01090J","","","0.71073","MoKα","","0.068","0.0583","","","0.1299","0.1343","","","","","","1.051","","","","has coordinates,has disorder","177884","2020-10-21","18:00:00",""
"7054984","8.798","0.007","14.565","0.011","15.456","0.012","78.075","0.016","74.593","0.015","79.602","0.016","1852","2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H65 Cl4 Cu N14 O14.5 -","- C56 H64 Cl4 Cu N14 O14 -","- C56 H64 Cl4 Cu N14 O14 -","1","0.5","","Li, Jie; Xi, Teng; Yan, Biao; Yang, Mingyan; Song, Jirong; Ma, Haixia","Two Cu(ii) complexes of triadimefon: crystal structure, antifungal activities and structure‒activity relationship","New J. Chem.","2015","39","9","6997","","10.1039/C5NJ00679A","","","0.71073","MoKα","","0.234","0.0845","","","0.1389","0.1601","","","","","","1.008","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7054985","9.0593","0.0012","12.8399","0.0017","16.926","0.002","87.738","0.002","74.848","0.002","70.694","0.002","1791.1","0.4","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H38 Cl4 Cu N6 O5 -","- C30 H38 Cl4 Cu N6 O5 -","- C60 H76 Cl8 Cu2 N12 O10 -","2","1","","Li, Jie; Xi, Teng; Yan, Biao; Yang, Mingyan; Song, Jirong; Ma, Haixia","Two Cu(ii) complexes of triadimefon: crystal structure, antifungal activities and structure‒activity relationship","New J. Chem.","2015","39","9","6997","","10.1039/C5NJ00679A","","","0.71073","MoKα","","0.0583","0.0538","","","0.151","0.1548","","","","","","1.068","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054986","7.7181","0.0013","8.3117","0.0014","14.132","0.002","99.319","0.003","103.875","0.002","106.46","0.003","817.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Ethyl 6,8-dichloro-2-hydroxy-2-(pyridin-4-yl)-2H-chromene-3-carboxylate","","- C17 H13 Cl2 N O4 -","- C17 H13 Cl2 N O4 -","- C34 H26 Cl4 N2 O8 -","2","1","","Chandrasekhara Rao, Lenka; Satish Kumar, Nandigama; Jagadeesh Babu, Nanubolu; Mitaram Meshram, Harshadas","A simple and efficient one-pot synthesis of 2-alkyl/aryl/pyridyl substituted 2H-chromenes","New J. Chem.","2015","39","9","7164","","10.1039/C5NJ01377A","","","0.71073","MoKα","","0.0649","0.0554","","","0.1352","0.1415","","","","","","1.121","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054987","7.3802","0.0011","8.307","0.0014","14.538","0.002","93.277","0.011","99.516","0.013","96.9","0.011","870","0.2","120","2","120","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C13 H21 F6 N4 O P -","- C13 H21 F6 N4 O P -","- C26 H42 F12 N8 O2 P2 -","2","1","","Ulbrich, Ana H. D. P. S.; Milani, Jorge L. S.; Roisnel, Thierry; Carpentier, Jean-François; Casagrande, Osvaldo L.","Zwitterionic Ni(ii) complexes bearing pyrazolyl-ether-imidazolium ligands: synthesis, structural characterization and use in ethylene oligomerization","New J. Chem.","2015","39","9","7234","","10.1039/C5NJ01538C","","x-ray","0.71073","MoKα","","0.0496","0.0348","","","0.0918","0.0978","","","","","","1.046","","","","has coordinates","155217","2020-10-21","18:00:00",""
"7054988","9.8869","0.0004","8.5977","0.0003","21.7613","0.0009","90","","94.16","0.002","90","","1844.94","0.12","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H23 F6 N4 O P -","- C14 H23 F6 N4 O P -","- C56 H92 F24 N16 O4 P4 -","4","1","","Ulbrich, Ana H. D. P. S.; Milani, Jorge L. S.; Roisnel, Thierry; Carpentier, Jean-François; Casagrande, Osvaldo L.","Zwitterionic Ni(ii) complexes bearing pyrazolyl-ether-imidazolium ligands: synthesis, structural characterization and use in ethylene oligomerization","New J. Chem.","2015","39","9","7234","","10.1039/C5NJ01538C","","x-ray","0.71073","MoKα","","0.0492","0.0409","","","0.0913","0.097","","","","","","1.021","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054989","8.1781","0.0002","15.6069","0.0003","28.0616","0.0006","90","","90","","90","","3581.64","0.14","150","2","150","2","","","","","","","synthesis as described","6","P c 21 b","P -2bc -2c","29","","","","- C13 H21 Cl3 N4 Ni O -","- C13 H21 Cl3 N4 Ni O -","- C104 H168 Cl24 N32 Ni8 O8 -","8","2","","Ulbrich, Ana H. D. P. S.; Milani, Jorge L. S.; Roisnel, Thierry; Carpentier, Jean-François; Casagrande, Osvaldo L.","Zwitterionic Ni(ii) complexes bearing pyrazolyl-ether-imidazolium ligands: synthesis, structural characterization and use in ethylene oligomerization","New J. Chem.","2015","39","9","7234","","10.1039/C5NJ01538C","","x-ray","0.71073","MoKα","","0.0208","0.0192","","","0.0462","0.0467","","","","","","1.034","","","","has coordinates","182989","2020-10-21","18:00:00",""
"7054990","13.383","0.0006","7.7341","0.0003","17.1341","0.0007","90","","104.377","0.002","90","","1717.93","0.12","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 Cl3 N4 Ni O -","- C12 H19 Cl3 N4 Ni O -","- C48 H76 Cl12 N16 Ni4 O4 -","4","1","","Ulbrich, Ana H. D. P. S.; Milani, Jorge L. S.; Roisnel, Thierry; Carpentier, Jean-François; Casagrande, Osvaldo L.","Zwitterionic Ni(ii) complexes bearing pyrazolyl-ether-imidazolium ligands: synthesis, structural characterization and use in ethylene oligomerization","New J. Chem.","2015","39","9","7234","","10.1039/C5NJ01538C","","x-ray","0.71073","MoKα","","0.0388","0.0298","","","0.0703","0.0748","","","","","","1.031","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054991","8.085","0.0001","17.5163","0.0003","13.4475","0.0002","90","","99.51","0.001","90","","1878.25","0.05","100","2","100","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H23 Cl3 N4 Ni O -","- C14 H23 Cl3 N4 Ni O -","- C56 H92 Cl12 N16 Ni4 O4 -","4","1","","Ulbrich, Ana H. D. P. S.; Milani, Jorge L. S.; Roisnel, Thierry; Carpentier, Jean-François; Casagrande, Osvaldo L.","Zwitterionic Ni(ii) complexes bearing pyrazolyl-ether-imidazolium ligands: synthesis, structural characterization and use in ethylene oligomerization","New J. Chem.","2015","39","9","7234","","10.1039/C5NJ01538C","","x-ray","0.71073","MoKα","","0.0301","0.0258","","","0.061","0.0638","","","","","","1.021","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054992","10.6396","0.0006","10.6396","0.0006","13.8377","0.0008","90","","90","","90","","1566.44","0.15","284","2","284","2","","","","","","","","3","I 41","I 4bw","80","","","","- C17 H16 N2 -","- C17 H16 N2 -","- C68 H64 N8 -","4","0.5","","Boominathan, Siva Senthil Kumar; Chen, Chung-Yu; Huang, Po-Jui; Hou, Ruei-Jhih; Wang, Jeh-Jeng","A sequential one-pot approach to 1,2,4,5-tetrasubstituted-2H-imidazole synthesis from disubstituted alkynes","New J. Chem.","2015","39","9","6914","","10.1039/C5NJ00959F","","x-ray","0.71073","MoKα","","0.0763","0.0689","","","0.2026","0.2158","","","","","","1.066","","","","has coordinates","155223","2020-10-21","18:00:00",""
"7054993","13.309","0.0005","9.40511","0.00019","13.7393","0.0004","90","","114.964","0.004","90","","1559.11","0.1","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-dioxido-aqua-(2-oxobenzaldehyde isonicotinylhydrazonato-O,N,O)molybdenum(VI)) chloride","","- C13 H12 Cl Mo N3 O5 -","- C13 H12 Cl Mo N3 O5 -","- C52 H48 Cl4 Mo4 N12 O20 -","4","1","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.0516","0.0337","","","0.0673","0.073","","","","","","1.047","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054994","7.48269","0.00013","25.6417","0.0005","8.45241","0.00014","90","","94.5659","0.0015","90","","1616.61","0.05","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-dioxido-methanol-(2-oxobenzaldehyde isonicotinylhydrazonato-O,N,O)molybdenum(VI)) chloride","","- C14 H14 Cl Mo N3 O5 -","- C14 H14 Cl Mo N3 O5 -","- C56 H56 Cl4 Mo4 N12 O20 -","4","1","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.0283","0.0255","","","0.0623","0.0635","","","","","","1.17","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054995","8.08986","0.00018","17.0004","0.0003","13.1601","0.0003","90","","105.619","0.002","90","","1743.09","0.07","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","cis-dioxido-aqua-(2-oxo-1-naphthaldehyde isonicotinylhydrazonato-O,N,O)molybdenum(VI) chloride","","- C17 H14 Cl Mo N3 O5 -","- C17 H14 Cl Mo N3 O5 -","- C68 H56 Cl4 Mo4 N12 O20 -","4","1","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.0493","0.0357","","","0.0737","0.078","","","","","","1.052","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054996","7.5013","0.0005","9.4538","0.0009","13.3244","0.0007","96.89","0.006","90.248","0.005","97.558","0.007","929.74","0.12","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","cis-dioxido-methanol-(2-oxo-1-naphthaldehyde isonicotinylhydrazonato-O,N,O)molybdenum(VI) chloride","","- C18 H16 Cl Mo N3 O5 -","- C18 H16 Cl Mo N3 O5 -","- C36 H32 Cl2 Mo2 N6 O10 -","2","1","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.0525","0.0336","","","0.086","0.0921","","","","","","1.049","","","","has coordinates","155212","2020-10-21","18:00:00",""
"7054997","15.958","0.0004","11.4043","0.0002","12.2325","0.0003","90","","109.225","0.003","90","","2102.04","0.09","295","","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-dioxido-aqua-(diethylamino-salicylaldehyde4-phenylthiosemicarbazonato)molybdenum(VI)chloride hydrate","","- C17 H23 Cl Mo N4 O6 -","- C17 H23 Cl Mo N4 O6 -","- C68 H92 Cl4 Mo4 N16 O24 -","4","1","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.0297","0.0248","","","0.0675","0.0709","","","","","","0.948","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7054998","9.2614","0.0004","9.9979","0.0006","11.8619","0.0005","82.827","0.004","72.104","0.004","89.482","0.004","1036.52","0.09","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","cis-dioxido-(diethylamino-salicylaldehyde isonicotinylhydrazonato-O,N,O)methanol molybdenum(VI) chloride","","- C18 H23 Cl Mo N4 O5 -","- C18 H23.034 Cl Mo N4 O5 -","- C36 H46.068 Cl2 Mo2 N8 O10 -","2","1","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.0577","0.0435","","","0.105","0.1101","","","","","","0.932","","","","has coordinates,has disorder","155212","2020-10-21","18:00:00",""
"7054999","25.2633","0.0003","25.2633","0.0003","11.2412","0.0002","90","","90","","90","","7174.52","0.18","295","2","295","2","","","","","","","","5","I 41/a","-I 4ad","88","","cis-dioxido-methanol-(2-oxo-1-naphthaldehyde isonicotinylhydrazonato-O,N,O)molybdenum(VI)","","- C18 H15 Mo N3 O5 -","- C18 H15 Mo N3 O5 -","- C288 H240 Mo16 N48 O80 -","16","","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.047","0.0343","","","0.0632","0.0668","","","","","","1.092","","","","has coordinates","155212","2020-10-21","18:00:00",""
"7055000","6.59351","0.00014","13.0715","0.0003","20.2077","0.0004","90","","96.718","0.002","90","","1729.68","0.06","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","cis-dioxido-(diethylamino-salicylaldehyde isonicotinylhydrazonato-O,O,N,N)molybdenum(VI)","","- C17 H18 Mo N4 O4 -","- C17 H18 Mo N4 O4 -","- C68 H72 Mo4 N16 O16 -","4","1","","Vrdoljak, Višnja; Prugovečki, Biserka; Pulić, Ivana; Cigler, Marko; Sviben, Dora; Parlov Vuković, Jelena; Novak, Predrag; Matković-Čalogović, Dubravka; Cindrić, Marina","Dioxidomolybdenum(vi) complexes with isoniazid-related hydrazones: solution-based, mechanochemical and UV-light assisted deprotonation","New J. Chem.","2015","39","9","7322","","10.1039/C5NJ01567G","","","0.71073","MoKα","","0.0452","0.0321","","","0.0806","0.0851","","","","","","0.943","","","","has coordinates","155212","2020-10-21","18:00:00",""
"7055001","11.4963","0.0012","16.0196","0.0017","20.763","0.002","78.971","0.004","85.227","0.005","81.247","0.004","3703.7","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C69 H58.5 Cl10.5 N12 O4.5 -","- C68.9995 H58.4995 Cl10.4985 N12 O4.5 -","- C137.999 H116.999 Cl20.997 N24 O9 -","2","1","","Zaiter, Jamila; Achibat, Hanane; Amiri, Ouafa; Hafid, Abderrafia; Khouili, Mostafa; Rakib, El Mostapha; Neves, Cláudia M. B.; Neves, Maria Graça P. M. S.; Silva, Artur M. S.; Cavaleiro, José A. S.; Almeida Paz, Filipe A.; Faustino, Maria Amparo F.","An easy synthetic access to new pyrazole spiro derivatives from 3-amino-1-phenyl-2-pyrazolin-5-one","New J. Chem.","2015","39","9","6738","","10.1039/C5NJ01306B","","","0.71073","MoKα","","0.1132","0.0812","","","0.2063","0.2254","","","","","","1.025","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7055002","11.14","0.005","23.478","0.01","13.342","0.006","90","","92.663","0.005","90","","3486","3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H48 I12 N6 O0 Pb3 -","- C48 H48 I12 N6 Pb3 -","- C96 H96 I24 N12 Pb6 -","2","0.5","","Wang, Chao-Hai; Du, Hai-Juan; Li, Yao; Niu, Yun-Yin; Hou, Hong-Wei","Crystal structures and photocatalytic properties of two novel iodoplumbate hybrids templated by multivalent organic cations","New J. Chem.","2015","39","9","7372","","10.1039/C5NJ01240F","","","0.71073","MoKα","","0.0571","0.0413","","","0.1022","0.1105","","","","","","1.034","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055003","19.5741","0.0006","15.1598","0.0005","15.981","0.0007","90","","97.571","0.004","90","","4700.9","0.3","291","2","291.15","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C27 H32 I9 N3 O Pb3 -","- C27 H30 I9 N3 O Pb3 -","- C108 H120 I36 N12 O4 Pb12 -","4","1","","Wang, Chao-Hai; Du, Hai-Juan; Li, Yao; Niu, Yun-Yin; Hou, Hong-Wei","Crystal structures and photocatalytic properties of two novel iodoplumbate hybrids templated by multivalent organic cations","New J. Chem.","2015","39","9","7372","","10.1039/C5NJ01240F","","","0.71073","MoKα","","0.0623","0.0427","","","0.0786","0.0876","","","","","","0.998","","","","has coordinates","155221","2020-10-21","18:00:00",""
"7055004","8.258","0.001","11.221","0.002","21.508","0.003","90","","97.19","0.002","90","","1977.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H19 Cu N3 O5 -","- C21 H19 Cu N3 O5 -","- C84 H76 Cu4 N12 O20 -","4","1","","Das, Kuheli; Panda, Uttam; Datta, Amitabha; Roy, Suman; Mondal, Sudipa; Massera, Chiara; Askun, Tulin; Celikboyun, Pinar; Garribba, Eugenio; Sinha, Chittaranjan; Anand, Kushi; Akitsu, Takashiro; Kobayashi, Kana","An enolato-bridged dinuclear Cu(ii) complex with a coumarin-assisted precursor: a spectral, magnetic and biological study","New J. Chem.","2015","39","9","7309","","10.1039/C5NJ00789E","","","0.71069","MoKα","","0.0483","0.0358","","","0.0963","0.104","","","","","","1.046","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7055005","25.45","0.005","11.928","0.005","25.835","0.005","90","","116.777","0.005","90","","7002","4","298","2","298","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C63 H73 Cd2.5 N9 Na O19 -","- C60 H65.95 Cd2.5 N8 Na O18 -","- C240 H263.8 Cd10 N32 Na4 O72 -","4","1","","Hu, Xiao-Li; Qin, Chao; Wang, Xin-Long; Shao, Kui-Zhan; Su, Zhong-Min","Cluster-based metal‒organic frameworks as sensitive and selective luminescent probes for sensing nitro explosives","New J. Chem.","2015","39","10","7858","","10.1039/C5NJ01237F","","","0.71069","MoKα","","0.224","0.0979","","","0.244","0.3129","","","","","","1.006","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7055006","14.202","0.0011","15.9564","0.0014","16.102","0.0011","116.872","0.005","93.433","0.005","92.854","0.005","3236.9","0.5","123","1","123.15","","","","","","","","","4","P -1","-P 1","2","","","","- C54 H60 Ce2 O21 -","- C54 H60 Ce2 O21 -","- C108 H120 Ce4 O42 -","2","1","","Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun","Rare earth 3-(4′-hydroxyphenyl)propionate complexes","New J. Chem.","2015","39","10","7688","","10.1039/C5NJ00787A","","","0.71073","MoKα","","0.1022","0.0676","","","0.1755","0.1891","","","","","","0.986","","","","has coordinates,has disorder","162018","2020-10-21","18:00:00",""
"7055007","24.425","0.005","5.3513","0.0011","22.945","0.005","90","","90","","90","","2999","1.1","123","1","123.15","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C27 H31 Er O11 -","- C27 H31 Er O11 -","- C108 H124 Er4 O44 -","4","1","","Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun","Rare earth 3-(4′-hydroxyphenyl)propionate complexes","New J. Chem.","2015","39","10","7688","","10.1039/C5NJ00787A","","","0.71073","MoKα","","0.1041","0.0627","","","0.1225","0.1337","","","","","","1.042","","","","has coordinates","162018","2020-10-21","18:00:00",""
"7055008","15.2502","0.0009","16.6406","0.001","25.6709","0.0014","89.014","0.002","78.289","0.002","64.668","0.003","5747.7","0.6","123","1","123.15","","","","","","","","","4","P -1","-P 1","2","","","","- C109 H132 La4 O47 -","- C109 H132 La4 O47 -","- C218 H264 La8 O94 -","2","1","","Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun","Rare earth 3-(4′-hydroxyphenyl)propionate complexes","New J. Chem.","2015","39","10","7688","","10.1039/C5NJ00787A","","","0.71073","MoKα","","0.1116","0.0814","","","0.1419","0.1571","","","","","","1.238","","","","has coordinates","162018","2020-10-21","18:00:00",""
"7055009","13.345","0.003","8.0505","0.0016","24.55","0.005","90","","96.45","0.03","90","","2620.8","1","123","1","123.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H29 Lu O10 -","- C27 H29 Lu O10 -","- C108 H116 Lu4 O40 -","4","1","","Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun","Rare earth 3-(4′-hydroxyphenyl)propionate complexes","New J. Chem.","2015","39","10","7688","","10.1039/C5NJ00787A","","","0.71073","MoKα","","0.1063","0.0714","","","0.1632","0.1857","","","","","","1.045","","","","has coordinates","162018","2020-10-21","18:00:00",""
"7055010","15.0063","0.0007","15.3267","0.0007","16.4093","0.0007","103.726","0.002","107.053","0.002","94.662","0.002","3458.6","0.3","123","1","123","1","","","","","","","","5","P -1","-P 1","2","","","","- C63 H73 Ce2 Na O26 -","- C63 H61 Ce2 Na O26 -","- C126 H122 Ce4 Na2 O52 -","2","1","","Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun","Rare earth 3-(4′-hydroxyphenyl)propionate complexes","New J. Chem.","2015","39","10","7688","","10.1039/C5NJ00787A","","","0.71073","MoKα","","0.1365","0.1257","","","0.3033","0.3247","","","","","","1.104","","","","has coordinates","162018","2020-10-21","18:00:00",""
"7055011","15.328","0.003","15.48","0.003","16.3","0.003","78.16","0.03","70.63","0.03","86.33","0.03","3571","1.4","123","1","123.15","","","","","","","","","5","P -1","-P 1","2","","","","- C67 H83 Na Nd2 O27 -","- C67 H83 Na Nd2 O27 -","- C134 H166 Na2 Nd4 O54 -","2","1","","Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun","Rare earth 3-(4′-hydroxyphenyl)propionate complexes","New J. Chem.","2015","39","10","7688","","10.1039/C5NJ00787A","","","0.71073","MoKα","","0.1318","0.0687","","","0.1616","0.1896","","","","","","1.049","","","","has coordinates","162018","2020-10-21","18:00:00",""
"7055012","8.443","0.002","10.304","0.002","12.134","0.002","69.409","0.01","81.907","0.01","77.454","0.01","962.2","0.3","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H27 N3 -","- C21 H27 N3 -","- C42 H54 N6 -","2","1","","Baishya, Ashim; Peddarao, Thota; Barman, Milan Kumar; Nembenna, Sharanappa","Catalyst free C‒N bond formation by the reaction of amines with diimides: Bulky guanidines","New J. Chem.","2015","","","","","10.1039/C5NJ01612F","","","0.71073","MoKα","","0.081","0.0587","","","0.164","0.1838","","","","","","1.041","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055013","18.0078","0.0007","13.9272","0.0007","15.5355","0.0007","90","","113.869","0.004","90","","3563","0.3","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C38 H46 N6 -","- C38 H46 N6 -","- C152 H184 N24 -","4","0.5","","Baishya, Ashim; Peddarao, Thota; Barman, Milan Kumar; Nembenna, Sharanappa","Catalyst free C‒N bond formation by the reaction of amines with diimides: Bulky guanidines","New J. Chem.","2015","","","","","10.1039/C5NJ01612F","","","0.71073","MoKα","","0.0885","0.0513","","","0.1291","0.1504","","","","","","1.039","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055014","9.405","0.002","17.12","0.003","18.715","0.003","90","","102.705","0.01","90","","2939.6","0.9","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H46 N4 -","- C30 H46 N4 -","- C120 H184 N16 -","4","1","","Baishya, Ashim; Peddarao, Thota; Barman, Milan Kumar; Nembenna, Sharanappa","Catalyst free C‒N bond formation by the reaction of amines with diimides: Bulky guanidines","New J. Chem.","2015","","","","","10.1039/C5NJ01612F","","","0.71073","MoKα","","0.0724","0.0549","","","0.1445","0.1691","","","","","","1.052","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055015","19.2529","0.0002","20.832","0.0003","17.2971","0.0003","90","","90","","90","","6937.46","0.17","133","2","133","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C44 H56 F24 O29 Ti4 Zn2 -","- C44 H56 F24 O29 Ti4 Zn2 -","- C176 H224 F96 O116 Ti16 Zn8 -","4","1","","Ehsan, Muhammad Ali; Khaledi, Hamid; Pandikumar, Alagarsamy; Rameshkumar, Perumal; Huang, Nay Ming; Arifin, Zainudin; Mazhar, Muhammad","Nitrite ion sensing properties of ZnTiO3‒TiO2composite thin films deposited from a zinc‒titanium molecular complex","New J. Chem.","2015","39","9","7442","","10.1039/C5NJ00850F","","","0.71073","MoKα","","0.0837","0.0702","","","0.1943","0.2085","","","","","","1.039","","","","has coordinates,has disorder","155218","2020-10-21","18:00:00",""
"7055016","6.6627","0.0004","9.345","0.0006","13.5348","0.0007","98.497","0.003","102.934","0.004","107.792","0.003","760.54","0.08","200","2","200","2","","","","","","","","4","P -1","-P 1","2","b(HTT08MR","3,7-bis[5-(5-hexylthiophen-2-yl)thienyl]-1,5,2,4,6,8-dithiatetrazocine","","- C15 H17 N2 S3 -","- C15 H17 N2 S3 -","- C30 H34 N4 S6 -","2","1","","Magnan, François; Korobkov, Ilia; Brusso, Jaclyn","Influence of substitution pattern and enhanced π-conjugation on a family of thiophene functionalized 1,5-dithia-2,4,6,8-tetrazocines","New J. Chem.","2015","39","9","7272","","10.1039/C5NJ01345C","","","0.71073","MoKα","","0.0424","0.0312","","","0.0792","0.0853","","","","","","1.019","","","","has coordinates","162136","2020-10-21","18:00:00",""
"7055017","5.6479","0.0006","28.28","0.003","6.4275","0.0007","90","","110.342","0.006","90","","962.59","0.18","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","b(TT)8MR","3,7-bis([5-(thiophen-2-yl)thienyl])-1,5,2,4,6,8-dithiatetrazocine","","- C18 H10 N4 S6 -","- C18 H10 N4 S6 -","- C36 H20 N8 S12 -","2","0.5","","Magnan, François; Korobkov, Ilia; Brusso, Jaclyn","Influence of substitution pattern and enhanced π-conjugation on a family of thiophene functionalized 1,5-dithia-2,4,6,8-tetrazocines","New J. Chem.","2015","39","9","7272","","10.1039/C5NJ01345C","","","0.71073","MoKα","","0.1155","0.0809","","","0.1823","0.1987","","","","","","1.087","","","","has coordinates,has disorder","162136","2020-10-21","18:00:00",""
"7055018","11.837","0.004","5.482","0.002","18.312","0.006","90","","92.953","0.012","90","","1186.7","0.7","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","b(4HT)8MR","3,7-bis(4-hexylthienyl)-1,5,2,4,6,8-dithiatetrazocine","","- C22 H30 N4 S4 -","- C22 H30 N4 S4 -","- C44 H60 N8 S8 -","2","0.5","","Magnan, François; Korobkov, Ilia; Brusso, Jaclyn","Influence of substitution pattern and enhanced π-conjugation on a family of thiophene functionalized 1,5-dithia-2,4,6,8-tetrazocines","New J. Chem.","2015","39","9","7272","","10.1039/C5NJ01345C","","","0.71073","MoKα","","0.1625","0.0746","","","0.158","0.1893","","","","","","1.01","","","","has coordinates","162136","2020-10-21","18:00:00",""
"7055019","8.6469","0.0007","34.562","0.003","11.4333","0.001","90","","109.165","0.005","90","","3227.5","0.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C37 H34 Cl Cu N3 O4 -","- C37 H34 Cl Cu N3 O4 -","- C148 H136 Cl4 Cu4 N12 O16 -","4","2","","Mahendiran, Dharmasivam; Gurumoorthy, Perumal; Gunasekaran, Krishnasamy; Senthil Kumar, Raju; Rahiman, Aziz Kalilur","Structural modeling, in vitro antiproliferative activity, and the effect of substituents on the DNA fastening and scission actions of heteroleptic copper(ii) complexes with terpyridines and naproxen","New J. Chem.","2015","39","10","7895","","10.1039/C5NJ01059D","","","0.71073","MoKα","","0.1407","0.0994","","","0.2307","0.2528","","","","","","1.104","","","","has coordinates","162108","2020-10-21","18:00:00",""
"7055020","8.59","0.005","10.579","0.005","18.094","0.005","83.522","0.005","84.936","0.005","69.681","0.005","1530","1.2","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C33.5 H30 Cl Cu N3 O5.5 -","- C33.5 H30 Cl Cu N3 O5.5 -","- C67 H60 Cl2 Cu2 N6 O11 -","2","2","","Mahendiran, Dharmasivam; Gurumoorthy, Perumal; Gunasekaran, Krishnasamy; Senthil Kumar, Raju; Rahiman, Aziz Kalilur","Structural modeling, in vitro antiproliferative activity, and the effect of substituents on the DNA fastening and scission actions of heteroleptic copper(ii) complexes with terpyridines and naproxen","New J. Chem.","2015","39","10","7895","","10.1039/C5NJ01059D","","","0.71073","MoKα","","0.0599","0.0406","","","0.0952","0.1053","","","","","","0.973","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7055021","10.0809","0.0019","11.449","0.002","7.5369","0.0015","90","","100.493","0.003","90","","855.3","0.3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C2 H3 Ag N4 -","- C2 H3 Ag N4 -","- C16 H24 Ag8 N32 -","8","1","","Qu, Xiaoni; Zhang, Sheng; Yang, Qi; Su, Zhiyong; Wei, Qing; Xie, Gang; Chen, Sanping","Silver(i)-based energetic coordination polymers: synthesis, structure and energy performance","New J. Chem.","2015","39","10","7849","","10.1039/C5NJ01623A","","","0.71073","MoKα","","0.0359","0.0315","","","0.1065","0.1121","","","","","","0.913","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055022","3.6019","0.0007","11.273","0.002","11.6","0.002","90","","93.389","0.003","90","","470.19","0.15","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H Ag N4 O2 -","- C2 H Ag N4 O2 -","- C8 H4 Ag4 N16 O8 -","4","1","","Qu, Xiaoni; Zhang, Sheng; Yang, Qi; Su, Zhiyong; Wei, Qing; Xie, Gang; Chen, Sanping","Silver(i)-based energetic coordination polymers: synthesis, structure and energy performance","New J. Chem.","2015","39","10","7849","","10.1039/C5NJ01623A","","","0.71073","MoKα","","0.0294","0.0244","","","0.0556","0.058","","","","","","1.059","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055023","11.6556","0.0009","14.2528","0.0015","13.4694","0.0012","90","","98.262","0.007","90","","2214.4","0.4","293","2","293","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C13 H28 Au2 Cu N8 O3 -","- C13 H28 Au2 Cu N8 O3 -","- C52 H112 Au8 Cu4 N32 O12 -","4","0.5","","Karadağ, Ahmet; Aydın, Ali; Dede, Süreyya; Tekin, Şaban; Yanar, Yusuf; Çadırcı, Bilge Hilal; Soylu, Mustafa Serkan; Andaç, Ömer","Five novel dicyanidoaurate(i)-based complexes exhibiting significant biological activities: synthesis, characterization and three crystal structures","New J. Chem.","2015","39","10","8136","","10.1039/C5NJ01108F","","","0.71073","MoKα","","0.0572","0.0497","","","0.1301","0.1351","","","","","","1.088","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055024","10.895","0.0006","12.6494","0.0006","15.5745","0.0009","90","","101.857","0.005","90","","2100.6","0.2","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C12 H26 Au2 N8 O3 Zn -","- C12 H26 Au2 N8 O3 Zn -","- C48 H104 Au8 N32 O12 Zn4 -","4","0.5","","Karadağ, Ahmet; Aydın, Ali; Dede, Süreyya; Tekin, Şaban; Yanar, Yusuf; Çadırcı, Bilge Hilal; Soylu, Mustafa Serkan; Andaç, Ömer","Five novel dicyanidoaurate(i)-based complexes exhibiting significant biological activities: synthesis, characterization and three crystal structures","New J. Chem.","2015","39","10","8136","","10.1039/C5NJ01108F","","","0.71073","MoKα","","0.0536","0.0363","","","0.082","0.0869","","","","","","0.947","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055025","11.0302","0.0009","13.1045","0.0006","15.5492","0.0011","90","","101.28","0.006","90","","2204.1","0.3","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C12 H24 Au2 Cd N8 O3 -","- C12 H24 Au2 Cd N8 O3 -","- C48 H96 Au8 Cd4 N32 O12 -","4","0.5","","Karadağ, Ahmet; Aydın, Ali; Dede, Süreyya; Tekin, Şaban; Yanar, Yusuf; Çadırcı, Bilge Hilal; Soylu, Mustafa Serkan; Andaç, Ömer","Five novel dicyanidoaurate(i)-based complexes exhibiting significant biological activities: synthesis, characterization and three crystal structures","New J. Chem.","2015","39","10","8136","","10.1039/C5NJ01108F","","","0.71073","MoKα","","0.0509","0.0428","","","0.1031","0.1071","","","","","","1.069","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055026","12.7243","0.001","10.1559","0.0008","7.678","0.0006","90","","95.932","0.0017","90","","986.89","0.13","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H12 Br2 Se -","- C8 H12 Br2 Se -","- C32 H48 Br8 Se4 -","4","0.5","","Potapov, Vladimir A.; Amosova, Svetlana V.; Abramova, Elena V.; Musalov, Maxim V.; Lyssenko, Konstantin A.; Finn, M. G.","2,6-Dihalo-9-selenabicyclo[3.3.1]nonanes and their complexes with selenium dihalides: synthesis and structural characterisation","New J. Chem.","2015","39","10","8055","","10.1039/C5NJ00684H","","","0.71073","MoKα","","0.0317","0.026","","","0.0661","0.069","","","","","","1.009","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055027","15.5132","0.0015","7.6193","0.0008","7.9082","0.0008","90","","90","","90","","934.75","0.16","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C8 H12 Cl2 Se -","- C8 H12 Cl2 Se -","- C32 H48 Cl8 Se4 -","4","0.5","","Potapov, Vladimir A.; Amosova, Svetlana V.; Abramova, Elena V.; Musalov, Maxim V.; Lyssenko, Konstantin A.; Finn, M. G.","2,6-Dihalo-9-selenabicyclo[3.3.1]nonanes and their complexes with selenium dihalides: synthesis and structural characterisation","New J. Chem.","2015","39","10","8055","","10.1039/C5NJ00684H","","","0.71073","MoKα","","0.0374","0.0273","","","0.0632","0.0664","","","","","","1.02","","","","has coordinates","162103","2020-10-21","18:00:00",""
"7055028","7.5401","0.0005","11.0902","0.0007","12.9721","0.0008","90","","90.385","0.0015","90","","1084.72","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H24 Cl6 Se3 -","- C16 H24 Cl6 Se3 -","- C32 H48 Cl12 Se6 -","2","0.5","","Potapov, Vladimir A.; Amosova, Svetlana V.; Abramova, Elena V.; Musalov, Maxim V.; Lyssenko, Konstantin A.; Finn, M. G.","2,6-Dihalo-9-selenabicyclo[3.3.1]nonanes and their complexes with selenium dihalides: synthesis and structural characterisation","New J. Chem.","2015","39","10","8055","","10.1039/C5NJ00684H","","","0.71073","MoKα","","0.04","0.0317","","","0.0812","0.0858","","","","","","0.962","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055029","11.9328","0.001","12.2111","0.001","18.6534","0.0016","90","","90","","90","","2718","0.4","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","compound-1","","- C11 H10 Cl2 Cu N2 Se2 -","- C11 H10 Cl2 Cu N2 Se2 -","- C88 H80 Cl16 Cu8 N16 Se16 -","8","1","","Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz","Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis","New J. Chem.","2015","39","10","7948","","10.1039/C5NJ01400J","","","0.71073","MoKα","","0.0285","0.0203","","","0.0924","0.1039","","","","","","0.852","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055030","9.086","0.0002","9.1684","0.0002","10.5159","0.0003","70.96","0.001","88.276","0.001","77.37","0.001","807.25","0.03","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","compound-2","","- C22 H20 Cu4 I4 N4 Se4 -","- C22 H20 Cu4 I4 N4 Se4 -","- C22 H20 Cu4 I4 N4 Se4 -","1","0.5","","Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz","Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis","New J. Chem.","2015","39","10","7948","","10.1039/C5NJ01400J","","","0.71073","MoKα","","0.0243","0.0193","","","0.0475","0.0489","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055031","8.2538","0.001","8.7192","0.001","11.6817","0.0012","87.058","0.009","81.017","0.009","62.798","0.008","738.35","0.16","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","compound-3","","- C26 H28 Cl2 Cu N4 Se4 -","- C26 H28 Cl2 Cu N4 Se4 -","- C26 H28 Cl2 Cu N4 Se4 -","1","0.5","","Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz","Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis","New J. Chem.","2015","39","10","7948","","10.1039/C5NJ01400J","","","0.71073","MoKα","","0.0498","0.0357","","","0.106","0.118","","","","","","0.781","","","","has coordinates","162074","2020-10-21","18:00:00",""
"7055032","20.476","0.002","8.5749","0.0006","21.202","0.002","90","","115.735","0.008","90","","3353.4","0.6","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","compound-4","","- C13 H14 Cl2 Co N2 Se2 -","- C13 H14 Cl2 Co N2 Se2 -","- C104 H112 Cl16 Co8 N16 Se16 -","8","2","","Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz","Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis","New J. Chem.","2015","39","10","7948","","10.1039/C5NJ01400J","","","0.71073","MoKα","","0.1577","0.0479","","","0.0512","0.0701","","","","","","0.717","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055033","9.791","0.001","4.442","0.001","20.883","0.003","90","","90.96","0.01","90","","908.1","0.3","200","2","200","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","compound-5","","- C13 H14 Ag N3 O3 Se2 -","- C13 H14 Ag N3 O3 Se2 -","- C26 H28 Ag2 N6 O6 Se4 -","2","0.5","","Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz","Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis","New J. Chem.","2015","39","10","7948","","10.1039/C5NJ01400J","","","0.71073","MoKα","","0.0878","0.0572","","","0.1522","0.166","","","","","","0.947","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055034","10.2403","0.0003","11.4552","0.0003","14.8043","0.0004","90","","90","","90","","1736.61","0.08","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","compound-6","","- C14 H16 Cl2 Cu N2 Se2 -","- C14 H16 Cl2 Cu N2 Se2 -","- C56 H64 Cl8 Cu4 N8 Se8 -","4","0.5","","Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz","Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis","New J. Chem.","2015","39","10","7948","","10.1039/C5NJ01400J","","","0.71073","MoKα","","0.0294","0.0217","","","0.0515","0.0557","","","","","","1.014","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055035","13.127","0.0002","13.7157","0.0002","12.1763","0.0002","90","","103.203","0.002","90","","2134.35","0.06","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H24 Cl Cu N3 O6 -","- C22 H24 Cl Cu N3 O6 -","- C88 H96 Cl4 Cu4 N12 O24 -","4","1","","Keypour, Hassan; Shayesteh, Maryam; Salehzadeh, Sadegh; Dhers, Sébastien; Maleki, Farahnaz; Ünver, Hüseyin; Dilek, Nefise","Probing the effect of arm length and inter- and intramolecular interactions in the formation of Cu(ii) complexes of Schiff base ligands derived from some unsymmetrical tripodal amines","New J. Chem.","2015","39","9","7429","","10.1039/C5NJ01318F","","","1.54184","CuKα","","0.0351","0.0308","","","0.0809","0.0844","","","","","","1.049","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055036","11.5021","0.0003","18.7307","0.0005","20.7277","0.0007","90","","95.504","0.001","90","","4445","0.2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H24 Cl Cu N3 O6 -","- C19 H24 Cl Cu N3 O6 -","- C152 H192 Cl8 Cu8 N24 O48 -","8","1","","Keypour, Hassan; Shayesteh, Maryam; Salehzadeh, Sadegh; Dhers, Sébastien; Maleki, Farahnaz; Ünver, Hüseyin; Dilek, Nefise","Probing the effect of arm length and inter- and intramolecular interactions in the formation of Cu(ii) complexes of Schiff base ligands derived from some unsymmetrical tripodal amines","New J. Chem.","2015","39","9","7429","","10.1039/C5NJ01318F","","","0.71073","MoKα","","0.0504","0.0456","","","0.1319","0.1359","","","","","","1.048","","","","has coordinates","155214","2020-10-21","18:00:00",""
"7055037","13.9094","0.0003","18.2391","0.0004","20.6775","0.0006","90.039","0.002","91.901","0.002","111.884","0.002","4864.6","0.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H62 Cl2 Cu2 N6 O15 -","- C44 H62 Cl2 Cu2 N6 O15 -","- C176 H248 Cl8 Cu8 N24 O60 -","4","2","","Keypour, Hassan; Shayesteh, Maryam; Salehzadeh, Sadegh; Dhers, Sébastien; Maleki, Farahnaz; Ünver, Hüseyin; Dilek, Nefise","Probing the effect of arm length and inter- and intramolecular interactions in the formation of Cu(ii) complexes of Schiff base ligands derived from some unsymmetrical tripodal amines","New J. Chem.","2015","39","9","7429","","10.1039/C5NJ01318F","","","1.54184","CuKα","","0.173","0.1565","","","0.3844","0.3908","","","","","","1.07","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055038","19.0697","0.0004","10.6833","0.0002","18.9974","0.0003","90","","95.766","0.002","90","","3850.71","0.12","89","2","89","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C18 H22 Cl Cu N3 O6 -","- C18 H22 Cl Cu N3 O6 -","- C144 H176 Cl8 Cu8 N24 O48 -","8","1","","Keypour, Hassan; Shayesteh, Maryam; Salehzadeh, Sadegh; Dhers, Sébastien; Maleki, Farahnaz; Ünver, Hüseyin; Dilek, Nefise","Probing the effect of arm length and inter- and intramolecular interactions in the formation of Cu(ii) complexes of Schiff base ligands derived from some unsymmetrical tripodal amines","New J. Chem.","2015","39","9","7429","","10.1039/C5NJ01318F","","","0.71073","MoKα","","0.0404","0.0382","","","0.1218","0.1244","","","","","","1.089","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055039","12.2844","0.0002","14.1806","0.0002","23.149","0.0003","90","","90","","90","","4032.56","0.1","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C38 H48 Cl2 Cu2 N6 O12 -","- C38 H48 Cl2 Cu2 N6 O12 -","- C152 H192 Cl8 Cu8 N24 O48 -","4","0.5","","Keypour, Hassan; Shayesteh, Maryam; Salehzadeh, Sadegh; Dhers, Sébastien; Maleki, Farahnaz; Ünver, Hüseyin; Dilek, Nefise","Probing the effect of arm length and inter- and intramolecular interactions in the formation of Cu(ii) complexes of Schiff base ligands derived from some unsymmetrical tripodal amines","New J. Chem.","2015","39","9","7429","","10.1039/C5NJ01318F","","","1.54184","CuKα","","0.1021","0.0878","","","0.2612","0.2657","","","","","","1.355","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055040","54.957","0.002","9.4249","0.0005","23.8226","0.0008","90","","110.27","0.004","90","","11575.1","0.9","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C66 H88 N4 O6 -","- C66 H88 N4 O6 -","- C528 H704 N32 O48 -","8","1","","Porada, Jan H.; Neudörfl, Jörg-M.; Blunk, Dirk","Planar and distorted indigo as the core motif in novel chromophoric liquid crystals","New J. Chem.","2015","39","11","8291","","10.1039/C5NJ01594D","","","1.54184","CuKα","","0.0932","0.0569","","","0.122","0.1386","","","","","","1.067","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055041","8.3342","0.0008","55.144","0.005","10.6926","0.001","90","","104.663","0.001","90","","4754.1","0.8","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H70 N2 O6 -","- C56 H70 N2 O6 -","- C224 H280 N8 O24 -","4","1","","Porada, Jan H.; Neudörfl, Jörg-M.; Blunk, Dirk","Planar and distorted indigo as the core motif in novel chromophoric liquid crystals","New J. Chem.","2015","39","11","8291","","10.1039/C5NJ01594D","","","0.71073","MoKα","","0.104","0.0475","","","0.1043","0.132","","","","","","0.918","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055042","16.6007","0.001","11.3683","0.001","20.5655","0.001","90","","120","","90","","3361.2","0.4","298","","298","","","","","","","","Local laboratory","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H42 N4 O3 -","- C37 H42 N4 O3 -","- C148 H168 N16 O12 -","4","1","","Girgis, Adel S.; Mabied, Ahmed F.; Stawinski, Jacek; Hegazy, Lamees; George, Riham F.; Farag, Hanaa; Shalaby, ElSayed M.; Farag, I. S. Ahmed","Synthesis and DFT studies of an antitumor active spiro-oxindole","New J. Chem.","2015","39","10","8017","","10.1039/C5NJ01109D","","","0.71073","MoKα","","0.2446","0.0476","","0.1288","0.0979","0.0979","","","","","","0.9671","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055043","11.347","0.003","11.36","0.003","16.303","0.007","99.15","0.005","93.557","0.005","118.858","0.003","1793.5","1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H54 Ce Fe I N2 O2 Si2 -","- C30 H54 Ce Fe I N2 O2 Si2 -","- C60 H108 Ce2 Fe2 I2 N4 O4 Si4 -","2","1","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0387","0.033","","","0.0763","0.079","","","","","","1.052","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055044","14.879","0.004","13.738","0.004","15.468","0.004","90","","91.074","0.003","90","","3161.2","1.5","100","2","100","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C52 H92 Fe2 I2 N4 O2 Pr2 Si4 -","- C52 H92 Fe2 I2 N4 O2 Pr2 Si4 -","- C104 H184 Fe4 I4 N8 O4 Pr4 Si8 -","2","0.5","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0299","0.0226","","","0.0493","0.052","","","","","","1.026","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055045","11.253","0.0013","11.6706","0.0013","16.3205","0.0019","101.063","0.001","92.506","0.001","118.408","0.001","1827.5","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H54 Fe I N2 O2 Si2 Sm -","- C30 H54 Fe I N2 O2 Si2 Sm -","- C60 H108 Fe2 I2 N4 O4 Si4 Sm2 -","2","1","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0451","0.0371","","","0.0807","0.0854","","","","","","1.043","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7055046","11.13","0.004","11.608","0.005","16.122","0.009","101.564","0.006","91.881","0.006","118.404","0.004","1775","1.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H54 Fe I N2 O2 Si2 Tb -","- C30 H54 Fe I N2 O2 Si2 Tb -","- C60 H108 Fe2 I2 N4 O4 Si4 Tb2 -","2","1","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0805","0.0589","","","0.1309","0.1467","","","","","","1.045","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055047","11.14","0.003","11.605","0.003","16.073","0.007","101.474","0.005","92.374","0.005","118.292","0.003","1770.8","1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H54 Fe I N2 O2 Si2 Tm -","- C30 H54 Fe I N2 O2 Si2 Tm -","- C60 H108 Fe2 I2 N4 O4 Si4 Tm2 -","2","1","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0757","0.0609","","","0.1296","0.1399","","","","","","1.063","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055048","11.5979","0.0017","11.6945","0.0017","16.109","0.002","76.069","0.002","78.51","0.002","56.888","0.002","1770.1","0.4","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H54 Fe I N2 O2 Si2 Yb -","- C30 H54 Fe I N2 O2 Si2 Yb -","- C60 H108 Fe2 I2 N4 O4 Si4 Yb2 -","2","1","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0513","0.042","","","0.0993","0.1074","","","","","","1.143","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055049","13.541","0.002","19.611","0.003","20.563","0.003","90","","90","","90","","5460.6","1.4","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C51 H84 Fe2 K N4 Si4 Yb -","- C51 H84 Fe2 K N4 Si4 Yb -","- C204 H336 Fe8 K4 N16 Si16 Yb4 -","4","1","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0339","0.0298","","","0.0744","0.0761","","","","","","1.06","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055050","10.605","0.004","11.35","0.004","16.204","0.006","100.677","0.004","94.486","0.004","114.277","0.004","1721","1.1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C30 H54 Cl Fe N2 O2 Si2 Yb -","- C30 H54 Cl Fe N2 O2 Si2 Yb -","- C60 H108 Cl2 Fe2 N4 O4 Si4 Yb2 -","2","1","","Huang, Wenliang; Brosmer, Jonathan L.; Diaconescu, Paula L.","In situ synthesis of lanthanide complexes supported by a ferrocene diamide ligand: extension to redox-active lanthanide ions","New J. Chem.","2015","39","10","7696","","10.1039/C5NJ01402F","","","0.71073","MoKα","","0.0388","0.0347","","","0.0926","0.0945","","","","","","1.116","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055051","12.0342","0.0003","17.4069","0.0004","9.4392","0.0002","90","","91.757","0.002","90","","1976.38","0.08","296","2","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N2 O -","- C26 H20 N2 O -","- C104 H80 N8 O4 -","4","1","","Liang, Zuo-Qin; Wang, Xiao-Mei; Dai, Guo-Liang; Ye, Chang-Qing; Zhou, Yu-Yang; Tao, Xu-Tang","The solvatochromism and aggregation-induced enhanced emission based on triphenylamine-propenone","New J. Chem.","2015","39","11","8874","","10.1039/C5NJ01072A","","","0.71073","MOKα","","0.096","0.0567","","","0.1507","0.1864","","","","","","1.032","","","","has coordinates","171311","2020-10-21","18:00:00",""
"7055052","12.1179","0.0007","17.3412","0.001","9.5281","0.0006","90","","91.21","0.004","90","","2001.8","0.2","293","2","293.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H21 N O -","- C27 H21 N O -","- C108 H84 N4 O4 -","4","1","","Liang, Zuo-Qin; Wang, Xiao-Mei; Dai, Guo-Liang; Ye, Chang-Qing; Zhou, Yu-Yang; Tao, Xu-Tang","The solvatochromism and aggregation-induced enhanced emission based on triphenylamine-propenone","New J. Chem.","2015","39","11","8874","","10.1039/C5NJ01072A","","","0.7107","MoKα","","0.0905","0.0461","","","0.0944","0.1142","","","","","","0.981","","","","has coordinates","171311","2020-10-21","18:00:00",""
"7055053","10.3265","0.0019","17.115","0.003","17.194","0.003","90","","96.575","0.003","90","","3018.8","0.9","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Gd N7 Ni O15 -","- C22 H24 Gd N7 Ni O15 -","- C88 H96 Gd4 N28 Ni4 O60 -","4","1","","Yao, Min-Xia; Lu, Xing-Yun; Zhu, Zhao-Xia; Deng, Xiao-Wei; Jing, Su","Synthesis, structures and magnetism of a series of dinuclear and one-dimensional Ni‒Ln complexes: single-molecule magnetic behavior in one-dimensional nitrate-bridged Dy analogue","New J. Chem.","2015","39","11","8356","","10.1039/C5NJ01708D","","","0.71073","MoKα","","0.0326","0.0287","","","0.0736","0.0758","","","","","","1.074","","","","has coordinates","171312","2020-10-21","18:00:00",""
"7055054","10.309","0.003","17.095","0.005","17.232","0.005","90","","96.548","0.004","90","","3017","1.5","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 N7 Ni O15 Tb -","- C22 H24 N7 Ni O15 Tb -","- C88 H96 N28 Ni4 O60 Tb4 -","4","1","","Yao, Min-Xia; Lu, Xing-Yun; Zhu, Zhao-Xia; Deng, Xiao-Wei; Jing, Su","Synthesis, structures and magnetism of a series of dinuclear and one-dimensional Ni‒Ln complexes: single-molecule magnetic behavior in one-dimensional nitrate-bridged Dy analogue","New J. Chem.","2015","39","11","8356","","10.1039/C5NJ01708D","","","0.71073","MoKα","","0.0245","0.0202","","","0.0495","0.0508","","","","","","1.104","","","","has coordinates","171312","2020-10-21","18:00:00",""
"7055055","21.577","0.003","9.4531","0.0012","15.866","0.002","90","","114.88","0.002","90","","2935.8","0.7","296","2","296","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C22 H24 Dy N7 Ni O15 -","- C22 H24 Dy N7 Ni O15 -","- C88 H96 Dy4 N28 Ni4 O60 -","4","1","","Yao, Min-Xia; Lu, Xing-Yun; Zhu, Zhao-Xia; Deng, Xiao-Wei; Jing, Su","Synthesis, structures and magnetism of a series of dinuclear and one-dimensional Ni‒Ln complexes: single-molecule magnetic behavior in one-dimensional nitrate-bridged Dy analogue","New J. Chem.","2015","39","11","8356","","10.1039/C5NJ01708D","","","0.71073","MoKα","","0.016","0.0153","","","0.0354","0.0357","","","","","","0.874","","","","has coordinates","171312","2020-10-21","18:00:00",""
"7055056","10.0281","0.0014","12.0551","0.0017","15.254","0.002","71.779","0.002","86.572","0.002","68.175","0.002","1622.7","0.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H32 N5 Ni O17 Tb -","- C23 H32 N5 Ni O17 Tb -","- C46 H64 N10 Ni2 O34 Tb2 -","2","1","","Yao, Min-Xia; Lu, Xing-Yun; Zhu, Zhao-Xia; Deng, Xiao-Wei; Jing, Su","Synthesis, structures and magnetism of a series of dinuclear and one-dimensional Ni‒Ln complexes: single-molecule magnetic behavior in one-dimensional nitrate-bridged Dy analogue","New J. Chem.","2015","39","11","8356","","10.1039/C5NJ01708D","","","0.71073","MoKα","","0.035","0.0318","","","0.0891","0.0911","","","","","","1.023","","","","has coordinates","171312","2020-10-21","18:00:00",""
"7055057","10.0241","0.0017","12.042","0.002","15.27","0.003","71.869","0.002","86.592","0.003","68.157","0.002","1622.6","0.5","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H32 Dy N5 Ni O17 -","- C23 H32 Dy N5 Ni O17 -","- C46 H64 Dy2 N10 Ni2 O34 -","2","1","","Yao, Min-Xia; Lu, Xing-Yun; Zhu, Zhao-Xia; Deng, Xiao-Wei; Jing, Su","Synthesis, structures and magnetism of a series of dinuclear and one-dimensional Ni‒Ln complexes: single-molecule magnetic behavior in one-dimensional nitrate-bridged Dy analogue","New J. Chem.","2015","39","11","8356","","10.1039/C5NJ01708D","","","0.71073","MoKα","","0.0428","0.0379","","","0.1062","0.1108","","","","","","0.904","","","","has coordinates","171312","2020-10-21","18:00:00",""
"7055058","9.9779","0.0011","11.5105","0.0012","13.4027","0.0014","91.472","0.006","107.929","0.006","109.296","0.006","1368.3","0.3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H26 Br3 O5 -","- C30 H26 Br3 O5 -","- C60 H52 Br6 O10 -","2","1","","Pavan Kumar, Chottanahalli S.; Harsha, Kachigere B.; Sandhya, Nagarakere C.; Ramesha, Ajjalli B.; Mantelingu, Kempegowda; Rangappa, Kanchugarakoppal S.","Highly diastereoselective synthesis of polycyclic amines via redox neutral C‒H functionalization","New J. Chem.","2015","39","11","8397","","10.1039/C5NJ01706H","","","1.54178","CuKα","","0.3233","0.2921","","","0.6761","0.7025","","","","","","6.633","","","","has coordinates","171322","2020-10-21","18:00:00",""
"7055059","9.5848","0.0007","11.0031","0.0008","14.0353","0.0011","87.764","0.002","70.878","0.002","65.624","0.002","1265.88","0.17","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H26 Br Cl N2 O3 -","- C30 H26 Br Cl N2 O3 -","- C60 H52 Br2 Cl2 N4 O6 -","2","1","","Pavan Kumar, Chottanahalli S.; Harsha, Kachigere B.; Sandhya, Nagarakere C.; Ramesha, Ajjalli B.; Mantelingu, Kempegowda; Rangappa, Kanchugarakoppal S.","Highly diastereoselective synthesis of polycyclic amines via redox neutral C‒H functionalization","New J. Chem.","2015","39","11","8397","","10.1039/C5NJ01706H","","","1.54178","CuKα","","0.0335","0.0331","","","0.0959","0.0965","","","","","","1.103","","","","has coordinates","171322","2020-10-21","18:00:00",""
"7055060","17.574","0.0017","8.964","0.0009","20.843","0.002","90","","106.682","0.004","90","","3145.3","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H36 N2 O6 S2 -","- C35 H36 N2 O6 S2 -","- C140 H144 N8 O24 S8 -","4","1","","Pavan Kumar, Chottanahalli S.; Harsha, Kachigere B.; Sandhya, Nagarakere C.; Ramesha, Ajjalli B.; Mantelingu, Kempegowda; Rangappa, Kanchugarakoppal S.","Highly diastereoselective synthesis of polycyclic amines via redox neutral C‒H functionalization","New J. Chem.","2015","39","11","8397","","10.1039/C5NJ01706H","","","1.54178","CuKα","","0.0596","0.0545","","","0.1671","0.1727","","","","","","1.078","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055061","35.8393","0.0017","10.627","0.0004","15.166","0.0007","90","","114.399","0.005","90","","5260.3","0.5","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H12 F3 N O -","- C15 H12 F3 N O -","- C240 H192 F48 N16 O16 -","16","2","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0635","0.0417","","","0.0888","0.1008","","","","","","1.05","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055062","15.1633","0.0005","9.9603","0.0003","17.7768","0.0006","90","","97.269","0.002","90","","2663.27","0.15","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 F3 N O -","- C15 H12 F3 N O -","- C120 H96 F24 N8 O8 -","8","2","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0659","0.049","","","0.1259","0.1356","","","","","","1.061","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055063","9.6555","0.0007","13.742","0.0011","19.3339","0.0015","90","","90","","90","","2565.3","0.3","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H12 F3 N O -","- C15 H12 F3 N O -","- C120 H96 F24 N8 O8 -","8","1","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.058","0.0398","","","0.0901","0.1028","","","","","","1.055","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055064","8.9803","0.0004","10.8526","0.0004","14.8181","0.0005","90","","92.763","0.003","90","","1442.49","0.1","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 F6 N O -","- C16 H11 F6 N O -","- C64 H44 F24 N4 O4 -","4","1","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0434","0.0368","","","0.0933","0.0982","","","","","","1.043","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055065","9.0978","0.0007","22.1735","0.0015","7.9449","0.0005","90","","101.946","0.004","90","","1568.02","0.19","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 F6 N O -","- C16 H11 F6 N O -","- C64 H44 F24 N4 O4 -","4","1","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0637","0.0482","","","0.1285","0.1388","","","","","","1.066","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055066","8.3764","0.0005","23.2362","0.0017","7.9755","0.0006","90","","103.567","0.002","90","","1509","0.18","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 F6 N O -","- C16 H11 F6 N O -","- C64 H44 F24 N4 O4 -","4","1","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0534","0.041","","","0.0993","0.1059","","","","","","1.033","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055067","11.2958","0.0005","14.0246","0.0004","10.4868","0.0003","90","","115.258","0.004","90","","1502.48","0.1","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 F6 N O -","- C16 H11 F6 N O -","- C64 H44 F24 N4 O4 -","4","1","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0499","0.0411","","","0.0993","0.1065","","","","","","1.066","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055068","12.3185","0.001","7.9401","0.0005","15.4912","0.0012","90","","90.168","0.004","90","","1515.19","0.19","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H11 F6 N O -","- C16 H11 F6 N O -","- C64 H44 F24 N4 O4 -","4","1","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.059","0.0384","","","0.0865","0.093","","","","","","1.034","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055069","8.9977","0.0004","10.8088","0.0005","16.672","0.0009","105.291","0.002","98.901","0.002","102.688","0.002","1486.36","0.13","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H11 F6 N O -","- C16 H11 F6 N O -","- C64 H44 F24 N4 O4 -","4","2","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0602","0.043","","","0.104","0.1143","","","","","","1.039","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055070","10.7818","0.0007","10.2566","0.0006","14.5072","0.0009","90","","109.917","0.007","90","","1508.32","0.17","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-(3,3-diethoxy-1,2-diiodoprop-1-en-1-yl)benzene","","- C13 H16 I2 O2 -","- C13 H16 I2 O2 -","- C52 H64 I8 O8 -","4","1","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71069","MoKα","","0.0472","0.0307","","","0.0593","0.0656","","","","","","1.029","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055071","11.3978","0.0004","7.2145","0.0002","18.1044","0.0006","90","","98.253","0.003","90","","1473.3","0.08","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Z)-(3,3-diethoxy-1,2-diiodoprop-1-en-1-yl)benzene","","- C13 H16 I2 O2 -","- C13 H16 I2 O2 -","- C52 H64 I8 O8 -","4","1","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71069","MoKα","","0.0294","0.0231","","","0.0531","0.0566","","","","","","1.098","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055072","10.1365","0.0004","15.9425","0.0006","5.7295","0.0002","90","","94.279","0.004","90","","923.31","0.06","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(E)-(1,2-diiodovinyl)benzene","","- C8 H6 I2 -","- C8 H6 I2 -","- C32 H24 I8 -","4","0.5","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71073","MoKα","","0.0245","0.0176","","","0.0404","0.0415","","","","","","1.027","","","","has coordinates","171310","2020-10-21","18:00:00",""
"7055073","5.7078","0.0003","17.4128","0.0008","7.0077","0.0004","90","","110.984","0.006","90","","650.3","0.06","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-1,2-diiodo-1,2-diphenylethene","","- C14 H10 I2 -","- C14 H10 I2 -","- C28 H20 I4 -","2","0.5","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71073","MoKα","","0.021","0.0162","","","0.0368","0.0374","","","","","","1.053","","","","has coordinates,has disorder","171310","2020-10-21","18:00:00",""
"7055074","8.6795","0.0004","7.5937","0.0002","8.552","0.0004","90","","108.798","0.005","90","","533.59","0.04","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","dimethyl 2,3-diiodofumarate","","- C6 H6 I2 O4 -","- C6 H6 I2 O4 -","- C12 H12 I4 O8 -","2","0.5","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71073","MoKα","","0.0211","0.0174","","","0.042","0.0427","","","","","","0.969","","","","has coordinates,has disorder","171310","2020-10-21","18:00:00",""
"7055075","23.9673","0.0005","23.9673","0.0005","7.5322","0.0003","90","","90","","90","","4326.7","0.2","173","2","173","2","","","","","","","","4","I 41/a","-I 4ad","88","","(E)-2,3-diiodo-3-phenylprop-2-en-1-ol","","- C9 H8 I2 O -","- C9 H8 I2 O -","- C144 H128 I32 O16 -","16","","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71073","MoKα","","0.0386","0.0225","","","0.0412","0.0432","","","","","","0.89","","","","has coordinates,has disorder","171310","2020-10-21","18:00:00",""
"7055076","12.8366","0.0005","7.0467","0.0002","14.279","0.0006","90","","96.053","0.004","90","","1284.42","0.08","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(E)-ethyl 2,3-diiodo-3-phenylacrylate","","- C11 H10 I2 O2 -","- C11 H10 I2 O2 -","- C44 H40 I8 O8 -","4","1","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71073","MoKα","","0.0416","0.0232","","","0.0424","0.0449","","","","","","0.917","","","","has coordinates,has disorder","171310","2020-10-21","18:00:00",""
"7055077","18.9368","0.0009","7.607","0.0003","22.9348","0.0012","90","","109.349","0.006","90","","3117.2","0.3","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(E)-(1,2-diiodoprop-1-en-1-yl)benzene","","- C9 H8 I2 -","- C9 H8 I2 -","- C108 H96 I24 -","12","3","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71073","MoKα","","0.0457","0.0282","","","0.0525","0.0552","","","","","","0.857","","","","has coordinates,has disorder","171310","2020-10-21","18:00:00",""
"7055078","20.5998","0.0015","7.1799","0.0002","18.253","0.002","90","","120.835","0.011","90","","2318.1","0.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(E)-methyl 2,3-diiodo-3-phenylacrylate","","- C10 H8 I2 O2 -","- C10 H8 I2 O2 -","- C80 H64 I16 O16 -","8","1","","Hettstedt, Christina; Mayer, Peter; Karaghiosoff, Konstantin","Halogen bonding in the crystal structures of 1,2-diiodo alkenes","New J. Chem.","2015","39","11","8522","","10.1039/C5NJ00821B","","","0.71073","MoKα","","0.0367","0.025","","","0.0531","0.0547","","","","","","0.94","","","","has coordinates","171310","2020-10-21","18:00:00",""
"7055079","7.4955","0.0011","7.5254","0.0011","12.0645","0.0017","80.285","0.002","86.767","0.002","67.729","0.002","620.7","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","ethyl (2Z)-3-[(4-bromophenyl)amino]-2-cyanoprop-2-enoate","","- C12 H11 Br N2 O2 -","- C12 H11 Br N2 O2 -","- C24 H22 Br2 N4 O4 -","2","1","","Zhang, Zhenfeng; Ma, Nana; Xuan, Xiaopeng","An unusual CC⋯CO interaction in (Z)-3-[(4-halogenphenyl)amino]-2-cyanoprop-2-enoates","New J. Chem.","2016","40","1","85","","10.1039/C5NJ01814E","","","0.71073","MoKα","","0.0394","0.0309","","","0.0736","0.077","","","","","","1.07","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055080","6.1217","0.0011","24.779","0.005","12.246","0.002","90","","98.345","0.003","90","","1837.9","0.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 N4 O5 S -","- C20 H16 N4 O5 S -","- C80 H64 N16 O20 S4 -","4","1","","Surov, Artem O.; Voronin, Alexander P.; Simagina, Anna A.; Churakov, Andrei V.; Skachilova, Sophia Y.; Perlovich, German L.","Saccharin salts of biologically active hydrazone derivatives","New J. Chem.","2015","39","11","8614","","10.1039/C5NJ01532D","","","0.71073","MoKα","","0.0794","0.0549","","","0.1114","0.1198","","","","","","1.071","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055081","6.1904","0.0009","26.105","0.004","12.4015","0.0018","90","","100.464","0.002","90","","1970.8","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 N4 O6 S -","- C21 H18 N4 O6 S -","- C84 H72 N16 O24 S4 -","4","1","","Surov, Artem O.; Voronin, Alexander P.; Simagina, Anna A.; Churakov, Andrei V.; Skachilova, Sophia Y.; Perlovich, German L.","Saccharin salts of biologically active hydrazone derivatives","New J. Chem.","2015","39","11","8614","","10.1039/C5NJ01532D","","","0.71073","MoKα","","0.085","0.0463","","","0.0974","0.1112","","","","","","1.013","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055082","18.766","0.003","18.766","0.003","24.688","0.002","90","","90","","120","","7529.4","1.8","120","0.1","120","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C42 H30 Cl6 N6 O11 Pd3 -","- C42 H30 Cl6 N6 O11 Pd3 -","- C252 H180 Cl36 N36 O66 Pd18 -","6","0.333333","","Karami, Kazem; Lighvan, Zohreh Mehri; Barzani, Somayeh Asgari; Faal, Ali Yeganeh; Poshteh-Shirani, Marziyeh; Khayamian, Taghi; Eigner, Václav; Dušek, Michal","Design and synthesis of a novel trinuclear palladium(ii) complex containing an oxime chelate ligand: determining the interaction mechanism with the DNA groove and BSA site I by spectroscopic and molecular dynamics simulation approaches","New J. Chem.","2015","39","11","8708","","10.1039/C5NJ01280E","","x-ray","1.54184","CuKα","","0.1268","0.0726","","","0.1653","0.1956","","","","1.69","1.69","1.37","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055083","24.539","0.006","20.456","0.005","15.357","0.004","90","","97.384","0.007","90","","7645","3","296","2","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C73 H71 N11 O10.5 Yb -","- C73 H71 N11 O10.5 Yb -","- C292 H284 N44 O42 Yb4 -","4","1","","Huang, Wei; Xu, Jun; Wu, Dayu; Huang, Xingcai; Jiang, Jun","Rhodamine-based field-induced single molecule magnets in Yb(iii) and Dy(iii) series","New J. Chem.","2015","39","11","8650","","10.1039/C5NJ01724F","","","0.71073","MoKα","","0.1256","0.0802","","","0.2181","0.2529","","","","","","1.052","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7055084","13.003","0.005","14.986","0.002","15.684","0.002","117.719","0.004","95.949","0.006","92.878","0.006","2674.1","1.1","296","2","296.15","","","","","","","","","7","P -1","-P 1","2","","","","- C53 H44 F6 N5 O8 S2 Yb -","- C53 H44 F6 N5 O8 S2 Yb -","- C106 H88 F12 N10 O16 S4 Yb2 -","2","1","","Huang, Wei; Xu, Jun; Wu, Dayu; Huang, Xingcai; Jiang, Jun","Rhodamine-based field-induced single molecule magnets in Yb(iii) and Dy(iii) series","New J. Chem.","2015","39","11","8650","","10.1039/C5NJ01724F","","","0.71073","MoKα","","0.1414","0.0736","","","0.1535","0.1895","","","","","","0.931","","","","has coordinates,has disorder","171319","2020-10-21","18:00:00",""
"7055085","13.001","0.003","14.9878","0.0017","15.6387","0.0019","117.175","0.002","95.878","0.003","92.955","0.003","2680","0.8","296","2","296.15","","","","","","","","","7","P -1","-P 1","2","","","","- C53 H45 Dy F6 N5 O8.5 S2 -","- C53 H45 Dy F6 N5 O8.5 S2 -","- C106 H90 Dy2 F12 N10 O17 S4 -","2","1","","Huang, Wei; Xu, Jun; Wu, Dayu; Huang, Xingcai; Jiang, Jun","Rhodamine-based field-induced single molecule magnets in Yb(iii) and Dy(iii) series","New J. Chem.","2015","39","11","8650","","10.1039/C5NJ01724F","","","0.71073","MoKα","","0.0453","0.0378","","","0.0986","0.1048","","","","","","1.051","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7055086","13.0712","0.0013","15.13","0.0007","15.7825","0.0007","118.258","0.003","97.533","0.004","91.684","0.004","2710.6","0.3","296","2","296.15","","","","","","","","","7","P -1","-P 1","2","","","","- C54 H48 F6 N5 O9 S2 Tb -","- C54 H48 F6 N5 O9 S2 Tb -","- C108 H96 F12 N10 O18 S4 Tb2 -","2","1","","Huang, Wei; Xu, Jun; Wu, Dayu; Huang, Xingcai; Jiang, Jun","Rhodamine-based field-induced single molecule magnets in Yb(iii) and Dy(iii) series","New J. Chem.","2015","39","11","8650","","10.1039/C5NJ01724F","","","0.71073","MoKα","","0.0914","0.0677","","","0.1626","0.1788","","","","","","1.0612","","","","has coordinates,has disorder","171319","2020-10-21","18:00:00",""
"7055087","13.023","0.004","15.037","0.004","15.687","0.004","117.673","0.004","96.46","0.02","92.48","0.02","2687.3","1.3","296","2","296.15","","","","","","","","","7","P -1","-P 1","2","","","","- C54 H48 F6 Ho N5 O9 S2 -","- C54 H48 F6 Ho N5 O9 S2 -","- C108 H96 F12 Ho2 N10 O18 S4 -","2","1","","Huang, Wei; Xu, Jun; Wu, Dayu; Huang, Xingcai; Jiang, Jun","Rhodamine-based field-induced single molecule magnets in Yb(iii) and Dy(iii) series","New J. Chem.","2015","39","11","8650","","10.1039/C5NJ01724F","","","0.71073","MoKα","","0.0361","0.0296","","","0.0773","0.0804","","","","","","1.07","","","","has coordinates,has disorder","171319","2020-10-21","18:00:00",""
"7055088","23.177","0.005","8.5606","0.0017","23.924","0.005","90","","90","","90","","4746.7","1.7","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H24 N4 O4 S2 -","- C24 H24 N4 O4 S2 -","- C192 H192 N32 O32 S16 -","8","1","","Das, Sangita; Goswami, Shyamaprosad; Aich, Krishnendu; Ghoshal, Kakali; Quah, Ching Kheng; Bhattacharyya, Maitree; Fun, Hoong-Kun","ESIPT and CHEF based highly sensitive and selective ratiometric sensor for Al3+with imaging in human blood cells","New J. Chem.","2015","39","11","8582","","10.1039/C5NJ01468A","","","0.71073","MoKα","","0.1569","0.0623","","","0.1553","0.2121","","","","","","0.962","","","","has coordinates","171316","2020-10-21","18:00:00",""
"7055089","10.107","0.003","11.058","0.003","12.667","0.003","71.325","0.004","71.161","0.004","78.62","0.004","1262.3","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 6'-amino-5-bromo-5'-cyano-2-oxo-1'-phenyl-1'H-spiro[indoline-3,4'-pyrano[2,3-c]pyrazole]-3'-carboxylate","","- C25 H20 Br N5 O5 -","- C25 H20 Br N5 O5 -","- C50 H40 Br2 N10 O10 -","2","1","","Karnakar, K.; Ramesh, K.; Reddy, K. Harsha Vardhan; Anil Kumar, B. S. P.; Nanubonula, Jagadeesh Babu; Nageswar, Y. V. D.","A novel one pot four-component reaction for the efficient synthesis of spiro[indoline-3,4′-pyrano[2,3-c]pyrazole]-3′-carboxylate and trifluoromethylated spiro[indole-3,4′-pyrano[2,3-c]pyrazole] derivatives using recyclable PEG-400","New J. Chem.","2015","39","11","8978","","10.1039/C5NJ01448D","","","0.71073","MoKα","","0.0745","0.0468","","","0.1258","0.1409","","","","","","1.028","","","","has coordinates,has disorder","171313","2020-10-21","18:00:00",""
"7055090","11.1658","0.0005","11.1797","0.0005","13.1399","0.0006","67.863","0.001","65.724","0.001","67.08","0.001","1330.51","0.1","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C42 H32 Br2 Cl6 Mo2 N8 O6 S4 -","- C42 H32 Br2 Cl6 Mo2 N8 O6 S4 -","- C42 H32 Br2 Cl6 Mo2 N8 O6 S4 -","1","0.5","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Mitra, Payel; Acharya, Krishnendu; Biswas, Sujan; Mondal, Tapan Kumar","Supramolecular frameworks of binuclear dioxomolybdenum(vi) complexes with ONS donor ligands using 4,4′-azopyridine as a pillar: crystal structure, DFT calculations and biological study","New J. Chem.","2015","39","11","8681","","10.1039/C5NJ01899D","","","0.71073","MoKα","","0.0634","0.0416","","","0.1037","0.1219","","","","","","0.882","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055091","10.827","0.018","11.07","0.018","12.58","0.02","65.78","0.017","73.533","0.017","65.932","0.017","1243","4","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H34 Cl6 Mo2 N8 O6 S4 -","- C42 H34 Cl6 Mo2 N8 O6 S4 -","- C42 H34 Cl6 Mo2 N8 O6 S4 -","1","0.5","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Mitra, Payel; Acharya, Krishnendu; Biswas, Sujan; Mondal, Tapan Kumar","Supramolecular frameworks of binuclear dioxomolybdenum(vi) complexes with ONS donor ligands using 4,4′-azopyridine as a pillar: crystal structure, DFT calculations and biological study","New J. Chem.","2015","39","11","8681","","10.1039/C5NJ01899D","","","0.71073","MoKα","","0.1394","0.0838","","","0.2067","0.242","","","","","","0.943","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055092","10.9255","0.0007","10.9637","0.0007","13.2353","0.0008","67.269","0.006","69.255","0.005","67.937","0.006","1314","0.16","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H32 Cl6 Mo2 N10 O10 S4 -","- C42 H32 Cl6 Mo2 N10 O10 S4 -","- C42 H32 Cl6 Mo2 N10 O10 S4 -","1","0.5","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Mitra, Payel; Acharya, Krishnendu; Biswas, Sujan; Mondal, Tapan Kumar","Supramolecular frameworks of binuclear dioxomolybdenum(vi) complexes with ONS donor ligands using 4,4′-azopyridine as a pillar: crystal structure, DFT calculations and biological study","New J. Chem.","2015","39","11","8681","","10.1039/C5NJ01899D","","","0.71073","MoKα","","0.0822","0.059","","","0.1243","0.1387","","","","","","1.039","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055093","8.89","0.0002","10.3346","0.0002","11.2245","0.0002","115.313","0.001","95.614","0.001","93.303","0.001","922.08","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H19 N5 O5 S -","- C17 H19 N5 O5 S -","- C34 H38 N10 O10 S2 -","2","1","","Patel, Tarosh S.; Vanparia, Satish F.; Gandhi, Sahaj A.; Patel, Urmila H.; Dixit, Ritu B.; Chudasama, Chaitanya J.; Dixit, Bharat C.","Novel stereoselective 2,3-disubstituted quinazoline-4(3H)-one derivatives derived from glycine as a potent antimalarial lead","New J. Chem.","2015","39","11","8638","","10.1039/C5NJ01408E","","","0.71073","MoKα","","0.0523","0.0469","","","0.1361","0.1432","","","","","","1.044","","","","has coordinates","171317","2020-10-21","18:00:00",""
"7055094","7.774","0.002","4.6585","0.0011","10.254","0.003","90","","109.516","0.015","90","","350.02","0.16","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- F2 Mg5 O8 Si2 -","- F2 Mg5 O8 Si2 -","- F4 Mg10 O16 Si4 -","2","0.5","","Zhen, Ni; Wu, Kui; Li, Qiang; Pan, Shilie; Gao, Wenhui; Yang, Zhihua","Synthesis, structures, and properties of two magnesium silicate fluorides Mg5(SiO4)2F2and Mg3SiO4F2","New J. Chem.","2015","39","11","8866","","10.1039/C5NJ01911G","","","0.71073","MoKα","","0.0729","0.0671","","","0.1935","0.1981","","","","","","1.181","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055095","10.268","0.007","8.694","0.006","4.65","0.003","90","","90","","90","","415.1","0.5","296","2","296","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- F2 Mg3 O4 Si -","- F2 Mg3 O4 Si -","- F8 Mg12 O16 Si4 -","4","0.5","","Zhen, Ni; Wu, Kui; Li, Qiang; Pan, Shilie; Gao, Wenhui; Yang, Zhihua","Synthesis, structures, and properties of two magnesium silicate fluorides Mg5(SiO4)2F2and Mg3SiO4F2","New J. Chem.","2015","39","11","8866","","10.1039/C5NJ01911G","","","0.71073","MoKα","","0.0713","0.0643","","","0.1869","0.1929","","","","","","1.156","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055096","12.8819","0.0011","19.3135","0.0015","21.382","0.003","90","","94.83","0.009","90","","5300.8","1","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H25 N O3 -","- C34 H25 N O3 -","- C272 H200 N8 O24 -","8","2","","Astolfi, Paola; Alberti, Angelo; Carloni, Patricia; Greci, Lucedio; Rizzoli, Corrado; Stipa, Pierluigi","The reactivity of manganese dioxide with different substrates in organic solvents","New J. Chem.","2015","","","","","10.1039/C5NJ01592H","","","1.54178","CuKα","","0.0769","0.0453","","","0.1105","0.1267","","","","","","0.958","","","","has coordinates","288505","2023-12-22","15:12:03",""
"7055097","9.6261","0.0003","10.9469","0.0003","14.6288","0.0004","72.336","0.003","89.163","0.003","65.679","0.002","1327.63","0.08","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H26 Cl2 N5 O2 P3 -","- C24 H26 Cl2 N5 O2 P3 -","- C48 H52 Cl4 N10 O4 P6 -","2","1","","Başterzi, Nisan Sevin; Bilge Koçak, Selen; Okumuş, Aytuğ; Kılıç, Zeynel; Hökelek, Tuncer; Çelik, Ömer; Türk, Mustafa; Koç, L. Yasemin; Açık, Leyla; Aydın, Betül","Syntheses, structural characterization and biological activities of spiro-ansa-spiro-cyclotriphosphazenes","New J. Chem.","2015","39","11","8825","","10.1039/C5NJ01530H","","","0.71073","MoKα","","0.0634","0.0443","","","0.1187","0.1297","","","","","","1.036","","","","has coordinates","171320","2020-10-21","18:00:00",""
"7055098","7.136","0.0013","9.7606","0.0013","13.6208","0.0012","70.976","0.01","78.653","0.012","71.791","0.015","847.2","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H23 N3 O -","- C19 H23 N3 O -","- C38 H46 N6 O2 -","2","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","0.7107","MoKα","","0.0784","0.0596","","","0.1378","0.1594","","","","","","1.034","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055099","10.2724","0.0004","10.5468","0.0004","10.7163","0.0004","68.395","0.004","71.217","0.004","69.263","0.004","984.7","0.07","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","","","- C26 H20 N2 O -","- C26 H20 N2 O -","- C52 H40 N4 O2 -","2","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","0.71073","MoKα","","0.0445","0.0372","","","0.0917","0.0964","","","","","","1.018","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055100","8.8129","0.0004","9.0613","0.0005","16.1691","0.0007","92.583","0.004","92.986","0.004","104.621","0.004","1245.43","0.11","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 Br N3 O -","- C32 H24 Br N3 O -","- C64 H48 Br2 N6 O2 -","2","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","1.5418","CuKα","","0.0433","0.0346","","","0.0835","0.0895","","","","","","1.032","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055101","6.1591","0.0005","12.0853","0.001","12.7889","0.0009","101.637","0.006","93.38","0.006","92.887","0.007","928.86","0.13","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H23 N3 O -","- C23 H23 N3 O -","- C46 H46 N6 O2 -","2","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","0.7107","MoKα","","0.072","0.0585","","","0.1566","0.1728","","","","","","1.07","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055102","22.9818","0.0013","8.6205","0.0003","23.3388","0.001","90","","114.188","0.006","90","","4217.8","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H23 N3 O -","- C27 H23 N3 O -","- C216 H184 N24 O8 -","8","2","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","0.71073","MoKα","","0.1129","0.0912","","","0.215","0.226","","","","","","1.115","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055103","9.1527","0.0008","10.0852","0.0007","10.4387","0.0009","90","","110.242","0.01","90","","904.05","0.14","100.01","0.1","100","0.02","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H21 N3 O -","- C22 H21 N3 O -","- C44 H42 N6 O2 -","2","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","1.5418","CuKα","","0.0513","0.0399","","","0.0919","0.0994","","","","","","1.012","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055104","9.5535","0.0003","6.1044","0.0003","26.1423","0.001","90","","97.15","0.003","90","","1512.72","0.11","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H19 N3 O -","- C17 H19 N3 O -","- C68 H76 N12 O4 -","4","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","0.71073","MoKα","","0.0652","0.0485","","","0.1158","0.1247","","","","","","1.054","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055105","17.0999","0.0002","8.90736","0.0001","15.9119","0.0002","90","","90","","90","","2423.62","0.05","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C32 H25 N3 O -","- C32 H25 N3 O -","- C128 H100 N12 O4 -","4","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","1.54184","CuKα","","0.0274","0.0268","","","0.067","0.0677","","","","","","1.042","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055106","10.5963","0.0006","10.8613","0.0005","13.9872","0.0006","83.343","0.004","69.786","0.005","61.16","0.005","1320.75","0.14","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H24 Br N3 O -","- C32 H24 Br N3 O -","- C64 H48 Br2 N6 O2 -","2","1","","Smirnov, Andrey S.; Yandanova, Ekaterina S.; Bokach, Nadezhda A.; Starova, Galina L.; Gurzhiy, Vladislav V.; Avdontceva, Margarita S.; Zolotarev, Andrey A.; Kukushkin, Vadim Yu.","Zinc(ii)-mediated generation of 5-amino substituted 2,3-dihydro-1,2,4-oxadiazoles and their further ZnII-catalyzed and O2-involving transformations","New J. Chem.","2015","39","12","9330","","10.1039/C5NJ02061A","","","1.54184","CuKα","","0.05","0.0466","","","0.1334","0.1386","","","","","","1.03","","","","has coordinates","171304","2020-10-21","18:00:00",""
"7055107","9.735","0.003","11.144","0.003","12.745","0.004","90","","90","","90","","1382.7","0.7","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Indozolidinoindolones","(5S,11bR)-5-(hydroxymethyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-indolizino[8,7-b]indol-3(2H)-one","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","","Bathula, Chandramohan; Dangi, Poonam; Hati, Santanu; Agarwal, Rahul; Munshi, Parthapratim; Singh, Ashutosh; Singh, Shailja; Sen, Subhabrata","Diverse synthesis of natural product inspired fused and spiro-heterocyclic scaffolds via ring distortion and ring construction strategies","New J. Chem.","2015","39","12","9281","","10.1039/C5NJ01858G","","","0.71073","MoKα","","0.0458","0.0352","","","0.0804","0.0862","","","","","","1.065","","","","has coordinates","171298","2020-10-21","18:00:00",""
"7055108","9.821","0.008","11.174","0.008","12.954","0.01","90","","90","","90","","1421.6","1.9","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","indozolidinoindolones","(5R,11bS)-5-(hydroxymethyl)-11b-methyl-5,6,11,11b-tetrahydro-1H-indolizino[8,7-b]indol-3(2H)-one","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","","Bathula, Chandramohan; Dangi, Poonam; Hati, Santanu; Agarwal, Rahul; Munshi, Parthapratim; Singh, Ashutosh; Singh, Shailja; Sen, Subhabrata","Diverse synthesis of natural product inspired fused and spiro-heterocyclic scaffolds via ring distortion and ring construction strategies","New J. Chem.","2015","39","12","9281","","10.1039/C5NJ01858G","","","0.71073","MoKα","","0.0598","0.0423","","","0.0925","0.1024","","","","","","1.055","","","","has coordinates","171298","2020-10-21","18:00:00",""
"7055109","7.289","0.003","11.525","0.004","14.616","0.005","90","","91.587","0.019","90","","1227.4","0.8","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","spiroindolopyrrolizinones","(1'R,7a'S)-7a'-methyl-2',3',7',7a'-tetrahydrospiro[indoline-3,1'-pyrrolizine]-2,5'(6'H)-dione","","- C15 H16 N2 O2 -","- C15 H16 N2 O2 -","- C60 H64 N8 O8 -","4","1","","Bathula, Chandramohan; Dangi, Poonam; Hati, Santanu; Agarwal, Rahul; Munshi, Parthapratim; Singh, Ashutosh; Singh, Shailja; Sen, Subhabrata","Diverse synthesis of natural product inspired fused and spiro-heterocyclic scaffolds via ring distortion and ring construction strategies","New J. Chem.","2015","39","12","9281","","10.1039/C5NJ01858G","","","0.71073","MoKα","","0.2204","0.1267","","","0.3225","0.4145","","","","","","1.131","","","","has coordinates","171298","2020-10-21","18:00:00",""
"7055110","13.677","0.007","16.455","0.008","19.539","0.008","70.956","0.018","76.3","0.02","87.68","0.02","4035","3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","AzPy2HBF4","AzPy2H_BF4","","- C100.5 H71.5 B3 F12 N6 O1.83 -","- C100.5 H71.5 B3 F12 N6 O1.828 -","- C201 H143 B6 F24 N12 O3.656 -","2","1","","Ninomiya, Kazuki; Harada, Yumi; Kanetou, Tomoaki; Suenaga, Yuma; Murafuji, Toshihiro; Tsunashima, Ryo","Synthesis and acid‒base properties of a proton-bridged biaryl compound based on pyridylazulene","New J. Chem.","2015","39","12","9079","","10.1039/C5NJ01651G","","","0.7107","MoKα","","0.1586","0.1034","","","0.2693","0.3137","","","","","","1.314","","","","has coordinates,has disorder","176429","2020-10-21","18:00:00",""
"7055111","9.994","0.002","10.49","0.003","16.062","0.004","103.726","0.007","94.369","0.007","98.139","0.007","1608.7","0.7","90","","90","","","","","","","","","4","P -1","-P 1","2","PhTPDC","","","- C40 H34 O6 S2 -","- C40 H34 O6 S2 -","- C80 H68 O12 S4 -","2","1","","Walton, Ian M.; Cox, Jordan M.; Benson, Cassidy A.; Patel, Dinesh (Dan) G.; Chen, Yu-Sheng; Benedict, Jason B.","The role of atropisomers on the photo-reactivity and fatigue of diarylethene-based metal‒organic frameworks","New J. Chem.","2016","40","1","101","","10.1039/C5NJ01718A","","x-ray","0.71073","MoKα","","0.1125","0.0645","","","0.1521","0.1789","","","","","","1.014","","","","has coordinates","176129","2020-10-21","18:00:00",""
"7055112","34.001","0.003","34.001","0.003","34.001","0.003","90","","90","","90","","39307","6","100","","100","","","","","","","","","4","F m -3 m","-F 4 2 3","225","UBMOF-2","","","- C12 H3 O3.25 Zn -","- C10.5 H2.25 O3.25 Zn -","- C336 H72 O104 Zn32 -","32","0.166667","","Walton, Ian M.; Cox, Jordan M.; Benson, Cassidy A.; Patel, Dinesh (Dan) G.; Chen, Yu-Sheng; Benedict, Jason B.","The role of atropisomers on the photo-reactivity and fatigue of diarylethene-based metal‒organic frameworks","New J. Chem.","2016","40","1","101","","10.1039/C5NJ01718A","","","0.71073","MoKα","","0.0956","0.0874","","","0.2643","0.2732","","","","","","1.149","","","","has coordinates","176129","2020-10-21","18:00:00",""
"7055113","8.1682","0.0011","10.1121","0.0012","12.2265","0.0015","106.817","0.005","96.61","0.005","94.955","0.005","952.6","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","(2E)-N-(2-methoxyphenyl)-2-(2,3,4,4a-tetrahydro-1H-xanthen-1-ylidene)hydrazinecarbothioamide","","- C21 H21 N3 O2 S -","- C21 H21 N3 O2 S -","- C42 H42 N6 O4 S2 -","2","1","","Hameed, Aminah; Shafiq, Zahid; Yaqub, Muhammad; Hussain, Mazhar; Hussain, Muhammad Ajaz; Afzal, Muhammad; Tahir, Muhammad Nawaz; Naseer, Muhammad Moazzam","Me3N-promoted synthesis of 2,3,4,4a-tetrahydroxanthen-1-one: preparation of thiosemicarbazone derivatives, their solid state self-assembly and antimicrobial properties","New J. Chem.","2015","39","12","9351","","10.1039/C5NJ01879J","","","0.71073","MoKα","","0.123","0.0641","","","0.171","0.2036","","","","","","1.038","","","","has coordinates","171305","2020-10-21","18:00:00",""
"7055114","9.6988","0.001","9.8693","0.0009","10.7502","0.0012","101.697","0.006","101.627","0.006","101.57","0.006","955.19","0.18","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","(2E)-N-(2,4-dichlorophenyl)-2-(2,3,4,4a-tetrahydro-1H-xanthen-1-ylidene)hydrazinecarbothioamide","","- C20 H17 Cl2 N3 O S -","- C20 H17 Cl2 N3 O S -","- C40 H34 Cl4 N6 O2 S2 -","2","1","","Hameed, Aminah; Shafiq, Zahid; Yaqub, Muhammad; Hussain, Mazhar; Hussain, Muhammad Ajaz; Afzal, Muhammad; Tahir, Muhammad Nawaz; Naseer, Muhammad Moazzam","Me3N-promoted synthesis of 2,3,4,4a-tetrahydroxanthen-1-one: preparation of thiosemicarbazone derivatives, their solid state self-assembly and antimicrobial properties","New J. Chem.","2015","39","12","9351","","10.1039/C5NJ01879J","","","0.71073","MoKα","","0.0806","0.0606","","","0.1567","0.1708","","","","","","1.081","","","","has coordinates,has disorder","171305","2020-10-21","18:00:00",""
"7055115","25.8681","0.0018","19.8556","0.0018","16.277","0.0013","90","","101.368","0.002","90","","8196.3","1.1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C70 H108 Cl6 Cu N14 O9 -","- C70 H108 Cl6 Cu N14 O9 -","- C280 H432 Cl24 Cu4 N56 O36 -","4","0.5","","Li, Jie; Xi, Teng; Yan, Biao; Guan, Yulei; Yang, Mingyan; Song, Jirong; Ma, Haixia","Synergistic actions between tebuconazole ligand and Cu(ii) cation: reasons for the enhanced antifungal activity of four Cu(ii) complexes based on the fungicide tebuconazole","New J. Chem.","2015","39","12","9550","","10.1039/C5NJ01845E","","","0.71073","MoKα","","0.1428","0.0717","","","0.1472","0.1822","","","","","","1.242","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055116","8.643","0.003","21.583","0.008","11.46","0.004","90","","107.229","0.007","90","","2041.8","1.3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H50 Cl2 Cu N6 O6 -","- C36 H50 Cl2 Cu N6 O6 -","- C72 H100 Cl4 Cu2 N12 O12 -","2","0.5","","Li, Jie; Xi, Teng; Yan, Biao; Guan, Yulei; Yang, Mingyan; Song, Jirong; Ma, Haixia","Synergistic actions between tebuconazole ligand and Cu(ii) cation: reasons for the enhanced antifungal activity of four Cu(ii) complexes based on the fungicide tebuconazole","New J. Chem.","2015","39","12","9550","","10.1039/C5NJ01845E","","","0.71073","MoKα","","0.1162","0.0635","","","0.1545","0.1962","","","","","","0.965","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055117","30.652","0.005","8.83","0.0015","30.761","0.005","90","","108.628","0.003","90","","7890","2","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H51 Cl2 Cu N7 O7 S -","- C35 H51 Cl2 Cu N7 O7 S -","- C280 H408 Cl16 Cu8 N56 O56 S8 -","8","1","","Li, Jie; Xi, Teng; Yan, Biao; Guan, Yulei; Yang, Mingyan; Song, Jirong; Ma, Haixia","Synergistic actions between tebuconazole ligand and Cu(ii) cation: reasons for the enhanced antifungal activity of four Cu(ii) complexes based on the fungicide tebuconazole","New J. Chem.","2015","39","12","9550","","10.1039/C5NJ01845E","","","0.71073","MoKα","","0.1212","0.0612","","","0.1536","0.2001","","","","","","0.975","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055118","9.713","0.002","13.623","0.003","15.213","0.003","65.309","0.002","84.32","0.002","79.878","0.002","1799.7","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H88 Cl6 Cu N12 O12 -","- C64 H88 Cl6 Cu N12 O12 -","- C64 H88 Cl6 Cu N12 O12 -","1","0.5","","Li, Jie; Xi, Teng; Yan, Biao; Guan, Yulei; Yang, Mingyan; Song, Jirong; Ma, Haixia","Synergistic actions between tebuconazole ligand and Cu(ii) cation: reasons for the enhanced antifungal activity of four Cu(ii) complexes based on the fungicide tebuconazole","New J. Chem.","2015","39","12","9550","","10.1039/C5NJ01845E","","","0.71073","MoKα","","0.07","0.0527","","","0.1462","0.1614","","","","","","1.075","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055119","14.574","0.0007","23.5585","0.0011","15.4557","0.0007","90","","110.801","0.003","90","","4960.7","0.4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Zn2(L)(oba)2?2DMF?2H2O","","- C52 H48 N6 O16 Zn2 -","- C49 H37 N5 O13 Zn2 -","- C196 H148 N20 O52 Zn8 -","4","1","","Lin, Rong-Guang; Cao, Gao-Juan; Lin, Jian-Di; Wang, Yu-Lin","A novel 3-fold interpenetration metal‒organic framework with tunable luminescence and selective adsorption of CO2properties","New J. Chem.","2015","39","12","9075","","10.1039/C5NJ01639H","","","0.71073","MoKα","","0.0687","0.0474","","","0.1164","0.1262","","","","","","1.051","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055120","10.998","0.002","6.197","0.0012","21.583","0.004","90","","103.25","0.03","90","","1431.8","0.5","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 Br O3 -","- C16 H15 Br O3 -","- C64 H60 Br4 O12 -","4","1","","Eyong, Kenneth O.; Chinthapally, Kiran; Senthilkumar, Soundararasu; Lamshöft, Marc; Folefoc, Gabriel N.; Baskaran, Sundarababu","Conversion of lapachol to lomatiol: synthesis of novel naphthoquinone derivatives","New J. Chem.","2015","39","12","9611","","10.1039/C5NJ01484K","","","0.71073","MoKα","","0.061","0.0323","","","0.0686","0.0771","","","","","","1.005","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055121","10.439","0.003","5.0804","0.0019","11.712","0.004","90","","99.816","0.014","90","","612","0.4","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H12 O4 -","- C15 H12 O4 -","- C30 H24 O8 -","2","1","","Eyong, Kenneth O.; Chinthapally, Kiran; Senthilkumar, Soundararasu; Lamshöft, Marc; Folefoc, Gabriel N.; Baskaran, Sundarababu","Conversion of lapachol to lomatiol: synthesis of novel naphthoquinone derivatives","New J. Chem.","2015","39","12","9611","","10.1039/C5NJ01484K","","","0.71073","MoKα","","0.1322","0.0693","","","0.1622","0.1963","","","","","","1.091","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055122","14.1031","0.0012","10.4382","0.0009","17.8607","0.0013","90","","90","","90","","2629.3","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C15 H14 O5 -","- C15 H14 O5 -","- C120 H112 O40 -","8","1","","Eyong, Kenneth O.; Chinthapally, Kiran; Senthilkumar, Soundararasu; Lamshöft, Marc; Folefoc, Gabriel N.; Baskaran, Sundarababu","Conversion of lapachol to lomatiol: synthesis of novel naphthoquinone derivatives","New J. Chem.","2015","39","12","9611","","10.1039/C5NJ01484K","","","0.71073","MoKα","","0.0651","0.0388","","","0.0925","0.1074","","","","","","1.018","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055123","7.3939","0.0004","19.7414","0.0011","8.5702","0.0004","90","","95.998","0.002","90","","1244.11","0.11","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H14 O5 -","- C15 H14 O5 -","- C60 H56 O20 -","4","1","","Eyong, Kenneth O.; Chinthapally, Kiran; Senthilkumar, Soundararasu; Lamshöft, Marc; Folefoc, Gabriel N.; Baskaran, Sundarababu","Conversion of lapachol to lomatiol: synthesis of novel naphthoquinone derivatives","New J. Chem.","2015","39","12","9611","","10.1039/C5NJ01484K","","","0.71073","MoKα","","0.0549","0.0424","","","0.1257","0.1364","","","","","","1.077","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055124","16.5569","0.0008","7.4472","0.0004","12.9479","0.0007","90","","99.196","0.002","90","","1575.99","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 N2 O4 -","- C18 H14 N2 O5 -","- C72 H56 N8 O20 -","4","1","","Mukherjee, Prasun; Paul, Sanjay; Das, Asish R.","Expeditious synthesis of functionalized tricyclic 4-spiro pyrano[2,3-c]pyrazoles in aqueous medium using dodecylbenzenesulphonic acid as a Brønsted acid‒surfactant-combined catalyst","New J. Chem.","2015","39","12","9480","","10.1039/C5NJ01728A","","","0.71073","MoKα","","0.0522","0.0409","","","0.1083","0.1161","","","","","","1.048","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055125","11.332","0.002","9.1756","0.0016","17.706","0.003","90","","104.54","0.006","90","","1782.1","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 N2 O5 -","- C21 H18 N2 O4 -","- C84 H72 N8 O16 -","4","1","","Mukherjee, Prasun; Paul, Sanjay; Das, Asish R.","Expeditious synthesis of functionalized tricyclic 4-spiro pyrano[2,3-c]pyrazoles in aqueous medium using dodecylbenzenesulphonic acid as a Brønsted acid‒surfactant-combined catalyst","New J. Chem.","2015","39","12","9480","","10.1039/C5NJ01728A","","","0.71073","MoKα","","0.0552","0.0419","","","0.1104","0.1206","","","","","","1.039","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055126","8.6306","0.0009","10.7523","0.0012","11.2579","0.0013","98.521","0.005","97.359","0.005","107.517","0.004","968.62","0.19","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H19 N3 O3 -","- C24 H19 N3 O3 -","- C48 H38 N6 O6 -","2","1","","Mukherjee, Prasun; Paul, Sanjay; Das, Asish R.","Expeditious synthesis of functionalized tricyclic 4-spiro pyrano[2,3-c]pyrazoles in aqueous medium using dodecylbenzenesulphonic acid as a Brønsted acid‒surfactant-combined catalyst","New J. Chem.","2015","39","12","9480","","10.1039/C5NJ01728A","","","0.71073","MoKα","","0.1346","0.1194","","","0.4014","0.4097","","","","","","1.048","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055127","7.817","0.0008","9.4031","0.001","16.4402","0.0017","73.821","0.003","81.557","0.003","69.541","0.003","1085.7","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H24 N2 O4 -","- C26 H24 N2 O4 -","- C52 H48 N4 O8 -","2","1","","Mukherjee, Prasun; Paul, Sanjay; Das, Asish R.","Expeditious synthesis of functionalized tricyclic 4-spiro pyrano[2,3-c]pyrazoles in aqueous medium using dodecylbenzenesulphonic acid as a Brønsted acid‒surfactant-combined catalyst","New J. Chem.","2015","39","12","9480","","10.1039/C5NJ01728A","","","0.71073","MoKα","","0.0616","0.0432","","","0.0974","0.1066","","","","","","1.046","","","","has coordinates","171303","2020-10-21","18:00:00",""
"7055128","19.852","0.002","6.7979","0.0006","19.7407","0.0017","90","","100.635","0.004","90","","2618.3","0.4","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H38 N2 S4 Sn -","- C20 H38 N2 S4 Sn -","- C80 H152 N8 S16 Sn4 -","4","0.5","","Khan, Malik Dilshad; Akhtar, Javeed; Malik, Mohammad Azad; Akhtar, Masood; Revaprasadu, Neerish","Phase-pure fabrication and shape evolution studies of SnS nanosheets","New J. Chem.","2015","39","12","9569","","10.1039/C5NJ01919B","","","1.54178","CuKα","","0.0252","0.0236","","","0.0581","0.0591","","","","","","1.091","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055129","7.9316","0.0011","8.4597","0.0012","14.947","0.002","90.946","0.002","101.791","0.002","109.574","0.001","921.1","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H6 Fe2 O7 S2 -","- C17 H6 Fe2 O7 S2 -","- C34 H12 Fe4 O14 S4 -","2","1","","Qian, Guifen; Zhong, Wei; Wei, Zhenhong; Wang, Hailong; Xiao, Zhiyin; Long, Li; Liu, Xiaoming","Diiron hexacarbonyl complexes bearing naphthalene-1,8-dithiolate bridge moiety as mimics of the sub-unit of [FeFe]-hydrogenase: synthesis, characterisation and electrochemical investigations","New J. Chem.","2015","39","12","9752","","10.1039/C5NJ02074C","","","0.71073","MoKα","","0.0391","0.0342","","","0.1027","0.1059","","","","","","1.037","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055130","7.71","0.003","11.306","0.004","15.523","0.005","110.397","0.004","91.963","0.004","107.447","0.004","1195.3","0.7","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H13 Br Cl0 Fe2 O8 S2 -","- C21 H13 Br Fe2 O8 S2 -","- C42 H26 Br2 Fe4 O16 S4 -","2","1","","Qian, Guifen; Zhong, Wei; Wei, Zhenhong; Wang, Hailong; Xiao, Zhiyin; Long, Li; Liu, Xiaoming","Diiron hexacarbonyl complexes bearing naphthalene-1,8-dithiolate bridge moiety as mimics of the sub-unit of [FeFe]-hydrogenase: synthesis, characterisation and electrochemical investigations","New J. Chem.","2015","39","12","9752","","10.1039/C5NJ02074C","","","0.71073","MoKα","","0.0667","0.0485","","","0.1318","0.1402","","","","","","1.037","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055131","8.0499","0.001","8.5617","0.0011","14.8223","0.0018","91.11","0.002","102.731","0.001","109.146","0.001","936.7","0.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H8 Fe2 O7 S2 -","- C17 H8 Fe2 O7 S2 -","- C34 H16 Fe4 O14 S4 -","2","1","","Qian, Guifen; Zhong, Wei; Wei, Zhenhong; Wang, Hailong; Xiao, Zhiyin; Long, Li; Liu, Xiaoming","Diiron hexacarbonyl complexes bearing naphthalene-1,8-dithiolate bridge moiety as mimics of the sub-unit of [FeFe]-hydrogenase: synthesis, characterisation and electrochemical investigations","New J. Chem.","2015","39","12","9752","","10.1039/C5NJ02074C","","","0.71073","MoKα","","0.0407","0.0308","","","0.0859","0.0909","","","","","","1.026","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055132","7.9363","0.0012","34.734","0.005","17.444","0.003","90","","94.006","0.002","90","","4796.9","1.3","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C21 H13 Cl Fe2 O8 S2 -","- C21 H13 Cl Fe2 O8 S2 -","- C168 H104 Cl8 Fe16 O64 S16 -","8","4","","Qian, Guifen; Zhong, Wei; Wei, Zhenhong; Wang, Hailong; Xiao, Zhiyin; Long, Li; Liu, Xiaoming","Diiron hexacarbonyl complexes bearing naphthalene-1,8-dithiolate bridge moiety as mimics of the sub-unit of [FeFe]-hydrogenase: synthesis, characterisation and electrochemical investigations","New J. Chem.","2015","39","12","9752","","10.1039/C5NJ02074C","","","0.71073","MoKα","","0.0427","0.036","","","0.0882","0.0911","","","","","","1.045","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055133","7.653","0.008","14.654","0.015","14.902","0.015","68.932","0.011","78.682","0.011","84.567","0.012","1529","3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H18 Cl2 Fe3 O8 S2 -","- C29 H18 Cl2 Fe3 O8 S2 -","- C58 H36 Cl4 Fe6 O16 S4 -","2","1","","Qian, Guifen; Zhong, Wei; Wei, Zhenhong; Wang, Hailong; Xiao, Zhiyin; Long, Li; Liu, Xiaoming","Diiron hexacarbonyl complexes bearing naphthalene-1,8-dithiolate bridge moiety as mimics of the sub-unit of [FeFe]-hydrogenase: synthesis, characterisation and electrochemical investigations","New J. Chem.","2015","39","12","9752","","10.1039/C5NJ02074C","","","0.71073","MoKα","","0.044","0.0373","","","0.0976","0.1029","","","","","","1.022","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055134","7.556","0.005","9.504","0.007","14.246","0.01","86.686","0.008","79.551","0.008","66.911","0.008","925.4","1.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H6 Fe2 O7 S2 -","- C17 H6 Fe2 O7 S2 -","- C34 H12 Fe4 O14 S4 -","2","1","","Qian, Guifen; Zhong, Wei; Wei, Zhenhong; Wang, Hailong; Xiao, Zhiyin; Long, Li; Liu, Xiaoming","Diiron hexacarbonyl complexes bearing naphthalene-1,8-dithiolate bridge moiety as mimics of the sub-unit of [FeFe]-hydrogenase: synthesis, characterisation and electrochemical investigations","New J. Chem.","2015","39","12","9752","","10.1039/C5NJ02074C","","","0.71073","MoKα","","0.0335","0.0263","","","0.0693","0.0725","","","","","","1.002","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055135","10.3845","0.0009","10.3845","0.0009","6.4739","0.0008","90","","90","","120","","604.6","0.11","298","2","298","2","","","","","","","","5","P -3 m 1","-P 3 2""","164","","","","- B3 Li O9 Sr Tb2 -","- B3 Li O9 Sr Tb2 -","- B9 Li3 O27 Sr3 Tb6 -","3","0.25","","Chen, Pengyun; Xia, Mingjun; Li, R. K.","A terbium rich orthoborate LiSrTb2(BO3)3and its analogues","New J. Chem.","2015","39","12","9389","","10.1039/C5NJ01913C","","","0.71073","MoKα","","0.0378","0.0311","","","0.0704","0.0732","","","","","","1.147","","","","has coordinates","171295","2020-10-21","18:00:00",""
"7055136","8.3278","0.0004","17.6372","0.0008","12.0862","0.0005","90","","93.553","0.003","90","","1771.8","0.14","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 P -","- C23 H21 P -","- C92 H84 P4 -","4","1","","Purdavaie, Kourosh; Baird, Michael C.; Budzelaar, Peter H. M.","Synthesis and structure of a new phosphonium-1-indenylide (PHIN) ligand, 4,7-dimethyl-1-C9H4PMePh2, and of new PHIN complexes of rhodium and iridium","New J. Chem.","2015","39","12","9429","","10.1039/C5NJ01756D","","","0.71073","MoKα","","0.0614","0.0429","","","0.0973","0.1077","","","","","","1.041","","","","has coordinates","171308","2020-10-21","18:00:00",""
"7055137","16.6549","0.0002","11.2323","0.0001","20.2304","0.0002","90","","96.4639","0.0004","90","","3760.5","0.07","180","2","180","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H23 P -","- C24 H23 P -","- C192 H184 P8 -","8","1","","Purdavaie, Kourosh; Baird, Michael C.; Budzelaar, Peter H. M.","Synthesis and structure of a new phosphonium-1-indenylide (PHIN) ligand, 4,7-dimethyl-1-C9H4PMePh2, and of new PHIN complexes of rhodium and iridium","New J. Chem.","2015","39","12","9429","","10.1039/C5NJ01756D","","","0.71073","MoKα","","0.0371","0.0341","","","0.0934","0.0968","","","","","","1.024","","","","has coordinates","171308","2020-10-21","18:00:00",""
"7055138","9.7473","0.0009","17.3697","0.0015","18.2266","0.0018","90","","90","","90","","3085.9","0.5","293","2","293","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C26 H22 Co N10 Na O6 S4 -","- C26 H22 Co N10 Na O6 S4 -","- C104 H88 Co4 N40 Na4 O24 S16 -","4","0.5","","Bansal, Deepak; Pandey, Saurabh; Hundal, Geeta; Gupta, Rajeev","Heterometallic coordination polymers: syntheses, structures and heterogeneous catalytic applications","New J. Chem.","2015","39","12","9772","","10.1039/C5NJ01223F","","","0.71073","MoKα","","0.1101","0.0657","","","0.1129","0.1274","","","","","","1.082","","","","has coordinates,has disorder","171302","2020-10-21","18:00:00",""
"7055139","9.488","0.006","12.563","0.008","16.137","0.009","70.636","0.003","86.729","0.003","89.399","0.002","1811.7","1.9","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C27 H26 Cd Cl Co N10 O9 S4 -","- C27 H26 Cd Cl Co N10 O9 S4 -","- C54 H52 Cd2 Cl2 Co2 N20 O18 S8 -","2","1","","Bansal, Deepak; Pandey, Saurabh; Hundal, Geeta; Gupta, Rajeev","Heterometallic coordination polymers: syntheses, structures and heterogeneous catalytic applications","New J. Chem.","2015","39","12","9772","","10.1039/C5NJ01223F","","","0.71069","MoKα","","0.0499","0.0426","","","0.116","0.1201","","","","","","1.09","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055140","43.8659","0.0011","43.8659","0.0011","9.541","0.0003","90","","90","","120","","15899.3","0.8","293","2","293","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C26 H22 Cl Co Hg N10 O4 S4 -","- C26 H22.315 Cl Co Hg N10 O4 S4 -","- C468 H401.67 Cl18 Co18 Hg18 N180 O72 S72 -","18","1","","Bansal, Deepak; Pandey, Saurabh; Hundal, Geeta; Gupta, Rajeev","Heterometallic coordination polymers: syntheses, structures and heterogeneous catalytic applications","New J. Chem.","2015","39","12","9772","","10.1039/C5NJ01223F","","","0.71073","MoKα","","0.0917","0.0513","","","0.1304","0.1401","","","","","","0.91","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055141","16.106","0.005","29.674","0.003","16.658","0.004","90","","90.38","0.005","90","","7961","3","295","2","295","2","","","","","","","","8","I 1 2/a 1","-I 2ya","15","","","","- C26 H22 Cl Co N10 O10 S4 Zn -","- C26 H22 Cl Co N10 O10 S4 Zn -","- C208 H176 Cl8 Co8 N80 O80 S32 Zn8 -","8","1","","Bansal, Deepak; Pandey, Saurabh; Hundal, Geeta; Gupta, Rajeev","Heterometallic coordination polymers: syntheses, structures and heterogeneous catalytic applications","New J. Chem.","2015","39","12","9772","","10.1039/C5NJ01223F","","","0.71073","MoKα","","0.109","0.0716","","","0.1787","0.2021","","","","","","1.013","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"7055142","7.8871","0.0011","11.287","0.0016","15.565","0.002","72.418","0.002","88.268","0.002","80.936","0.002","1304.2","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H32 Cl2 Co N7 O3 -","- C24 H32 Cl2 Co N7 O3 -","- C48 H64 Cl4 Co2 N14 O6 -","2","1","","Adolph, Michael; Zevaco, Thomas A.; Altesleben, Christiane; Staudt, Simone; Walter, Olaf; Dinjus, Eckhard","New ionic cobalt(iii) complexes based on the N,N-bis(2-pyrazinecarboxamide)-1,2-benzene ligand: application to the formation of organic carbonates from epoxides and CO2","New J. Chem.","2015","39","12","9858","","10.1039/C5NJ02135A","","","0.71073","MoKα","","0.0402","0.0293","","","0.0645","0.0692","","","","","","1.031","","","","has coordinates","171299","2020-10-21","18:00:00",""
"7055143","8.0125","0.0004","11.3","0.0006","15.6292","0.0008","73.057","0.001","88.933","0.001","81.351","0.001","1337.8","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H32 Br2 Co N7 O3 -","- C24 H32 Br2 Co N7 O3 -","- C48 H64 Br4 Co2 N14 O6 -","2","1","","Adolph, Michael; Zevaco, Thomas A.; Altesleben, Christiane; Staudt, Simone; Walter, Olaf; Dinjus, Eckhard","New ionic cobalt(iii) complexes based on the N,N-bis(2-pyrazinecarboxamide)-1,2-benzene ligand: application to the formation of organic carbonates from epoxides and CO2","New J. Chem.","2015","39","12","9858","","10.1039/C5NJ02135A","","","0.71073","MoKα","","0.0339","0.0255","","","0.0579","0.0611","","","","","","1.025","","","","has coordinates","171299","2020-10-21","18:00:00",""
"7055144","7.8969","0.0002","9.4631","0.0003","9.992","0.0003","74.851","0.003","89.546","0.003","84.803","0.0019","717.69","0.04","150","1","150","1","","","","","","","","4","P -1","-P 1","2","","","","- C16 H14 Mo O4 -","- C16 H14 Mo O4 -","- C32 H28 Mo2 O8 -","2","1","","Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan","Novel indenyl ligands bearing electron-withdrawing functional groups","New J. Chem.","2016","40","1","245","","10.1039/C5NJ02406D","","","0.71073","MoKα","","0.0216","0.0202","","","0.0523","0.0534","","","","","","1.107","","","","has coordinates,has disorder","176134","2020-10-21","18:00:00",""
"7055145","7.721","0.0006","15.632","0.0012","23.2461","0.0018","90","","90","","90","","2805.7","0.4","150","1","150","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H14 Mo O3 -","- C16 H14 Mo O3 -","- C128 H112 Mo8 O24 -","8","1","","Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan","Novel indenyl ligands bearing electron-withdrawing functional groups","New J. Chem.","2016","40","1","245","","10.1039/C5NJ02406D","","","0.71073","MoKα","","0.0469","0.0292","","","0.0597","0.0685","","","","","","1.083","","","","has coordinates","176134","2020-10-21","18:00:00",""
"7055146","10.229","0.0003","8.629","0.0007","21.3501","0.0013","90","","110.029","0.004","90","","1770.51","0.19","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Mo O4 -","- C22 H16 Mo O4 -","- C88 H64 Mo4 O16 -","4","1","","Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan","Novel indenyl ligands bearing electron-withdrawing functional groups","New J. Chem.","2016","40","1","245","","10.1039/C5NJ02406D","","","0.71073","MoKα","","0.034","0.0244","","","0.0522","0.0577","","","","","","1.087","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055147","15.7229","0.0006","10.526","0.0004","10.5021","0.0007","90","","96.03","0.007","90","","1728.47","0.15","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 Mo N O3 -","- C19 H21 Mo N O3 -","- C76 H84 Mo4 N4 O12 -","4","1","","Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan","Novel indenyl ligands bearing electron-withdrawing functional groups","New J. Chem.","2016","40","1","245","","10.1039/C5NJ02406D","","","0.71073","MoKα","","0.0351","0.027","","","0.0637","0.0691","","","","","","1.105","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055148","15.0282","0.0004","7.542","0.0002","14.8454","0.0005","90","","91.901","0.002","90","","1681.69","0.08","150","1","150","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C11 H10 O -","- C11 H10 O -","- C88 H80 O8 -","8","1","","Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan","Novel indenyl ligands bearing electron-withdrawing functional groups","New J. Chem.","2016","40","1","245","","10.1039/C5NJ02406D","","","0.71073","MoKα","","0.0708","0.0462","","","0.1032","0.12","","","","","","1.125","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055149","7.002","0.0006","8.928","0.0006","17.3821","0.0007","75.562","0.005","85.442","0.006","74.224","0.006","1012.59","0.12","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C22 H20 Cl Mo N O4 -","- C22 H20 Cl Mo N O4 -","- C44 H40 Cl2 Mo2 N2 O8 -","2","1","","Honzíčková, Iva; Vinklárek, Jaromír; Romão, Carlos C.; Růžičková, Zdeňka; Honzíček, Jan","Novel indenyl ligands bearing electron-withdrawing functional groups","New J. Chem.","2016","40","1","245","","10.1039/C5NJ02406D","","","0.71073","MoKα","","0.0401","0.0303","","","0.0635","0.068","","","","","","1.073","","","","has coordinates","176134","2020-10-21","18:00:00",""
"7055150","13.471","0.003","14.06","0.003","18.498","0.004","106.035","0.003","103.8","0.003","92.507","0.003","3247.4","1.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C126 H108 B2 Fe2 Mn2 N26 O2 -","- C124.428 H101.284 B2 Fe2 Mn2 N26 O2 -","- C124.428 H101.284 B2 Fe2 Mn2 N26 O2 -","1","0.5","","Gao, Feng; Zhu, Guang-Zhou; Yang, Liu; Yao, Min-Xia","Cyanide-bridged heterobimetallic magnetic complexes based on metalloporphyrinate and tricyanometalate building blocks","New J. Chem.","2016","40","1","365","","10.1039/C5NJ02132D","","","0.71073","MoKα","","0.0727","0.0575","","","0.1879","0.2004","","","","","","1.104","","","","has coordinates,has disorder","176126","2020-10-21","18:00:00",""
"7055151","19.758","0.003","12.4162","0.0017","22.828","0.003","90","","105.308","0.002","90","","5401.5","1.3","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C114 H82.55 B2 Cr2 Mn2 N26 O2.28 -","- C113.726 H81.1768 B2 Cr2 Mn2 N26 O2.2744 -","- C227.451 H162.354 B4 Cr4 Mn4 N52 O4.5488 -","2","0.5","","Gao, Feng; Zhu, Guang-Zhou; Yang, Liu; Yao, Min-Xia","Cyanide-bridged heterobimetallic magnetic complexes based on metalloporphyrinate and tricyanometalate building blocks","New J. Chem.","2016","40","1","365","","10.1039/C5NJ02132D","","","0.71073","MoKα","","0.0762","0.0623","","","0.1737","0.1843","","","","","","1.066","","","","has coordinates,has disorder","176126","2020-10-21","18:00:00",""
"7055152","20.928","0.007","14.437","0.004","20.777","0.006","90","","105.019","0.003","90","","6063","3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H46 B Fe Mn N17 -","- C58 H46 B Fe Mn N17 -","- C232 H184 B4 Fe4 Mn4 N68 -","4","1","","Gao, Feng; Zhu, Guang-Zhou; Yang, Liu; Yao, Min-Xia","Cyanide-bridged heterobimetallic magnetic complexes based on metalloporphyrinate and tricyanometalate building blocks","New J. Chem.","2016","40","1","365","","10.1039/C5NJ02132D","","","0.71073","MoKα","","0.1345","0.1146","","","0.2569","0.2674","","","","","","1.021","","","","has coordinates","176126","2020-10-21","18:00:00",""
"7055153","6.9244","0.0012","7.3583","0.0012","9.5353","0.0016","105.537","0.003","102.545","0.003","110.219","0.003","412.65","0.12","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H22 Co N8 O10 -","- C8 H20 Co N8 O10 -","- C8 H20 Co N8 O10 -","1","0.5","","Selvakumar, Rajendran; Geib, Steven J.; Premkumar, Thathan; Vairam, Sundararajan; Govindarajan, Subbiah","Isomorphic metal malonates with N-aminoguanidine: MCo2O4(M = Ni & Zn) nanoparticle synthesis via a (AmgH)2[M1/3Co2/3(mal)2(H2O)2] precursor solid solution","New J. Chem.","2016","40","1","257","","10.1039/C5NJ01134E","","","0.71073","MoKα","","0.0333","0.0304","","","0.0891","0.0925","","","","","","0.885","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055154","6.881","0.004","7.283","0.004","9.541","0.005","105.601","0.01","102.526","0.01","109.834","0.01","407.4","0.4","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H22 N8 Ni O10 -","- C8 H22 N8 Ni O10 -","- C8 H22 N8 Ni O10 -","1","0.5","","Selvakumar, Rajendran; Geib, Steven J.; Premkumar, Thathan; Vairam, Sundararajan; Govindarajan, Subbiah","Isomorphic metal malonates with N-aminoguanidine: MCo2O4(M = Ni & Zn) nanoparticle synthesis via a (AmgH)2[M1/3Co2/3(mal)2(H2O)2] precursor solid solution","New J. Chem.","2016","40","1","257","","10.1039/C5NJ01134E","","","0.71073","MoKα","","0.0949","0.0667","","","0.1499","0.1637","","","","","","1.088","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055155","6.9096","0.001","7.3355","0.001","9.5299","0.0013","105.577","0.002","102.494","0.002","110.156","0.002","410.52","0.1","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H22 Co0.5 N8 Ni0.5 O10 -","- C8 H22 Co0.5 N8 Ni0.5 O10 -","- C8 H22 Co0.5 N8 Ni0.5 O10 -","1","0.5","","Selvakumar, Rajendran; Geib, Steven J.; Premkumar, Thathan; Vairam, Sundararajan; Govindarajan, Subbiah","Isomorphic metal malonates with N-aminoguanidine: MCo2O4(M = Ni & Zn) nanoparticle synthesis via a (AmgH)2[M1/3Co2/3(mal)2(H2O)2] precursor solid solution","New J. Chem.","2016","40","1","257","","10.1039/C5NJ01134E","","","0.71073","MoKα","","0.0318","0.0304","","","0.0888","0.0914","","","","","","0.944","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7055156","12.9196","0.0003","13.3903","0.0003","25.3747","0.0004","90","","95.496","0.001","90","","4369.57","0.16","123","2","123","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C47 H53 Cl N4 O P2 Pd -","- C47 H53 Cl N4 O P2 Pd -","- C188 H212 Cl4 N16 O4 P8 Pd4 -","4","1","","Kinzhalov, Mikhail A.; Novikov, Alexander S.; Luzyanin, Konstantin V.; Haukka, Matti; Pombeiro, Armando J. L.; Kukushkin, Vadim Yu.","PdII-mediated integration of isocyanides and azide ions might proceed via formal 1,3-dipolar cycloaddition between RNC ligands and uncomplexed azide","New J. Chem.","2016","40","1","521","","10.1039/C5NJ02564H","","","0.71073","MoKα","","0.0549","0.0411","","","0.086","0.093","","","","","","1.06","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7055157","23.731","0.005","8.3394","0.0015","13.706","0.002","90","","106.707","0.012","90","","2597.9","0.8","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 F3 N O -","- C15 H12 F3 N O -","- C120 H96 F24 N8 O8 -","8","2","","Panini, Piyush; Chopra, Deepak","Experimental and computational insights into the nature of weak intermolecular interactions in trifluoromethyl-substituted isomeric crystalline N-methyl-N-phenylbenzamides","New J. Chem.","2015","39","11","8720","","10.1039/C5NJ01670C","","","0.71073","MoKα","","0.0522","0.0403","","","0.0854","0.0897","","","","","","1.063","","","","has coordinates","288505","2023-12-22","15:12:03",""
"7055158","19.2231","0.0002","11.34721","0.00013","64.2553","0.0009","90","","92.2457","0.0011","90","","14005.2","0.3","200","","200","","","","101","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C72 H78 O8 S8 -","- C72 H78 O8 S8 -","- C576 H624 O64 S64 -","8","1","","Botha, F.; Eigner, V.; Dvořáková, H.; Lhoták, P.","Arylation of thiacalix[4]arenes using organomercurial intermediates","New J. Chem.","2016","40","2","1104","","10.1039/C5NJ02427G","","","1.54184","CuKα","","0.0618","0.0539","","0.133","0.1201","0.1326","","","","","","0.9927","","","","has coordinates,has disorder","177898","2020-10-21","18:00:00",""
"7055159","19.8323","0.0003","10.8754","0.0002","37.256","0.0007","90","","101.47","0.0017","90","","7875","0.2","120","","120","","","","101","","","","","5","I 1 2/c 1","-I 2yc","15","","","","- C42 H43 N O6 S4 -","- C42 H43 N O6 S4 -","- C336 H344 N8 O48 S32 -","8","1","","Botha, F.; Eigner, V.; Dvořáková, H.; Lhoták, P.","Arylation of thiacalix[4]arenes using organomercurial intermediates","New J. Chem.","2016","40","2","1104","","10.1039/C5NJ02427G","","","1.54184","CuKα","","0.084","0.077","","0.1058","0.1037","0.1057","","","","","","0.9685","","","","has coordinates,has disorder","177898","2020-10-21","18:00:00",""
"7055160","19.3452","0.0006","9.1412","0.0003","19.3696","0.0007","90","","95.901","0.003","90","","3407.1","0.2","200","","200","","","","101","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C72 H78 O8 S8 -","- C72 H78 O8 S8 -","- C144 H156 O16 S16 -","2","0.5","","Botha, F.; Eigner, V.; Dvořáková, H.; Lhoták, P.","Arylation of thiacalix[4]arenes using organomercurial intermediates","New J. Chem.","2016","40","2","1104","","10.1039/C5NJ02427G","","","1.5418","CuKα","","0.0826","0.0632","","0.1804","0.1478","0.1804","","","","","","0.9939","","","","has coordinates,has disorder","177898","2020-10-21","18:00:00",""
"7055161","19.887","0.0006","10.9789","0.0002","20.3062","0.0006","90","","117.855","0.004","90","","3919.9","0.2","190","","190","","","","101","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C42 H43 N O6 S4 -","- C42 H43 N O6 S4 -","- C168 H172 N4 O24 S16 -","4","1","","Botha, F.; Eigner, V.; Dvořáková, H.; Lhoták, P.","Arylation of thiacalix[4]arenes using organomercurial intermediates","New J. Chem.","2016","40","2","1104","","10.1039/C5NJ02427G","","","1.5418","CuKα","","0.062","0.0533","","0.1315","0.1218","0.1315","","","","","","0.8997","","","","has coordinates,has disorder","177898","2020-10-21","18:00:00",""
"7055162","19.0018","0.0005","46.9211","0.0012","9.3659","0.0003","90","","90","","90","","8350.5","0.4","190","","190","","","","101","","","","","5","P n 21 a","P -2ac -2n","33","","","","- C86 H89 N3 O12 S8 -","- C86 H89 N3 O12 S8 -","- C344 H356 N12 O48 S32 -","4","1","","Botha, F.; Eigner, V.; Dvořáková, H.; Lhoták, P.","Arylation of thiacalix[4]arenes using organomercurial intermediates","New J. Chem.","2016","40","2","1104","","10.1039/C5NJ02427G","","","1.54184","CuKα","","0.0628","0.0526","","0.1386","0.123","0.1384","","","","","","0.9025","","","","has coordinates,has disorder","177898","2020-10-21","18:00:00",""
"7055163","9.562","0.005","19.281","0.005","23.109","0.005","79.293","0.005","83.66","0.005","77.619","0.005","4078","3","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C37 H51 Cl2 Mo N5 O S2 Se -","- C37 H51 Cl2 Mo N5 O S2 Se -","- C148 H204 Cl8 Mo4 N20 O4 S8 Se4 -","4","2","","Mitra, Joyee; Sarkar, Sabyasachi","Photoinduced electron transfer from the oxo‒MoIVselenolato complex to oxygen","New J. Chem.","2016","40","1","626","","10.1039/C5NJ02494C","","","0.71069","MoKα","","0.1092","0.0713","","","0.1935","0.29","","","","","","1.021","","","","has coordinates","176124","2020-10-21","18:00:00",""
"7055164","9.288","0.005","11.771","0.005","19.492","0.005","83.3","0.005","84.385","0.005","83.738","0.005","2096","1.5","100","2","100","2","","","","","","","","8","P -1","-P 1","2","[NBu4][OMo(phen)(SePh)(mnt)].CH2Cl2","","","- C39 H51 Cl2 Mo N5 O S2 Se -","- C39 H51 Cl2 Mo N5 O S2 Se -","- C78 H102 Cl4 Mo2 N10 O2 S4 Se2 -","2","1","","Mitra, Joyee; Sarkar, Sabyasachi","Photoinduced electron transfer from the oxo‒MoIVselenolato complex to oxygen","New J. Chem.","2016","40","1","626","","10.1039/C5NJ02494C","","","0.71069","MoKα","","0.1068","0.0806","","","0.2377","0.3139","","","","","","1.272","","","","has coordinates","176124","2020-10-21","18:00:00",""
"7055165","8.54","0.002","9.813","0.003","11.707","0.003","82.404","0.004","73.547","0.004","68.028","0.004","872.2","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H15 N2 O12 V -","- C14 H15 N2 O12 V -","- C28 H30 N4 O24 V2 -","2","1","","Feng, Xiao Dong; Zhang, Xiao Xi; Wang, Zhi Nan; Song, Jian; Xing, Yong Heng; Bai, Feng Ying","Mimicking vanadium haloperoxidases: vanadium(iii)‒carboxylic acid complexes and their application in H2O2detection","New J. Chem.","2016","40","2","1222","","10.1039/C5NJ01905B","","","0.71073","MoKα","","0.0835","0.0555","","","0.1371","0.1534","","","","","","1.044","","","","has coordinates","177888","2020-10-21","18:00:00",""
"7055166","15.3219","0.0017","17.734","0.002","6.6947","0.0008","90","","90.641","0.002","90","","1819","0.4","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H11 F3 N O9 V -","- C15 H11 F3 N O9 V -","- C60 H44 F12 N4 O36 V4 -","4","1","","Feng, Xiao Dong; Zhang, Xiao Xi; Wang, Zhi Nan; Song, Jian; Xing, Yong Heng; Bai, Feng Ying","Mimicking vanadium haloperoxidases: vanadium(iii)‒carboxylic acid complexes and their application in H2O2detection","New J. Chem.","2016","40","2","1222","","10.1039/C5NJ01905B","","","0.71073","MoKα","","0.0567","0.0387","","","0.0975","0.1066","","","","","","1.037","","","","has coordinates,has disorder","177888","2020-10-21","18:00:00",""
"7055167","10.66","0.0002","10.758","0.0002","13.6855","0.0003","106.201","0.002","95.799","0.002","119.067","0.002","1263.9","0.06","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H24 Ag2 Cl2 N8 O12 -","- C16 H24 Ag2 Cl2 N8 O12 -","- C32 H48 Ag4 Cl4 N16 O24 -","2","1","","Kalinowska-Lis, Urszula; Felczak, Aleksandra; Chęcińska, Lilianna; Małecka, Magdalena; Lisowska, Katarzyna; Ochocki, Justyn","Influence of selected inorganic counter-ions on the structure and antimicrobial properties of silver(i) complexes with imidazole-containing ligands","New J. Chem.","2016","40","1","694","","10.1039/C5NJ02514A","","","0.71073","MoKα","","0.0179","0.0169","","","0.0456","0.0463","","","","","","1.096","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7055168","7.7766","0.0002","15.2479","0.0003","11.6266","0.0002","90","","97.599","0.002","90","","1366.54","0.05","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 Ag2 F6 N8 O8 -","- C20 H24 Ag2 F6 N8 O8 -","- C40 H48 Ag4 F12 N16 O16 -","2","0.5","","Kalinowska-Lis, Urszula; Felczak, Aleksandra; Chęcińska, Lilianna; Małecka, Magdalena; Lisowska, Katarzyna; Ochocki, Justyn","Influence of selected inorganic counter-ions on the structure and antimicrobial properties of silver(i) complexes with imidazole-containing ligands","New J. Chem.","2016","40","1","694","","10.1039/C5NJ02514A","","","0.71073","MoKα","","0.0286","0.0283","","","0.0665","0.0667","","","","","","1.142","","","","has coordinates,has disorder","176132","2020-10-21","18:00:00",""
"7055169","7.9688","0.0003","9.2044","0.0002","9.3306","0.0003","73.719","0.003","76.471","0.003","74.445","0.002","623.48","0.04","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C16 H24 Ag2 B2 F8 N8 O4 -","- C16 H24 Ag2 B2 F8 N8 O4 -","- C16 H24 Ag2 B2 F8 N8 O4 -","1","0.5","","Kalinowska-Lis, Urszula; Felczak, Aleksandra; Chęcińska, Lilianna; Małecka, Magdalena; Lisowska, Katarzyna; Ochocki, Justyn","Influence of selected inorganic counter-ions on the structure and antimicrobial properties of silver(i) complexes with imidazole-containing ligands","New J. Chem.","2016","40","1","694","","10.1039/C5NJ02514A","","","0.71073","MoKα","","0.0217","0.021","","","0.0492","0.0497","","","","","","1.055","","","","has coordinates,has disorder","176132","2020-10-21","18:00:00",""
"7055170","17.7272","0.0003","10.9714","0.0002","10.2468","0.0002","90","","97.6257","0.0019","90","","1975.3","0.06","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Cl N2 O3 P S -","- C19 H16 Cl N2 O3 P S -","- C76 H64 Cl4 N8 O12 P4 S4 -","4","1","","Babashkina, Maria G.; Robeyns, Koen; Filinchuk, Yaroslav; Safin, Damir A.","Detailed studies of the interaction of 3-chloroaniline with O,O′-diphenylphosphorylisothiocyanate","New J. Chem.","2016","40","2","1230","","10.1039/C5NJ02588E","","","0.71073","MoKα","","0.042","0.0387","","","0.0932","0.0951","","","","","","1.039","","","","has coordinates,has disorder","177896","2020-10-21","18:00:00",""
"7055171","15.742","0.004","7.7102","0.0009","7.0694","0.0012","90","","99.36","0.02","90","","846.6","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 Cl N2 S -","- C7 H7 Cl N2 S -","- C28 H28 Cl4 N8 S4 -","4","1","","Babashkina, Maria G.; Robeyns, Koen; Filinchuk, Yaroslav; Safin, Damir A.","Detailed studies of the interaction of 3-chloroaniline with O,O′-diphenylphosphorylisothiocyanate","New J. Chem.","2016","40","2","1230","","10.1039/C5NJ02588E","","","0.71073","MoKα","","0.1194","0.0928","","","0.2066","0.2191","","","","","","1.084","","","","has coordinates","177896","2020-10-21","18:00:00",""
"7055172","6.7856","0.0006","11.797","0.005","15.113","0.004","67.8","0.03","80.388","0.017","74.82","0.02","1077.9","0.6","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H20 Cl N O4 P -","- C21 H20 Cl N O4 P -","- C42 H40 Cl2 N2 O8 P2 -","2","1","","Babashkina, Maria G.; Robeyns, Koen; Filinchuk, Yaroslav; Safin, Damir A.","Detailed studies of the interaction of 3-chloroaniline with O,O′-diphenylphosphorylisothiocyanate","New J. Chem.","2016","40","2","1230","","10.1039/C5NJ02588E","","","0.71073","MoKα","","0.0576","0.0471","","","0.1293","0.1417","","","","","","1.049","","","","has coordinates","177896","2020-10-21","18:00:00",""
"7055173","8.4353","0.0004","14.9782","0.0009","11.5168","0.0008","90","","104.453","0.006","90","","1409.05","0.15","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 Cl N2 S -","- C13 H15 Cl N2 S -","- C52 H60 Cl4 N8 S4 -","4","1","","Babashkina, Maria G.; Robeyns, Koen; Filinchuk, Yaroslav; Safin, Damir A.","Detailed studies of the interaction of 3-chloroaniline with O,O′-diphenylphosphorylisothiocyanate","New J. Chem.","2016","40","2","1230","","10.1039/C5NJ02588E","","","0.71073","MoKα","","0.0783","0.0552","","","0.1681","0.1878","","","","","","1.005","","","","has coordinates","177896","2020-10-21","18:00:00",""
"7055174","17.9949","0.0007","17.9949","0.0007","64.9775","0.0008","90","","90","","120","","18221.9","1","291","2","291","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","compoud 1","","- C27.5 H26.9 Cd N2.5 O10 -","- C26 H20 Cd N2 O8 -","- C468 H360 Cd18 N36 O144 -","18","0.5","","Su, Jian; Yao, Liudi; Zhang, Jun; Yuan, Shizhen; Xie, Fazhi; Ding, Yi; Zhao, Meng; Wang, Shichao; Li, Hao; Zhang, Shengyi; Wu, Jieying; Tian, Yupeng","A novel 2D infinite M3L2cage-based Cd(ii) microporous coordination polymer with a tripodal carboxylic acid ligand and solvent-dependent luminescence properties","New J. Chem.","2016","40","1","97","","10.1039/C5NJ02144H","","","0.71073","MoKα","","0.1388","0.0626","","","0.1909","0.2203","","","","","","1.012","","","","has coordinates,has disorder","176128","2020-10-21","18:00:00",""
"7055175","12.985","0.0003","13.0948","0.0003","16.3926","0.0004","93.7823","0.0019","103.688","0.002","100.746","0.002","2642.92","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C70 H53 N3 O3 -","- C70 H53 N3 O3 -","- C140 H106 N6 O6 -","2","1","","Bekere, Laura; Lokshin, Vladimir; Sigalov, Mark; Gvishi, Raz; Zhao, Peng; Hagan, David J.; Van Stryland, Eric W.; Khodorkovsky, Vladimir","Chromenes involving a two-photon absorbing moiety: photochromism via intramolecular resonance energy transfer","New J. Chem.","2016","40","2","1143","","10.1039/C5NJ02490K","","x-ray","1.54184","CuKα","","0.061","0.053","","","0.1444","0.1534","","","","","","1.051","","","","has coordinates","204135","2020-10-21","18:00:00",""
"7055176","13.2538","0.0006","21.2051","0.0004","25.4117","0.0013","90","","134.348","0.009","90","","5107.2","0.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2,7-di(9H-carbazol-9-yl)-9-methyl-9H-fluoren-9-yl)propyl 8-methyl-2,2-diphenyl-2H-benzo[h]chromene-5-carboxylate","","- C68 H50 N2 O3 -","- C68 H50 N2 O3 -","- C272 H200 N8 O12 -","4","1","","Bekere, Laura; Lokshin, Vladimir; Sigalov, Mark; Gvishi, Raz; Zhao, Peng; Hagan, David J.; Van Stryland, Eric W.; Khodorkovsky, Vladimir","Chromenes involving a two-photon absorbing moiety: photochromism via intramolecular resonance energy transfer","New J. Chem.","2016","40","2","1143","","10.1039/C5NJ02490K","","x-ray","1.54184","CuKα","","0.1141","0.0961","","","0.2824","0.3022","","","","","","1.115","","","","has coordinates","177890","2020-10-21","18:00:00",""
"7055177","8.2321","0.0007","9.8695","0.0008","12.5776","0.001","101.763","0.003","103.543","0.002","100.003","0.003","945.92","0.14","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C26 H28 Cu F6 N12 O12 S4 -","- C26 H28 Cu F6 N12 O12 S4 -","- C26 H28 Cu F6 N12 O12 S4 -","1","0.5","","Silva, Telma F. S.; Rocha, Bruno G. M.; Guedes da Silva, M. Fátima C.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.","V(iv), Fe(ii), Ni(ii) and Cu(ii) complexes bearing 2,2,2-tris(pyrazol-1-yl)ethyl methanesulfonate: application as catalysts for the cyclooctane oxidation","New J. Chem.","2016","40","1","528","","10.1039/C5NJ01865J","","","0.71069","MoKα","","0.1003","0.0679","","","0.1943","0.2237","","","","","","0.935","","","","has coordinates,has disorder","176131","2020-10-21","18:00:00",""
"7055178","12.3279","0.0012","12.8597","0.0009","13.1221","0.0009","104.215","0.006","100.333","0.007","105.122","0.007","1879.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H88 Cl4 N6 O30 Zn -","- C64 H84 Cl4 N6 O30 Zn -","- C64 H84 Cl4 N6 O30 Zn -","1","0.5","","Devi, Manisha; Dhir, Abhimanew; Pradeep, Chullikkattil P.","A sandwich-type zinc complex from a rhodamine dye based ligand: a potential fluorescent chemosensor for acetate in human blood plasma and a molecular logic gate with INHIBIT function","New J. Chem.","2016","40","2","1269","","10.1039/C5NJ02175H","","","0.71073","MoKα","","0.1081","0.0827","","","0.2386","0.2735","","","","","","1.053","","","","has coordinates","177889","2020-10-21","18:00:00",""
"7055179","47.02","0.06","10.77","0.007","23.78","0.03","90","","94.87","0.06","90","","11999","2","296","2","296.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C53 H60 Co2 N4 O22 -","- C53 H40 Co2 N4 O16 -","- C424 H320 Co16 N32 O128 -","8","1","","Li, Zhao; Chen, Xi; Yu, Fan; Su, Min; Zhang, Bi-quan; Li, Bao; Zhang, Tian-le","A porous framework based on tetrakis(4-pyridyloxymethyl)methane fine-tuned by metal ions: synthesis, crystal structures and adsorption properties","New J. Chem.","2016","40","2","1430","","10.1039/C5NJ02002F","","","0.71","MoKα","","0.1661","0.0936","","","0.2455","0.3208","","","","","","0.98","","","","has coordinates","177891","2020-10-21","18:00:00",""
"7055180","18.894","0.004","20.963","0.004","22.381","0.005","90","","114.95","0.03","90","","8037","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C59 H70 N6 O24 Zn2 -","- C53 H40 N4 O14 Zn2 -","- C212 H160 N16 O56 Zn8 -","4","0.5","","Li, Zhao; Chen, Xi; Yu, Fan; Su, Min; Zhang, Bi-quan; Li, Bao; Zhang, Tian-le","A porous framework based on tetrakis(4-pyridyloxymethyl)methane fine-tuned by metal ions: synthesis, crystal structures and adsorption properties","New J. Chem.","2016","40","2","1430","","10.1039/C5NJ02002F","","","1.54178","CuKα","","0.1485","0.1365","","","0.3446","0.3586","","","","","","1.497","","","","has coordinates","177891","2020-10-21","18:00:00",""
"7055181","46.403","","11.125","","24.144","","90","","98.48","","90","","12327.7","","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C53 H64 Cd2 N14 O24 -","- C53 H38 Cd2 N4 O16 -","- C424 H304 Cd16 N32 O128 -","8","1","","Li, Zhao; Chen, Xi; Yu, Fan; Su, Min; Zhang, Bi-quan; Li, Bao; Zhang, Tian-le","A porous framework based on tetrakis(4-pyridyloxymethyl)methane fine-tuned by metal ions: synthesis, crystal structures and adsorption properties","New J. Chem.","2016","40","2","1430","","10.1039/C5NJ02002F","","","0.71","MoKα","","0.1673","0.0712","","","0.1741","0.2178","","","","","","1.005","","","","has coordinates,has disorder","177891","2020-10-21","18:00:00",""
"7055182","10.614","0.009","8.737","0.007","12.75","0.011","90","","112.7","0.02","90","","1090.8","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H36 Mn2 N8 O8 -","- C52 H36 Mn2 N8 O8 -","- C52 H36 Mn2 N8 O8 -","1","0.25","","Banerjee, Kaustuv; Biradha, Kumar","Two-dimensional coordination polymers and metal‒organic gels of symmetrical and unsymmetrical dipyridyl β-diketones: luminescence, dye absorption and mechanical properties","New J. Chem.","2016","40","3","1997","","10.1039/C5NJ02193F","","","0.71073","MoKα","","0.1163","0.0483","","","0.1164","0.1416","","","","","","0.793","","","","has coordinates","181753","2020-10-21","18:00:00",""
"7055183","10.811","0.006","8.73","0.005","12.942","0.007","90","","113.866","0.017","90","","1117","1.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H18 Cd N4 O4 -","- C26 H18 Cd N4 O4 -","- C52 H36 Cd2 N8 O8 -","2","0.5","","Banerjee, Kaustuv; Biradha, Kumar","Two-dimensional coordination polymers and metal‒organic gels of symmetrical and unsymmetrical dipyridyl β-diketones: luminescence, dye absorption and mechanical properties","New J. Chem.","2016","40","3","1997","","10.1039/C5NJ02193F","","","0.71073","MoKα","","0.1399","0.0771","","","0.1689","0.1925","","","","","","0.889","","","","has coordinates","181753","2020-10-21","18:00:00",""
"7055184","9.289","0.002","9.986","0.003","13.136","0.003","90","","109.741","0.007","90","","1146.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 N4 O4 Zn -","- C26 H18 N4 O4 Zn -","- C52 H36 N8 O8 Zn2 -","2","0.5","","Banerjee, Kaustuv; Biradha, Kumar","Two-dimensional coordination polymers and metal‒organic gels of symmetrical and unsymmetrical dipyridyl β-diketones: luminescence, dye absorption and mechanical properties","New J. Chem.","2016","40","3","1997","","10.1039/C5NJ02193F","","","0.71073","MoKα","","0.0447","0.0322","","","0.1019","0.1129","","","","","","0.841","","","","has coordinates","181753","2020-10-21","18:00:00",""
"7055185","9.297","0.003","9.981","0.003","13.148","0.004","90","","109.752","0.008","90","","1148.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 Mn N4 O4 -","- C26 H18 Mn N4 O4 -","- C52 H36 Mn2 N8 O8 -","2","0.5","","Banerjee, Kaustuv; Biradha, Kumar","Two-dimensional coordination polymers and metal‒organic gels of symmetrical and unsymmetrical dipyridyl β-diketones: luminescence, dye absorption and mechanical properties","New J. Chem.","2016","40","3","1997","","10.1039/C5NJ02193F","","","0.71073","MoKα","","0.1576","0.0699","","","0.1653","0.2109","","","","","","1.067","","","","has coordinates","181753","2020-10-21","18:00:00",""
"7055186","8.404","0.002","9.573","0.002","10.905","0.003","91.915","0.006","111.122","0.006","101.924","0.006","795.1","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C14 H10 Ag F3 N2 O5 S -","- C14 H9 Ag F3 N2 O5 S -","- C28 H18 Ag2 F6 N4 O10 S2 -","2","1","","Banerjee, Kaustuv; Biradha, Kumar","Two-dimensional coordination polymers and metal‒organic gels of symmetrical and unsymmetrical dipyridyl β-diketones: luminescence, dye absorption and mechanical properties","New J. Chem.","2016","40","3","1997","","10.1039/C5NJ02193F","","","0.71073","MoKα","","0.0701","0.0604","","","0.142","0.1468","","","","","","0.684","","","","has coordinates","181753","2020-10-21","18:00:00",""
"7055187","24.1919","0.0006","24.1919","0.0006","12.7495","0.0002","90","","90","","120","","6462","0.2","100","2","100","2","","","","","","","","5","R 3 :H","R 3","146","[Cu(anti-23)]","","","- C23 H30 Cu N10 O2 -","- C23 H30 Cu N10 O2 -","- C207 H270 Cu9 N90 O18 -","9","1","","Felten, A.-S.; Petry, N.; Henry, B.; Pellegrini-Moïse, N.; Selmeczi, K.","C-Functionalized chiral dioxocyclam and cyclam derivatives with 1,2,3-triazole units: synthesis, complexation properties and crystal structures of copper(ii) complexes","New J. Chem.","2016","40","2","1507","","10.1039/C5NJ01927C","","","0.71073","MoKα","","0.0335","0.0295","","","0.0742","0.0768","","","","","","1.024","","","","has coordinates","177887","2020-10-21","18:00:00",""
"7055188","12.2504","0.0001","12.2504","0.0001","42.3729","0.0007","90","","90","","90","","6359","0.13","100","2","100.15","","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","[Cu(syn-25)]","","","- C23 H34 Cu N10 O4 -","- C23 H34 Cu N10 O4 -","- C184 H272 Cu8 N80 O32 -","8","1","","Felten, A.-S.; Petry, N.; Henry, B.; Pellegrini-Moïse, N.; Selmeczi, K.","C-Functionalized chiral dioxocyclam and cyclam derivatives with 1,2,3-triazole units: synthesis, complexation properties and crystal structures of copper(ii) complexes","New J. Chem.","2016","40","2","1507","","10.1039/C5NJ01927C","","","1.5418","CuKα","","0.0463","0.0438","","","0.1061","0.1083","","","","","","1.043","","","","has coordinates","177887","2020-10-21","18:00:00",""
"7055189","38.562","0.008","9.0853","0.0019","7.0499","0.0015","90","","92.608","0.011","90","","2467.4","0.9","103","2","103","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H12 F6 N4 S4 -","- C28 H12 F6 N4 S4 -","- C112 H48 F24 N16 S16 -","4","0.5","","Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo","Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives","New J. Chem.","2016","40","2","1403","","10.1039/C5NJ02302E","","","0.71075","MoKα","","0.0974","0.0757","","","0.1391","0.1488","","","","","","1.156","","","","has coordinates","177895","2020-10-21","18:00:00",""
"7055190","5.0599","0.0008","6.4683","0.0013","20.014","0.003","93.915","0.015","97.142","0.013","102.709","0.014","630.93","0.19","299","2","299","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H12 F6 N4 S4 -","- C28 H12 F6 N4 S4 -","- C28 H12 F6 N4 S4 -","1","0.5","","Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo","Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives","New J. Chem.","2016","40","2","1403","","10.1039/C5NJ02302E","","","1.54178","CuKα","","0.0755","0.0626","","","0.1764","0.1872","","","","","","1.066","","","","has coordinates","177895","2020-10-21","18:00:00",""
"7055191","4.859","0.004","22.931","0.018","22.781","0.018","90","","92.026","0.012","90","","2537","4","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H12 F6 N4 S4 -","- C28 H12 F6 N4 S4 -","- C112 H48 F24 N16 S16 -","4","1","","Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo","Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives","New J. Chem.","2016","40","2","1403","","10.1039/C5NJ02302E","","","0.71075","MoKα","","0.0955","0.0684","","","0.1581","0.1942","","","","","","1.123","","","","has coordinates","177895","2020-10-21","18:00:00",""
"7055192","40.73","0.07","9.045","0.015","7.129","0.012","90","","95.19","0.03","90","","2616","8","93","2","93","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H12 F6 N4 O2 S4 -","- C28 H12 F6 N4 O2 S4 -","- C112 H48 F24 N16 O8 S16 -","4","0.5","","Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo","Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives","New J. Chem.","2016","40","2","1403","","10.1039/C5NJ02302E","","","0.71075","MoKα","","0.1696","0.1264","","","0.298","0.3288","","","","","","1.105","","","","has coordinates","177895","2020-10-21","18:00:00",""
"7055193","4.8806","0.0019","6.618","0.003","20.996","0.01","96.69","0.03","94.33","0.04","103.15","0.03","652.2","0.5","299","2","299","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H12 F6 N4 O2 S4 -","- C28 H12 F6 N4 O2 S4 -","- C28 H12 F6 N4 O2 S4 -","1","0.5","","Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo","Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives","New J. Chem.","2016","40","2","1403","","10.1039/C5NJ02302E","","","1.54178","CuKα","","0.12","0.0676","","","0.1937","0.2278","","","","","","1.059","","","","has coordinates","177895","2020-10-21","18:00:00",""
"7055194","10.999","0.002","7.0481","0.0013","33.51","0.006","90","","96.985","0.01","90","","2578.5","0.8","113","2","113","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H12 F6 N4 O2 S4 -","- C28 H12 F6 N4 O2 S4 -","- C112 H48 F24 N16 O8 S16 -","4","1","","Mamada, Masashi; Fujita, Harunori; Kakita, Kazuaki; Shima, Hidetaka; Yoneda, Yasuhiro; Tanaka, Yasuhiro; Tokito, Shizuo","Crystal structure and modeled charge carrier mobility of benzobis(thiadiazole) derivatives","New J. Chem.","2016","40","2","1403","","10.1039/C5NJ02302E","","","0.71075","MoKα","","0.1293","0.0894","","","0.21","0.2442","","","","","","1.08","","","","has coordinates,has disorder","177895","2020-10-21","18:00:00",""
"7055195","17.4889","0.0014","17.3814","0.0011","8.2889","0.0006","90","","99.779","0.008","90","","2483.1","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H21 Cl N2 O4 S -","- C28 H21 Cl N2 O4 S -","- C112 H84 Cl4 N8 O16 S4 -","4","1","","Ali, Yakub; Alam, Mohammad Sarwar; Hamid, Hinna; Husain, Asif; Dhulap, Abhijeet; Hussain, Firasat; Bano, Sameena; Kharbanda, Chetna","Molecular modeling and synthesis of some new 2-imino-4-thiazolidinone derivatives with promising TNF-α inhibitory activity","New J. Chem.","2016","40","1","711","","10.1039/C5NJ00078E","","","0.71073","MoKα","","0.217","0.0949","","","0.1531","0.2046","","","","","","0.988","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7055196","7.7271","0.0007","9.6737","0.0008","10.9425","0.001","69.74","0.003","87.236","0.002","67.112","0.003","703.38","0.11","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H10 N4 O9 Zn -","- C12 H10 N4 O9 Zn -","- C24 H20 N8 O18 Zn2 -","2","1","","Karmakar, Anirban; Paul, Anup; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","pH dependent synthesis of Zn(ii) and Cd(ii) coordination polymers with dicarboxyl-functionalized arylhydrazone of barbituric acid: photoluminescence properties and catalysts for Knoevenagel condensation","New J. Chem.","2016","40","2","1535","","10.1039/C5NJ02411K","","","0.71073","MoKα","","0.0475","0.0381","","","0.0972","0.1013","","","","","","1.09","","","","has coordinates","177885","2020-10-21","18:00:00",""
"7055197","7.8701","0.0005","10.0231","0.0006","10.5151","0.0007","107.894","0.002","91.326","0.003","113.088","0.002","716.27","0.08","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H10 Cd N4 O9 -","- C12 H10 Cd N4 O9 -","- C24 H20 Cd2 N8 O18 -","2","1","","Karmakar, Anirban; Paul, Anup; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","pH dependent synthesis of Zn(ii) and Cd(ii) coordination polymers with dicarboxyl-functionalized arylhydrazone of barbituric acid: photoluminescence properties and catalysts for Knoevenagel condensation","New J. Chem.","2016","40","2","1535","","10.1039/C5NJ02411K","","","0.71073","MoKα","","0.031","0.0302","","","0.0768","0.0775","","","","","","1.132","","","","has coordinates","177885","2020-10-21","18:00:00",""
"7055198","7.5088","0.0005","13.6816","0.0009","18.8063","0.0012","90","","96.493","0.003","90","","1919.6","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H18 N4 O13 Zn -","- C12 H18 N4 O13 Zn -","- C48 H72 N16 O52 Zn4 -","4","1","","Karmakar, Anirban; Paul, Anup; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","pH dependent synthesis of Zn(ii) and Cd(ii) coordination polymers with dicarboxyl-functionalized arylhydrazone of barbituric acid: photoluminescence properties and catalysts for Knoevenagel condensation","New J. Chem.","2016","40","2","1535","","10.1039/C5NJ02411K","","","0.71073","MoKα","","0.0768","0.0444","","","0.1015","0.1156","","","","","","1.048","","","","has coordinates","177885","2020-10-21","18:00:00",""
"7055199","22.127","0.004","15.583","0.004","14.931","0.003","90","","106.34","0.01","90","","4940.3","1.9","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H20 Cd N4 O14 -","- C12 H14 Cd N4 O11 -","- C96 H112 Cd8 N32 O88 -","8","1","","Karmakar, Anirban; Paul, Anup; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.","pH dependent synthesis of Zn(ii) and Cd(ii) coordination polymers with dicarboxyl-functionalized arylhydrazone of barbituric acid: photoluminescence properties and catalysts for Knoevenagel condensation","New J. Chem.","2016","40","2","1535","","10.1039/C5NJ02411K","","","0.71073","MoKα","","0.0898","0.058","","","0.1601","0.1734","","","","","","1.053","","","","has coordinates","177885","2020-10-21","18:00:00",""
"7055200","26.7027","0.0014","3.8296","0.0002","13.3781","0.0007","90","","90","","90","","1368.05","0.12","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C14 H12 N2 O6 -","- C14 H12 N2 O6 -","- C56 H48 N8 O24 -","4","1","","Roy, Manojit; Roy, Subhadip; Singh, Keisham Surjit; Kalita, Janmoni; Singh, S. Sureshkumar","Synthesis, characterization and anti-diabetic assay of diorganotin(iv) azo-carboxylates: crystal structure and topological studies of azo-dicarboxylic acid ligand and its cyclic tetranuclear dimethyltin(iv) complex","New J. Chem.","2016","40","2","1471","","10.1039/C5NJ02637G","","","0.71073","MoKα","","0.0913","0.0406","","","0.0749","0.0948","","","","","","1.01","","","","has coordinates","177886","2020-10-21","18:00:00",""
"7055201","9.5462","0.0003","9.782","0.0003","11.8061","0.0004","88.004","0.002","69.65","0.002","79.051","0.002","1014.26","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H40 N4 O12 Sn4 -","- C36 H40 N4 O12 Sn4 -","- C36 H40 N4 O12 Sn4 -","1","0.5","","Roy, Manojit; Roy, Subhadip; Singh, Keisham Surjit; Kalita, Janmoni; Singh, S. Sureshkumar","Synthesis, characterization and anti-diabetic assay of diorganotin(iv) azo-carboxylates: crystal structure and topological studies of azo-dicarboxylic acid ligand and its cyclic tetranuclear dimethyltin(iv) complex","New J. Chem.","2016","40","2","1471","","10.1039/C5NJ02637G","","","0.71073","MoKα","","0.0409","0.0284","","","0.0584","0.0659","","","","","","1.106","","","","has coordinates,has disorder","177886","2020-10-21","18:00:00",""
"7055202","10.966","0.003","7.485","0.0012","23.09","0.02","90","","100.94","0.05","90","","1860.8","1.7","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,4-diazabicyclo[2.2.2]octane hydroiodide water methanol cocrystal","","- C7 H19 I N2 O2 -","- C7 H19 I N2 O2 -","- C56 H152 I8 N16 O16 -","8","1","","Olejniczak, A.; Podsiadło, M.; Katrusiak, A.","High pressure used for producing a new solvate of 1,4-diazabicyclo[2.2.2]octane hydroiodide","New J. Chem.","2016","40","3","2014","","10.1039/C5NJ01654A","","","0.71073","MoKα","","0.0919","0.0459","","","0.1169","0.1544","","","","","","1.085","","","","has coordinates","181764","2020-10-21","18:00:00",""
"7055203","22.807","0.004","25.243","0.005","16.204","0.003","90","","133.809","0.002","90","","6732","2","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C46 H30 N8 O10 Zn2 -","- C46 H30 N8 O10 Zn2 -","- C184 H120 N32 O40 Zn8 -","4","0.5","","Yao, Wan-Ting; Luo, Ming-Biao; Feng, Xue-Feng; Meng, Pan-Pan; Gong, Le-Le; Luo, Feng","Construction of structural diversity and fine-tuned porosity in acylamide MOFs by a synthetic approach","New J. Chem.","2016","40","3","2021","","10.1039/C5NJ02634B","","","0.71073","MoKα","","0.061","0.0399","","","0.0946","0.0995","","","","","","0.901","","","","has coordinates","181776","2020-10-21","18:00:00",""
"7055204","17.202","0.005","17.211","0.005","18.875","0.006","90","","114.062","0.004","90","","5103","3","296","2","296","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C23 H14 N4 O5 Zn -","- C23 H14 N4 O5 Zn -","- C92 H56 N16 O20 Zn4 -","4","1","","Yao, Wan-Ting; Luo, Ming-Biao; Feng, Xue-Feng; Meng, Pan-Pan; Gong, Le-Le; Luo, Feng","Construction of structural diversity and fine-tuned porosity in acylamide MOFs by a synthetic approach","New J. Chem.","2016","40","3","2021","","10.1039/C5NJ02634B","","","0.71073","MoKα","","0.0982","0.0586","","","0.1357","0.1536","","","","","","0.832","","","","has coordinates","181776","2020-10-21","18:00:00",""
"7055205","23.2393","0.0018","25.042","0.002","53.544","0.004","90","","94.148","0.004","90","","31079","4","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Zn4(AzDC)4(L)2(DMF)1.5(H2O)0.5","","- C104 H68 N16 O20 Zn4 -","- C104 H68 N16 O20 Zn4 -","- C832 H544 N128 O160 Zn32 -","8","1","","Yao, Wan-Ting; Luo, Ming-Biao; Feng, Xue-Feng; Meng, Pan-Pan; Gong, Le-Le; Luo, Feng","Construction of structural diversity and fine-tuned porosity in acylamide MOFs by a synthetic approach","New J. Chem.","2016","40","3","2021","","10.1039/C5NJ02634B","","","0.71073","MoKα","","0.2433","0.1859","","","0.5286","0.5556","","","","","","1.07","","","","has coordinates","181776","2020-10-21","18:00:00",""
"7055206","16.833","0.0014","29.227","0.002","53.531","0.004","90","","96.338","0.004","90","","26175","3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Zn4(AzDC)4(L)4(DMF)4.5","","- C152 H104 N23 O24 Zn4 -","- C152 H104 N23 O24 Zn4 -","- C608 H416 N92 O96 Zn16 -","4","0.5","","Yao, Wan-Ting; Luo, Ming-Biao; Feng, Xue-Feng; Meng, Pan-Pan; Gong, Le-Le; Luo, Feng","Construction of structural diversity and fine-tuned porosity in acylamide MOFs by a synthetic approach","New J. Chem.","2016","40","3","2021","","10.1039/C5NJ02634B","","","0.71073","MoKα","","0.2007","0.1719","","","0.5027","0.5265","","","","","","1.088","","","","has coordinates","181776","2020-10-21","18:00:00",""
"7055207","14.708","0.003","15.429","0.003","23.084","0.004","84.282","0.003","82.619","0.003","86.756","0.003","5164.1","1.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C87 H57 N Nd4 O32 -","- C87 H57 N Nd4 O32 -","- C174 H114 N2 Nd8 O64 -","2","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.0611","0.0403","","","0.0784","0.0843","","","","","","1.004","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055208","14.604","0.003","15.309","0.003","22.87","0.005","84.603","0.003","83.64","0.003","86.655","0.003","5053.2","1.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C87 H57 N O32 Sm4 -","- C87 H57 N O32 Sm4 -","- C174 H114 N2 O64 Sm8 -","2","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.0942","0.0527","","","0.099","0.1092","","","","","","0.992","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055209","14.589","0.002","15.285","0.002","22.758","0.003","84.679","0.003","84.323","0.003","86.396","0.003","5020.8","1.2","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C87 H57 Eu4 N O32 -","- C87 H57 Eu4 N O32 -","- C174 H114 Eu8 N2 O64 -","2","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.1139","0.0652","","","0.1146","0.1246","","","","","","0.986","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055210","14.626","0.007","15.297","0.007","23.009","0.01","84.817","0.006","83.605","0.006","86.488","0.006","5088","4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C87 H57 Gd4 N O32 -","- C87 H57 Gd4 N O32 -","- C174 H114 Gd8 N2 O64 -","2","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.0759","0.0475","","","0.0896","0.0977","","","","","","0.983","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055211","15.089","0.006","15.275","0.006","23.654","0.01","85.902","0.007","81.506","0.007","86.813","0.008","5373","4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H52 N O32 Tb4 -","- C84 H52 O32 Tb4 -","- C168 H104 O64 Tb8 -","2","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.109","0.0752","","","0.1473","0.1616","","","","","","1.017","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055212","15.189","0.003","15.232","0.002","23.855","0.004","85.89","0.003","79.971","0.003","86.842","0.003","5415.7","1.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H52 Dy4 N O32 -","- C84 H52 Dy4 O32 -","- C168 H104 Dy8 O64 -","2","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.0919","0.0562","","","0.1112","0.1221","","","","","","1.005","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055213","15.9451","0.0014","28.148","0.003","23.416","0.002","90","","107.837","0.002","90","","10004.5","1.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C87 H59 N O33 Tb4 -","- C87 H59 N O33 Tb4 -","- C348 H236 N4 O132 Tb16 -","4","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.0494","0.0348","","","0.0672","0.0705","","","","","","1.066","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055214","15.97","0.004","28.166","0.007","23.583","0.006","90","","108.092","0.003","90","","10083","4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C87 H59 Dy4 N O33 -","- C87 H59 Dy4 N O33 -","- C348 H236 Dy16 N4 O132 -","4","1","","Li, Yun; Wang, Ning; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang","Lanthanide metal‒organic frameworks based on the 4,4′-oxybisbenzoic acid ligand: synthesis, structures and physical properties","New J. Chem.","2015","39","12","9872","","10.1039/C5NJ01930C","","","0.71073","MoKα","","0.0686","0.0476","","","0.1017","0.1089","","","","","","1.09","","","","has coordinates","170884","2020-10-21","18:00:00",""
"7055215","12.577","0.003","8.509","0.008","20.565","0.006","90","","102.9","0.02","90","","2145","2","294","2","294","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 Cl N3 O2 -","- C10 H8 Cl N3 O2 -","- C80 H64 Cl8 N24 O16 -","8","2","","Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Zarate, Ximena; Schott, Eduardo","A family of substituted hydrazonoisoxazolones with potential biological properties","New J. Chem.","2016","40","3","2156","","10.1039/C5NJ02604K","","x-ray","0.71073","MoKα","","0.1267","0.0615","","","0.1297","0.1462","","","","","","1.009","","","","has coordinates","181756","2020-10-21","18:00:00",""
"7055216","7.642","","7.933","","9.511","","98.77","","104.53","","98.06","","541.945","","294","2","294","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C10 H8 Cl N3 O2 -","- C10 H8 Cl N3 O2 -","- C20 H16 Cl2 N6 O4 -","2","1","","Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Zarate, Ximena; Schott, Eduardo","A family of substituted hydrazonoisoxazolones with potential biological properties","New J. Chem.","2016","40","3","2156","","10.1039/C5NJ02604K","","x-ray","0.71073","MoKα","","0.1192","0.0497","","","0.1158","0.1376","","","","","","0.913","","","","has coordinates","181756","2020-10-21","18:00:00",""
"7055217","15.7377","0.0005","21.1254","0.0008","11.7487","0.0003","90","","90","","90","","3906","0.2","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C29 H22 Cd1.5 N4 O7 -","- C29 H22 Cd1.5 N4 O7 -","- C116 H88 Cd6 N16 O28 -","4","1","","Xu, Zhong-Xuan; Liu, Liyang; Zhang, Jian","A pair of homochiral porous metal‒organic frameworks with a helical metal-carboxylate layer","New J. Chem.","2016","40","3","1927","","10.1039/C5NJ02236C","","","1.54178","CuKα","","0.0456","0.0413","","","0.1113","0.1143","","","","","","1.043","","","","has coordinates,has disorder","181761","2020-10-21","18:00:00",""
"7055218","15.6969","0.0006","20.9233","0.0007","11.7168","0.0004","90","","90","","90","","3848.2","0.2","293","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C29 H22 Cd1.5 N4 O7 -","- C29 H22 Cd1.5 N4 O7 -","- C116 H88 Cd6 N16 O28 -","4","1","","Xu, Zhong-Xuan; Liu, Liyang; Zhang, Jian","A pair of homochiral porous metal‒organic frameworks with a helical metal-carboxylate layer","New J. Chem.","2016","40","3","1927","","10.1039/C5NJ02236C","","","0.71073","MoKα","","0.0427","0.0387","","","0.0993","0.1018","","","","","","1.09","","","","has coordinates,has disorder","181761","2020-10-21","18:00:00",""
"7055219","7.957","0.005","9.112","0.005","16.833","0.01","80.061","0.009","80.638","0.009","82.591","0.009","1179.7","1.2","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H52 N6 O4 Pd S2 -","- C48 H52 N6 O4 Pd S2 -","- C48 H52 N6 O4 Pd S2 -","1","0.5","","Spodine, Evgenia; Hernández, Wilfredo; Vaisberg, Abraham; Tobar, Mabel; Alvarez, Melisa; Manzur, Jorge; Echevarría, Yuri","In Vitro Antiproliferative Activity of Palladium(II) Thiosemicarbazone Complexes and the Corresponding Functionalized Chitosan Coated Magnetite Nanoparticles","New J. Chem.","2015","","","","","10.1039/C5NJ02429C","","","0.71073","MoKα","","0.0674","0.0594","","","0.1462","0.1525","","","","","","1.035","","","","has coordinates","171458","2020-10-21","18:00:00",""
"7055220","7.96","0.001","13.588","0.002","22.433","0.003","87.035","0.006","83.056","0.005","73.204","0.005","2305.5","0.5","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H33 N O5 Si -","- C23 H33 N O5 Si -","- C92 H132 N4 O20 Si4 -","4","2","","Mutneja, Ruchi; Singh, Raghubir; Kaur, Varinder; Wagler, Jörg; Fels, Sabine; Kroke, Edwin","Schiff base tailed silatranes for the fabrication of functionalized silica based magnetic nano-cores possessing active sites for the adsorption of copper ions","New J. Chem.","2016","40","2","1640","","10.1039/C5NJ02287H","","","0.71073","MoKα","","0.2606","0.0729","","","0.1412","0.215","","","","","","0.965","","","","has coordinates","177897","2020-10-21","18:00:00",""
"7055221","7.8815","0.0012","13.2589","0.0008","13.5466","0.0006","117.517","0.002","103.013","0.003","93.115","0.003","1202.5","0.2","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H33 N O5 Si -","- C23 H33 N O5 Si -","- C46 H66 N2 O10 Si2 -","2","1","","Mutneja, Ruchi; Singh, Raghubir; Kaur, Varinder; Wagler, Jörg; Fels, Sabine; Kroke, Edwin","Schiff base tailed silatranes for the fabrication of functionalized silica based magnetic nano-cores possessing active sites for the adsorption of copper ions","New J. Chem.","2016","40","2","1640","","10.1039/C5NJ02287H","","","0.71073","MoKα","","0.072","0.0438","","","0.1119","0.1304","","","","","","1.012","","","","has coordinates,has disorder","177897","2020-10-21","18:00:00",""
"7055222","10.7352","0.0006","13.3873","0.0005","16.2758","0.001","90","","100.095","0.005","90","","2302.9","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H30.3 N2 O5.15 Si -","- C23 H30.3 N2 O5.15 Si -","- C92 H121.2 N8 O20.6 Si4 -","4","1","","Mutneja, Ruchi; Singh, Raghubir; Kaur, Varinder; Wagler, Jörg; Fels, Sabine; Kroke, Edwin","Schiff base tailed silatranes for the fabrication of functionalized silica based magnetic nano-cores possessing active sites for the adsorption of copper ions","New J. Chem.","2016","40","2","1640","","10.1039/C5NJ02287H","","","0.71073","MoKα","","0.0507","0.0397","","","0.0969","0.1029","","","","","","1.037","","","","has coordinates,has disorder","177897","2020-10-21","18:00:00",""
"7055223","9.4731","0.0005","13.5296","0.0008","29.022","0.0018","90","","90","","90","","3719.7","0.4","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H16 Cl4 N2 O3 Zn2 -","- C12 H16 Cl4 N2 O3 Zn2 -","- C96 H128 Cl32 N16 O24 Zn16 -","8","1","","Sharma, Vinay; Mohammad, Akbar; Mishra, Veenu; Chaudhary, Archana; Kapoor, Kshipra; Mobin, Shaikh M.","Fabrication of innovative ZnO nanoflowers showing drastic biological activity","New J. Chem.","2016","40","3","2145","","10.1039/C5NJ02391B","","","0.71073","MoKα","","0.0622","0.0467","","","0.0804","0.0865","","","","","","1.15","","","","has coordinates","181758","2020-10-21","18:00:00",""
"7055224","10.468","0.007","8.1058","0.0006","10.993","0.003","90","","97.69","0.04","90","","924.4","0.7","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H9 Cl2 N O Zn -","- C7 H9 Cl2 N O Zn -","- C28 H36 Cl8 N4 O4 Zn4 -","4","1","","Sharma, Vinay; Mohammad, Akbar; Mishra, Veenu; Chaudhary, Archana; Kapoor, Kshipra; Mobin, Shaikh M.","Fabrication of innovative ZnO nanoflowers showing drastic biological activity","New J. Chem.","2016","40","3","2145","","10.1039/C5NJ02391B","","","0.71073","MoKα","","0.0451","0.0372","","","0.0802","0.0824","","","","","","0.995","","","","has coordinates","181758","2020-10-21","18:00:00",""
"7055225","8.0536","0.0014","15.872","0.002","3.5364","0.0006","90","","100.268","0.007","90","","444.81","0.12","301","","301","","","","","","","","","4","C 1 m 1","C -2y","8","","","","- B3 Cd4 Nd O10 -","- B3 Cd4 Nd O10 -","- B6 Cd8 Nd2 O20 -","2","0.5","","Wang, Xing; Xia, Mingjun; Li, R. K.","Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties","New J. Chem.","2016","40","3","2057","","10.1039/C5NJ02710A","","","0.71073","MoKα","","0.032","0.0311","","","0.073","0.0745","","","","","","1.084","","","","has coordinates","208165","2020-10-21","18:00:00",""
"7055226","10.4864","0.0002","10.4864","0.0002","6.2665","0.0001","90","","90","","120","","596.772","0.019","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 Nd3 O15 -","- B5 Ca3 Nd3 O15 -","- B10 Ca6 Nd6 O30 -","2","0.166667","","Wang, Xing; Xia, Mingjun; Li, R. K.","Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties","New J. Chem.","2016","40","3","2057","","10.1039/C5NJ02710A","","","0.71073","MoKα","","0.0245","0.0245","","","0.0584","0.0584","","","","","","1.191","","","","has coordinates","181759","2020-10-21","18:00:00",""
"7055227","8.7069","0.0008","9.1354","0.0008","15.4095","0.0014","98.506","0.0015","91.665","0.0015","113.205","0.0014","1108.98","0.17","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H32 K O6 -","- C22 H32 K O6 -","- C44 H64 K2 O12 -","2","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.0853","0.0513","","","0.0943","0.1081","","","","","","1.035","","","","has coordinates","181765","2020-10-21","18:00:00",""
"7055228","13.0082","0.0008","18.1719","0.0011","15.3774","0.001","90","","112.47","0.001","90","","3359","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C34 H50 K O8 -","- C34 H50 K O8 -","- C136 H200 K4 O32 -","4","2","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.0754","0.0444","","","0.0767","0.0878","","","","","","1.004","","","","has coordinates","181765","2020-10-21","18:00:00",""
"7055229","8.602","0.0003","21.887","0.0008","22.2344","0.0008","90","","90","","90","","4186.1","0.3","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H32 Li O6 -","- C22 H32 Li O6 -","- C176 H256 Li8 O48 -","8","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.0531","0.0368","","","0.081","0.0918","","","","","","1.025","","","","has coordinates","181765","2020-10-21","18:00:00",""
"7055230","11.5114","0.0007","11.8386","0.0007","13.627","0.0008","65.213","0.001","70.169","0.001","63.751","0.001","1484.9","0.15","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H44 Na O8 -","- C30 H44 Na O8 -","- C60 H88 Na2 O16 -","2","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.0938","0.0491","","","0.0873","0.1074","","","","","","1.011","","","","has coordinates","181765","2020-10-21","18:00:00",""
"7055231","22.1045","0.0007","12.5068","0.0004","16","0.0009","90","","132.18","","90","","3277.8","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C36 H46 Na O8 -","- C36 H46 Na O8 -","- C144 H184 Na4 O32 -","4","0.5","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.0375","0.0335","","","0.092","0.0954","","","","","","1.024","","","","has coordinates","181765","2020-10-21","18:00:00",""
"7055232","12.8923","0.0012","18.0166","0.0017","15.2947","0.0014","90","","114.036","0.002","90","","3244.5","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H48 K O8 -","- C32 H48 K O8 -","- C128 H192 K4 O32 -","4","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.134","0.0607","","","0.133","0.1708","","","","","","1.02","","","","has coordinates,has disorder","181765","2020-10-21","18:00:00",""
"7055233","12.1048","0.0008","17.6109","0.0012","15.2132","0.001","90","","103.67","0.001","90","","3151.2","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H50 Li O8 -","- C32 H50 Li O8 -","- C128 H200 Li4 O32 -","4","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.0637","0.0406","","","0.0901","0.103","","","","","","1","","","","has coordinates,has disorder","181765","2020-10-21","18:00:00",""
"7055234","12.7772","0.0013","17.6539","0.0018","15.1994","0.0015","90","","112.12","0.002","90","","3176.1","0.6","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H50 Na O8 -","- C32 H50 Na O8 -","- C128 H200 Na4 O32 -","4","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.0841","0.0424","","","0.0931","0.111","","","","","","1.004","","","","has coordinates,has disorder","181765","2020-10-21","18:00:00",""
"7055235","8.6161","0.0008","15.756","0.0014","19.686","0.0018","90","","98.022","0.002","90","","2646.3","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H42 Na O8 -","- C26 H42 Na O8 -","- C104 H168 Na4 O32 -","4","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.1053","0.0487","","","0.0853","0.1037","","","","","","1.006","","","","has coordinates","181765","2020-10-21","18:00:00",""
"7055236","17.512","0.0018","18.3856","0.0019","23.115","0.002","90","","98.461","0.002","90","","7361.3","1.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H52 K O8 -","- C40 H52 K O8 -","- C320 H416 K8 O64 -","8","2","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.1178","0.0656","","","0.1549","0.1784","","","","","","1.04","","","","has coordinates,has disorder","181765","2020-10-21","18:00:00",""
"7055237","8.3174","0.0005","12.2288","0.0008","20.1448","0.0013","104.274","0.001","99.634","0.001","97.908","0.001","1923.1","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H52 Li O8 -","- C46 H52 Li O8 -","- C92 H104 Li2 O16 -","2","1","","Castillo, Maximiliano; Metta-Magaña, Alejandro J.; Fortier, Skye","Isolation of gravimetrically quantifiable alkali metal arenides using 18-crown-6","New J. Chem.","2016","40","3","1923","","10.1039/C5NJ02841H","","","0.71073","MoKα","","0.144","0.0635","","","0.1123","0.1438","","","","","","0.976","","","","has coordinates","181765","2020-10-21","18:00:00",""
"7055238","11.838","0.0004","12.3065","0.0004","20.7813","0.0008","99.315","0.003","99.81","0.003","95.905","0.003","2917.29","0.18","100","0.1","100","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C44 H88 Br Mo6 N3 O18 -","- C44 H88 Br Mo6 N3 O18 -","- C88 H176 Br2 Mo12 N6 O36 -","2","1","","Jangir, Ritambhara; Antony, Rajendran; Murugavel, Ramaswamy","New sterically encumbered arylimido hexamolybdates for organic oxidation reactions","New J. Chem.","2016","40","2","1004","","10.1039/C5NJ02330K","","","1.5418","CuKα","","0.0322","0.0304","","","0.0773","0.0786","","","","","","1.088","","","","has coordinates","177893","2020-10-21","18:00:00",""
"7055239","16.201","0.004","19.611","0.005","22.481","0.006","98.01","0.05","96.77","0.04","90.14","0.06","7022","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H104 Br2 Mo6 N4 O17 -","- C56 H104 Br2 Mo6 N4 O17 -","- C224 H416 Br8 Mo24 N16 O68 -","4","2","","Jangir, Ritambhara; Antony, Rajendran; Murugavel, Ramaswamy","New sterically encumbered arylimido hexamolybdates for organic oxidation reactions","New J. Chem.","2016","40","2","1004","","10.1039/C5NJ02330K","","","0.71073","MoKα","","0.0683","0.0529","","","0.1411","0.1533","","","","","","1.088","","","","has coordinates,has disorder","177893","2020-10-21","18:00:00",""
"7055240","23.8986","0.0005","15.7862","0.0002","20.1555","0.0005","90","","112.883","0.002","90","","7005.6","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H105.54 Mo6 N4 O18 -","- C56 H105.543 Mo6 N4 O18 -","- C224 H422.172 Mo24 N16 O72 -","4","1","","Jangir, Ritambhara; Antony, Rajendran; Murugavel, Ramaswamy","New sterically encumbered arylimido hexamolybdates for organic oxidation reactions","New J. Chem.","2016","40","2","1004","","10.1039/C5NJ02330K","","","1.54184","CuKα","","0.0879","0.0546","","","0.1372","0.1565","","","","","","0.967","","","","has coordinates,has disorder","177893","2020-10-21","18:00:00",""
"7055241","23.078","0.005","11.26","0.0018","17.936","0.004","90","","118.626","0.005","90","","4091.1","1.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3'-(4-methoxyphenyl)-4'-nitro-5'-phenylspiro[indoline-3,2'-pyrrolidin]-2-one","","- C24 H21 N3 O4 -","- C24 H21 N3 O4 -","- C192 H168 N24 O32 -","8","1","","Mali, Prakash R.; Chandrasekhara Rao, L.; Bangade, Vikas M.; Shirsat, Prashishkumar K.; George, Sara A.; Jagadeesh babu, N.; Meshram, H. M.","A convenient and rapid microwave-assisted synthesis of spirooxindoles in aqueous medium and their antimicrobial activities","New J. Chem.","2016","40","3","2225","","10.1039/C5NJ02126J","","","0.71073","MoKα","","0.0603","0.0468","","","0.1269","0.1387","","","","","","1.047","","","","has coordinates,has disorder","181770","2020-10-21","18:00:00",""
"7055242","16.515","0.002","45.244","0.007","7.7842","0.0011","90","","92.294","0.003","90","","5811.7","1.4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 N2 -","- C23 H24 N2 -","- C276 H288 N24 -","12","3","","Ji, Xiangdong; Yao, Wei; Luo, Xuyang; Gao, Wei; Mu, Ying","Synthesis of Ti, Zr, and Hf complexes with a new tetra-azane ligand by one-pot HCl-elimination and their properties as catalysts for production of UHMWPE","New J. Chem.","2016","40","3","2071","","10.1039/C5NJ02151K","","","0.71073","MoKα","","0.135","0.0754","","","0.1494","0.1746","","","","","","1.053","","","","has coordinates","181771","2020-10-21","18:00:00",""
"7055243","10.2174","0.001","10.6434","0.001","19.4065","0.0018","77.176","0.002","80.422","0.002","66.226","0.002","1876.1","0.3","185","2","185","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H50 N4 -","- C44 H50 N4 -","- C88 H100 N8 -","2","1","","Ji, Xiangdong; Yao, Wei; Luo, Xuyang; Gao, Wei; Mu, Ying","Synthesis of Ti, Zr, and Hf complexes with a new tetra-azane ligand by one-pot HCl-elimination and their properties as catalysts for production of UHMWPE","New J. Chem.","2016","40","3","2071","","10.1039/C5NJ02151K","","","0.71073","MoKα","","0.1172","0.0681","","","0.155","0.1905","","","","","","1.028","","","","has coordinates","181771","2020-10-21","18:00:00",""
"7055244","10.7714","0.0008","11.1493","0.0008","19.3176","0.0014","100.572","0.001","101.732","0.001","104.877","0.001","2126.1","0.3","185","2","185","2","","","","","","","","5","P -1","-P 1","2","","","","- C44.5 H49 Cl3 N4 Ti -","- C44.5 H49 Cl3 N4 Ti -","- C89 H98 Cl6 N8 Ti2 -","2","1","","Ji, Xiangdong; Yao, Wei; Luo, Xuyang; Gao, Wei; Mu, Ying","Synthesis of Ti, Zr, and Hf complexes with a new tetra-azane ligand by one-pot HCl-elimination and their properties as catalysts for production of UHMWPE","New J. Chem.","2016","40","3","2071","","10.1039/C5NJ02151K","","","0.71073","MoKα","","0.0756","0.0573","","","0.1404","0.1612","","","","","","1.066","","","","has coordinates","181771","2020-10-21","18:00:00",""
"7055245","10.8808","0.0013","11.226","0.0013","19.417","0.002","100.183","0.002","103.09","0.002","104.971","0.002","2160.8","0.4","185","2","185","2","","","","","","","","5","P -1","-P 1","2","","","","- C44.5 H49 Cl3 N4 Zr -","- C44.5 H49 Cl3 N4 Zr -","- C89 H98 Cl6 N8 Zr2 -","2","1","","Ji, Xiangdong; Yao, Wei; Luo, Xuyang; Gao, Wei; Mu, Ying","Synthesis of Ti, Zr, and Hf complexes with a new tetra-azane ligand by one-pot HCl-elimination and their properties as catalysts for production of UHMWPE","New J. Chem.","2016","40","3","2071","","10.1039/C5NJ02151K","","","0.71073","MoKα","","0.1317","0.0844","","","0.2013","0.2403","","","","","","1.07","","","","has coordinates","181771","2020-10-21","18:00:00",""
"7055246","10.9945","0.0007","11.1586","0.0007","19.4967","0.0013","98.036","0.001","104.963","0.001","105.193","0.001","2174.1","0.2","185","2","185","2","","","","","","","","5","P -1","-P 1","2","","","","- C47.5 H53 Cl2 Hf N4 -","- C47.5 H53 Cl2 Hf N4 -","- C95 H106 Cl4 Hf2 N8 -","2","1","","Ji, Xiangdong; Yao, Wei; Luo, Xuyang; Gao, Wei; Mu, Ying","Synthesis of Ti, Zr, and Hf complexes with a new tetra-azane ligand by one-pot HCl-elimination and their properties as catalysts for production of UHMWPE","New J. Chem.","2016","40","3","2071","","10.1039/C5NJ02151K","","","0.71073","MoKα","","0.04","0.0344","","","0.086","0.0981","","","","","","1.104","","","","has coordinates","181771","2020-10-21","18:00:00",""
"7055247","11.6472","0.0015","11.6472","0.0015","19.117","0.002","90","","90","","120","","2245.9","0.5","173","2","173","2","","","","","","","","6","R 3 :H","R 3","146","","","","- Cs3 H20 Na Nb2 O29 W4 -","- Cs3 Na Nb2.001 O29 W3.999 -","- Cs9 Na3 Nb6.003 O87 W11.997 -","3","0.333333","","Sures, Dylan J.; Molina, Pedro I.; Miró, Pere; Zakharov, Lev N.; Nyman, May","Cesium salts of niobo-tungstate isopolyanions with intermediate group V‒group VI character","New J. Chem.","2016","40","2","928","","10.1039/C5NJ02914G","","","0.71073","MoKα","","0.0497","0.0325","","","0.0537","0.0581","","","","","","1.006","","","","has coordinates","177894","2020-10-21","18:00:00",""
"7055248","9.6119","0.0008","11.8087","0.001","11.2532","0.0009","90","","90.929","0.004","90","","1277.12","0.18","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Cs4 H8 Nb1.97 O23 W4.03 -","- Cs4 Nb1.966 O23 W4.034 -","- Cs8 Nb3.932 O46 W8.068 -","2","0.5","","Sures, Dylan J.; Molina, Pedro I.; Miró, Pere; Zakharov, Lev N.; Nyman, May","Cesium salts of niobo-tungstate isopolyanions with intermediate group V‒group VI character","New J. Chem.","2016","40","2","928","","10.1039/C5NJ02914G","","","0.71073","MoKα","","0.0897","0.0468","","","0.0869","0.1037","","","","","","1.016","","","","has coordinates,has disorder","177894","2020-10-21","18:00:00",""
"7055249","9.576","0.0003","13.5844","0.0004","12.3503","0.0004","90","","90.079","0.0012","90","","1606.58","0.09","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Cs4 H24 Na2 Nb3.89 O31 W2.11 -","- Cs4 H24 Na2 Nb3.896 O31 W2.104 -","- Cs8 H48 Na4 Nb7.792 O62 W4.208 -","2","0.5","","Sures, Dylan J.; Molina, Pedro I.; Miró, Pere; Zakharov, Lev N.; Nyman, May","Cesium salts of niobo-tungstate isopolyanions with intermediate group V‒group VI character","New J. Chem.","2016","40","2","928","","10.1039/C5NJ02914G","","","0.71073","MoKα","","0.0318","0.031","","","0.0917","0.0921","","","","","","1.261","","","","has coordinates","177894","2020-10-21","18:00:00",""
"7055250","7.5074","0.0006","15.984","0.0013","23.982","0.002","90","","96.482","0.003","90","","2859.4","0.4","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H36 Cl2 N4 Ni2 O10 -","- C21 H36 Cl2 N4 Ni2 O10 -","- C84 H144 Cl8 N16 Ni8 O40 -","4","1","","Mahapatra, Tufan Singha; Chaudhury, Susmitnarayan; Dasgupta, Swagata; Bertolasi, Valerio; Ray, Debashis","Dinuclear nickel complexes of divergent Ni⋯Ni separation showing ancillary ligand addition and bio-macromolecular interaction","New J. Chem.","2016","40","3","2268","","10.1039/C5NJ02410B","","","0.71073","MoKα","","0.1263","0.0863","","","0.2066","0.228","","","","","","1.116","","","","has coordinates","181773","2020-10-21","18:00:00",""
"7055251","11.6655","0.0001","16.9475","0.0001","22.7678","0.0002","74.219","0.0004","87.0926","0.0004","75.704","0.0004","4196.77","0.06","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H46 F9 N5 Ni2 O10 -","- C30 H46 F9 N5 Ni2 O10 -","- C120 H184 F36 N20 Ni8 O40 -","4","2","","Mahapatra, Tufan Singha; Chaudhury, Susmitnarayan; Dasgupta, Swagata; Bertolasi, Valerio; Ray, Debashis","Dinuclear nickel complexes of divergent Ni⋯Ni separation showing ancillary ligand addition and bio-macromolecular interaction","New J. Chem.","2016","40","3","2268","","10.1039/C5NJ02410B","","","0.71073","MoKα","","0.0857","0.0618","","","0.1803","0.1964","","","","","","1.058","","","","has coordinates","181773","2020-10-21","18:00:00",""
"7055252","19.664","0.003","11.6297","0.0018","20.591","0.003","90","","117.27","0.004","90","","4185.5","1.1","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C33 H61 Cl N6 Ni2 O12 -","- C33 H61 Cl N6 Ni2 O12 -","- C132 H244 Cl4 N24 Ni8 O48 -","4","1","","Mahapatra, Tufan Singha; Chaudhury, Susmitnarayan; Dasgupta, Swagata; Bertolasi, Valerio; Ray, Debashis","Dinuclear nickel complexes of divergent Ni⋯Ni separation showing ancillary ligand addition and bio-macromolecular interaction","New J. Chem.","2016","40","3","2268","","10.1039/C5NJ02410B","","","0.71073","MoKα","","0.0499","0.0377","","","0.0969","0.1046","","","","","","1.05","","","","has coordinates,has disorder","181773","2020-10-21","18:00:00",""
"7055253","17.461","0.003","67.604","0.009","12.0678","0.0017","90","","90","","90","","14245","4","295","","295","","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C28 H45 N7 Ni2 O4 S2 -","- C28 H45 N7 Ni2 O4 S2 -","- C448 H720 N112 Ni32 O64 S32 -","16","1","","Mahapatra, Tufan Singha; Chaudhury, Susmitnarayan; Dasgupta, Swagata; Bertolasi, Valerio; Ray, Debashis","Dinuclear nickel complexes of divergent Ni⋯Ni separation showing ancillary ligand addition and bio-macromolecular interaction","New J. Chem.","2016","40","3","2268","","10.1039/C5NJ02410B","","","0.71073","MoKα","","0.1745","0.0874","","","0.1206","0.1526","","","","","","1.13","","","","has coordinates,has disorder","181773","2020-10-21","18:00:00",""
"7055254","10.3693","0.0009","35.46","0.003","18.8761","0.0015","90","","104.288","0.002","90","","6726","1","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H45 N11 Ni2 O4 -","- C26 H45 N11 Ni2 O4 -","- C208 H360 N88 Ni16 O32 -","8","2","","Mahapatra, Tufan Singha; Chaudhury, Susmitnarayan; Dasgupta, Swagata; Bertolasi, Valerio; Ray, Debashis","Dinuclear nickel complexes of divergent Ni⋯Ni separation showing ancillary ligand addition and bio-macromolecular interaction","New J. Chem.","2016","40","3","2268","","10.1039/C5NJ02410B","","","0.71073","MoKα","","0.1014","0.0578","","","0.1386","0.1679","","","","","","1.039","","","","has coordinates,has disorder","181773","2020-10-21","18:00:00",""
"7055255","15.295","0.005","15.295","0.005","19.43","0.005","90","0.005","90","0.005","90","0.005","4545","2","298","2","298.15","","","","","","","","","8","I 4/m","-I 4","87","","1","","- C24 H95 As Cu4 N16 Nb12 O52 V4 -","- C24 H80 As Cu4 N16 Nb12 O52 V4 -","- C48 H160 As2 Cu8 N32 Nb24 O104 V8 -","2","0.125","","Li, Ning; Liu, Yiwei; Lu, Ying; He, Danfeng; Liu, Shumei; Wang, Xingquan; Li, Yangguang; Liu, Shuxia","An arsenicniobate-based 3D framework with selective adsorption and anion-exchange properties","New J. Chem.","2016","40","3","2220","","10.1039/C5NJ02163D","","","0.71069","MoKα","","0.0611","0.0544","","","0.1863","0.1956","","","","","","1.051","","","","has coordinates,has disorder","181774","2020-10-21","18:00:00",""
"7055256","7.8007","0.0006","10.7877","0.0005","20.2847","0.0016","90","","91.562","0.007","90","","1706.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 N4 O5 -","- C15 H21 N4 O5 -","- C60 H84 N16 O20 -","4","1","","Ionita, Gabriela; Madalan, Augustin M.; Ariciu, Ana Maria; Medvedovici, Andrei; Ionita, Petre","Synthesis of novel TEMPO stable free (poly)radical derivatives and their host‒guest interaction with cucurbit[6]uril","New J. Chem.","2016","40","1","503","","10.1039/C5NJ01518A","","","0.71073","MoKα","","0.1063","0.0479","","","0.0985","0.1162","","","","","","0.973","","","","has coordinates","173500","2020-10-21","18:00:00",""
"7055257","7.0768","0.0007","25.637","0.004","10.7812","0.0011","90","","101.712","0.008","90","","1915.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H25 N4 O5 -","- C16 H25 N4 O5 -","- C64 H100 N16 O20 -","4","1","","Ionita, Gabriela; Madalan, Augustin M.; Ariciu, Ana Maria; Medvedovici, Andrei; Ionita, Petre","Synthesis of novel TEMPO stable free (poly)radical derivatives and their host‒guest interaction with cucurbit[6]uril","New J. Chem.","2016","40","1","503","","10.1039/C5NJ01518A","","","0.71073","MoKα","","0.2069","0.0451","","","0.0432","0.0687","","","","","","0.724","","","","has coordinates","173500","2020-10-21","18:00:00",""
"7055258","10.3872","0.0006","14.4087","0.001","18.44","0.001","95.95","0.02","102","0.014","109.68","0.013","2496.2","0.4","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C57 H50 B Cu F4 N4 O2 P2 -","- C57 H50 B Cu F4 N4 O2 P2 -","- C114 H100 B2 Cu2 F8 N8 O4 P4 -","2","1","","Liu, Xinfang; Li, Rongfang; Ma, Lufang; Feng, Xun; Ding, Yuqiang","Influences of the protonic state of an imidazole-phenanthroline ligand on the luminescence properties of copper(i) complexes: experimental and theoretical research","New J. Chem.","2016","40","1","619","","10.1039/C5NJ02100F","","","0.71073","MoKα","","0.1065","0.0762","","","0.1523","0.1703","","","","","","1.087","","","","has coordinates,has disorder","173501","2020-10-21","18:00:00",""
"7055259","13.0549","0.0002","13.6031","0.0002","14.2237","0.0002","73.079","0.001","75.249","0.001","87.895","0.001","2335.03","0.06","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H43 Cu N4 O2 P2 -","- C56 H43 Cu N4 O2 P2 -","- C112 H86 Cu2 N8 O4 P4 -","2","1","","Liu, Xinfang; Li, Rongfang; Ma, Lufang; Feng, Xun; Ding, Yuqiang","Influences of the protonic state of an imidazole-phenanthroline ligand on the luminescence properties of copper(i) complexes: experimental and theoretical research","New J. Chem.","2016","40","1","619","","10.1039/C5NJ02100F","","","0.71073","MoKα","","0.0459","0.0387","","","0.0974","0.1039","","","","","","1.056","","","","has coordinates,has disorder","173501","2020-10-21","18:00:00",""
"7055260","19.491","0.004","25.892","0.005","8.9679","0.0018","90","","90","","90","","4525.7","1.6","223.15","","223.15","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C56 H43 Cu N4 P2 -","- C56 H43 Cu N4 P2 -","- C224 H172 Cu4 N16 P8 -","4","1","","Liu, Xinfang; Li, Rongfang; Ma, Lufang; Feng, Xun; Ding, Yuqiang","Influences of the protonic state of an imidazole-phenanthroline ligand on the luminescence properties of copper(i) complexes: experimental and theoretical research","New J. Chem.","2016","40","1","619","","10.1039/C5NJ02100F","","","0.71073","MoKα","","0.1352","0.0805","","","0.1693","0.2007","","","","","","0.95","","","","has coordinates","173501","2020-10-21","18:00:00",""
"7055261","12.143","0.0013","14.0076","0.0014","14.3167","0.0014","107.833","0.002","93.586","0.002","92.363","0.002","2309","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H40 Cu2 N4 O12 P4 -","- C48 H40 Cu2 N4 O12 P4 -","- C96 H80 Cu4 N8 O24 P8 -","2","1","","Zhu, Yan-Yu; Wang, Mei-Ling; Ma, Ming-Xue; Sun, Zhen-Gang; Jiao, Cheng-Qi; Ma, Chao; Li, Huan-Yu","Transition metal phosphonates with supramolecular structures: syntheses, structures, surface photovoltage and luminescence properties","New J. Chem.","2016","40","1","578","","10.1039/C5NJ02417J","","","0.71073","MoKα","","0.0761","0.0475","","","0.1204","0.139","","","","","","1.016","","","","has coordinates,has disorder","173502","2020-10-21","18:00:00",""
"7055262","11.1636","0.0006","11.3733","0.0006","11.8809","0.0006","105.563","0.001","114.973","0.001","103.195","0.001","1212.38","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H20 N2 O6 P2 Zn -","- C24 H20 N2 O6 P2 Zn -","- C48 H40 N4 O12 P4 Zn2 -","2","1","","Zhu, Yan-Yu; Wang, Mei-Ling; Ma, Ming-Xue; Sun, Zhen-Gang; Jiao, Cheng-Qi; Ma, Chao; Li, Huan-Yu","Transition metal phosphonates with supramolecular structures: syntheses, structures, surface photovoltage and luminescence properties","New J. Chem.","2016","40","1","578","","10.1039/C5NJ02417J","","","0.71073","MoKα","","0.0319","0.0266","","","0.0666","0.0698","","","","","","1.042","","","","has coordinates","173502","2020-10-21","18:00:00",""
"7055263","13.0305","0.0008","14.3151","0.0009","17.8602","0.001","90","","111.826","0.004","90","","3092.7","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 Mn N2 O9 P3 -","- C30 H27 Mn N2 O9 P3 -","- C120 H108 Mn4 N8 O36 P12 -","4","1","","Zhu, Yan-Yu; Wang, Mei-Ling; Ma, Ming-Xue; Sun, Zhen-Gang; Jiao, Cheng-Qi; Ma, Chao; Li, Huan-Yu","Transition metal phosphonates with supramolecular structures: syntheses, structures, surface photovoltage and luminescence properties","New J. Chem.","2016","40","1","578","","10.1039/C5NJ02417J","","","0.71073","MoKα","","0.0478","0.0321","","","0.0813","0.0901","","","","","","1.015","","","","has coordinates,has disorder","173502","2020-10-21","18:00:00",""
"7055264","13.1419","0.0006","14.4775","0.0007","17.4996","0.0008","90","","110.441","0.001","90","","3119.9","0.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 Cd N2 O9 P3 -","- C30 H27 Cd N2 O9 P3 -","- C120 H108 Cd4 N8 O36 P12 -","4","1","","Zhu, Yan-Yu; Wang, Mei-Ling; Ma, Ming-Xue; Sun, Zhen-Gang; Jiao, Cheng-Qi; Ma, Chao; Li, Huan-Yu","Transition metal phosphonates with supramolecular structures: syntheses, structures, surface photovoltage and luminescence properties","New J. Chem.","2016","40","1","578","","10.1039/C5NJ02417J","","","0.71073","MoKα","","0.0444","0.0318","","","0.0729","0.0804","","","","","","1.021","","","","has coordinates","173502","2020-10-21","18:00:00",""
"7055265","6.534","0.0001","25.7728","0.0005","8.4563","0.0006","90","","97.402","0.007","90","","1412.17","0.11","93","2","93","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 N2 O3 -","- C16 H20 N2 O3 -","- C64 H80 N8 O12 -","4","1","","Bloomfield, Aaron J.; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.","Facile solvolysis of a surprisingly twisted tertiary amide","New J. Chem.","2016","40","3","1974","","10.1039/C5NJ02449H","","","0.71075","MoKα","","0.0506","0.0414","","","0.1033","0.1081","","","","","","1.145","","","","has coordinates","181769","2020-10-21","18:00:00",""
"7055266","7.1666","0.0008","10.518","0.0012","20.8","0.003","75.729","0.005","82.329","0.006","82.895","0.006","1499.1","0.3","93","2","93","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H22 N2 O3 -","- C17 H22 N2 O3 -","- C68 H88 N8 O12 -","4","2","","Bloomfield, Aaron J.; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.","Facile solvolysis of a surprisingly twisted tertiary amide","New J. Chem.","2016","40","3","1974","","10.1039/C5NJ02449H","","","0.71075","MoKα","","0.1399","0.0837","","","0.1191","0.1324","","","","","","1.13","","","","has coordinates","181769","2020-10-21","18:00:00",""
"7055267","7.3641","0.0007","13.8244","0.0019","16.9502","0.0019","90","","90","","90","","1725.6","0.3","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H10 Au Cl N2 -","- C6 H10 Au Cl N2 -","- C48 H80 Au8 Cl8 N16 -","8","1","","Chou, Chang-Chuan; Yang, Chia-Chi; Chang, Hao-Ching; Lee, Way-Zen; Kuo, Ting-Shen","Weaving an infinite 3-D supramolecular network via AuI⋯AuIIIaurophilicity and C‒H⋯Cl hydrogen bonding","New J. Chem.","2016","40","3","1944","","10.1039/C5NJ02860D","","","0.71073","MoKα","","0.0634","0.0357","","","0.0629","0.0709","","","","","","1.021","","","","has coordinates","181757","2020-10-21","18:00:00",""
"7055268","8.4029","0.0005","20.7542","0.0011","13.5645","0.0008","90","","99.439","0.002","90","","2333.6","0.2","200","2","200","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C12 H20 Au N5 O3 -","- C12 H20.3333 Au N5 O3 -","- C72 H122 Au6 N30 O18 -","6","1.5","","Chou, Chang-Chuan; Yang, Chia-Chi; Chang, Hao-Ching; Lee, Way-Zen; Kuo, Ting-Shen","Weaving an infinite 3-D supramolecular network via AuI⋯AuIIIaurophilicity and C‒H⋯Cl hydrogen bonding","New J. Chem.","2016","40","3","1944","","10.1039/C5NJ02860D","","","0.71073","MoKα","","0.0365","0.0323","","","0.0767","0.0787","","","","","","1.117","","","","has coordinates","181757","2020-10-21","18:00:00",""
"7055269","8.5936","0.0014","13.854","0.002","14.342","0.002","77.941","0.002","82.224","0.003","77.872","0.003","1625.1","0.4","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H20 Au B F4 N4 -","- C12 H20 Au B F4 N4 -","- C48 H80 Au4 B4 F16 N16 -","4","2","","Chou, Chang-Chuan; Yang, Chia-Chi; Chang, Hao-Ching; Lee, Way-Zen; Kuo, Ting-Shen","Weaving an infinite 3-D supramolecular network via AuI⋯AuIIIaurophilicity and C‒H⋯Cl hydrogen bonding","New J. Chem.","2016","40","3","1944","","10.1039/C5NJ02860D","","","0.71073","MoKα","","0.0387","0.0314","","","0.0768","0.08","","","","","","1.082","","","","has coordinates","181757","2020-10-21","18:00:00",""
"7055270","7.45","0.002","7.938","0.002","8.481","0.003","89.041","0.007","84.027","0.007","68.263","0.005","463.2","0.2","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H20 Au F6 N4 Sb -","- C12 H20 Au F6 N4 Sb -","- C12 H20 Au F6 N4 Sb -","1","0.5","","Chou, Chang-Chuan; Yang, Chia-Chi; Chang, Hao-Ching; Lee, Way-Zen; Kuo, Ting-Shen","Weaving an infinite 3-D supramolecular network via AuI⋯AuIIIaurophilicity and C‒H⋯Cl hydrogen bonding","New J. Chem.","2016","40","3","1944","","10.1039/C5NJ02860D","","","0.71073","MoKα","","0.058","0.0531","","","0.1368","0.141","","","","","","1.158","","","","has coordinates","181757","2020-10-21","18:00:00",""
"7055271","6.6824","0.0004","8.2695","0.0005","17.5884","0.001","90","","90.01","0.002","90","","971.94","0.1","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Au2 Cl4 N4 -","- C12 H20 Au2 Cl4 N4 -","- C24 H40 Au4 Cl8 N8 -","2","0.5","","Chou, Chang-Chuan; Yang, Chia-Chi; Chang, Hao-Ching; Lee, Way-Zen; Kuo, Ting-Shen","Weaving an infinite 3-D supramolecular network via AuI⋯AuIIIaurophilicity and C‒H⋯Cl hydrogen bonding","New J. Chem.","2016","40","3","1944","","10.1039/C5NJ02860D","","","0.71073","MoKα","","0.064","0.0288","","","0.0517","0.062","","","","","","1.037","","","","has coordinates","181757","2020-10-21","18:00:00",""
"7055272","12.365","0.009","15.377","0.011","7.396","0.005","90","","104.715","0.008","90","","1360.1","1.7","110.15","","110.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N'-(2-oxoindolin-3-ylidene)pyrrolidine-1-carbothiohydrazide","","- C13 H16 N4 O2 S -","- C13 H16 N4 O2 S -","- C52 H64 N16 O8 S4 -","4","1","","Muralisankar, Mathiyan; Bhuvanesh, Nattamai S. P.; Sreekanth, Anandaram","Synthesis, X-ray crystal structure, DNA/protein binding and DNA cleavage studies of novel copper(ii) complexes of N-substituted isatin thiosemicarbazone ligands","New J. Chem.","2016","40","3","2661","","10.1039/C5NJ02806J","","","0.71073","MoKα","","0.0469","0.0384","","","0.093","0.0974","","","","","","1.034","","","","has coordinates","181760","2020-10-21","18:00:00",""
"7055273","21.514","0.019","9.287","0.007","15.869","0.012","90","","107.718","0.014","90","","3020","4","110.15","","110.15","","","","","","","","433K","5","C 1 2/c 1","-C 2yc","15","","(Z)-N'-(1-allyl-2-oxoindolin-3-ylidene)pyrrolidine-1-carbothiohydrazide","","- C16 H18 N4 O S -","- C16 H18 N4 O S -","- C128 H144 N32 O8 S8 -","8","1","","Muralisankar, Mathiyan; Bhuvanesh, Nattamai S. P.; Sreekanth, Anandaram","Synthesis, X-ray crystal structure, DNA/protein binding and DNA cleavage studies of novel copper(ii) complexes of N-substituted isatin thiosemicarbazone ligands","New J. Chem.","2016","40","3","2661","","10.1039/C5NJ02806J","","","0.71073","MoKα","","0.0531","0.0385","","","0.0847","0.092","","","","","","1.031","","","","has coordinates","181760","2020-10-21","18:00:00",""
"7055274","8.009","0.0017","19.621","0.004","11.51","0.003","90","","94.636","0.002","90","","1802.8","0.7","110.15","","110.15","","","","","","","","METHANOL / ACEONITRILE","5","P 1 21/n 1","-P 2yn","14","","N'-(1-benzyl-2-oxoindolin-3-ylidene)pyrrolidine-1-carbothiohydrazide","","- C20 H20 N4 O S -","- C20 H20 N4 O S -","- C80 H80 N16 O4 S4 -","4","1","","Muralisankar, Mathiyan; Bhuvanesh, Nattamai S. P.; Sreekanth, Anandaram","Synthesis, X-ray crystal structure, DNA/protein binding and DNA cleavage studies of novel copper(ii) complexes of N-substituted isatin thiosemicarbazone ligands","New J. Chem.","2016","40","3","2661","","10.1039/C5NJ02806J","","","0.71073","MoKα","","0.0553","0.0404","","","0.0886","0.0962","","","","","","1.023","","","","has coordinates","181760","2020-10-21","18:00:00",""
"7055275","8.352","0.006","8.874","0.006","13.617","0.009","79.406","0.007","81.424","0.007","64.639","0.007","893.6","1.1","150.15","","150.15","","","","","","","","","5","P -1","-P 1","2","","N'-(2-oxo-1-pentylindolin-3-ylidene)pyrrolidine-1-carbothiohydrazide","","- C18 H24 N4 O S -","- C18 H24 N4 O S -","- C36 H48 N8 O2 S2 -","2","1","","Muralisankar, Mathiyan; Bhuvanesh, Nattamai S. P.; Sreekanth, Anandaram","Synthesis, X-ray crystal structure, DNA/protein binding and DNA cleavage studies of novel copper(ii) complexes of N-substituted isatin thiosemicarbazone ligands","New J. Chem.","2016","40","3","2661","","10.1039/C5NJ02806J","","","0.71073","MoKα","","0.0731","0.0501","","","0.1176","0.1284","","","","","","1.062","","","","has coordinates","181760","2020-10-21","18:00:00",""
"7055276","21.496","0.008","9.118","0.003","15.908","0.005","90","","108.156","0.006","90","","2962.7","1.7","110.15","","110.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N'-(2-oxo-1-(prop-2-yn-1-yl)indolin-3-ylidene)pyrrolidine-1-carbothiohydrazide","","- C16 H16 N4 O S -","- C16 H16 N4 O S -","- C128 H128 N32 O8 S8 -","8","1","","Muralisankar, Mathiyan; Bhuvanesh, Nattamai S. P.; Sreekanth, Anandaram","Synthesis, X-ray crystal structure, DNA/protein binding and DNA cleavage studies of novel copper(ii) complexes of N-substituted isatin thiosemicarbazone ligands","New J. Chem.","2016","40","3","2661","","10.1039/C5NJ02806J","","","0.71073","MoKα","","0.0345","0.0304","","","0.0748","0.0777","","","","","","1.023","","","","has coordinates","181760","2020-10-21","18:00:00",""
"7055277","8.984","0.003","9.757","0.004","10.524","0.004","105.822","0.004","98.341","0.004","108.844","0.004","812","0.5","150.15","","150.15","","","","","","","","","7","P -1","-P 1","2","","N'-(1-allyl-2-oxoindolin-3-ylidene)pyrrolidine-1-carbothiohydrazide) copper(II) complex","","- C16 H17 Cl Cu N4 O S -","- C16 H17 Cl Cu N4 O S -","- C32 H34 Cl2 Cu2 N8 O2 S2 -","2","1","","Muralisankar, Mathiyan; Bhuvanesh, Nattamai S. P.; Sreekanth, Anandaram","Synthesis, X-ray crystal structure, DNA/protein binding and DNA cleavage studies of novel copper(ii) complexes of N-substituted isatin thiosemicarbazone ligands","New J. Chem.","2016","40","3","2661","","10.1039/C5NJ02806J","","","0.71073","MoKα","","0.0382","0.0333","","","0.0879","0.0913","","","","","","1.063","","","","has coordinates","181760","2020-10-21","18:00:00",""
"7055278","6.7997","0.0005","9.5387","0.0008","24.3565","0.0019","90","","95.512","0.008","90","","1572.5","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Pyridazine hydrazine compound","","- C15 H18 Cl N5 O -","- C15 H18 Cl N5 O -","- C60 H72 Cl4 N20 O4 -","4","1","","Rafi, Ummer Muhammed; Mahendiran, Dharmasivam; Haleel, Azees Khan; Nankar, Rakesh Pandeet; Doble, Mukesh; Rahiman, Aziz Kalilur","New pyridazine-based binuclear nickel(ii), copper(ii) and zinc(ii) complexes as prospective anticancer agents","New J. Chem.","2016","40","3","2451","","10.1039/C5NJ02739J","","","0.71073","MoKα","","0.153","0.0873","","","0.1891","0.215","","","","","","1.085","","","","has coordinates","181766","2020-10-21","18:00:00",""
"7055279","14.964","0.008","24.495","0.014","15.987","0.009","90","","109.982","0.006","90","","5507","5","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C104 H100 F12 Ir4 N12 O16 S4 -","- C104 H100 F12 Ir4 N12 O16 S4 -","- C208 H200 F24 Ir8 N24 O32 S8 -","2","0.5","","Yu, Wei-Bin; He, Qing-Ya; Shi, Hua-Tian; Wei, Xianwen","Heterogeneous catalysis of water oxidation supported by a novel metallamacrocycle","New J. Chem.","2016","40","3","2354","","10.1039/C5NJ02931G","","","0.71073","MoKα","","0.1351","0.0832","","","0.2069","0.2374","","","","","","0.855","","","","has coordinates","181772","2020-10-21","18:00:00",""
"7055280","14.94","0.004","24.403","0.006","15.917","0.004","90","","109.611","0.003","90","","5466","2","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C104 H100 F12 N12 O16 Rh4 S4 -","- C104 H100 F12 N12 O16 Rh4 S4 -","- C208 H200 F24 N24 O32 Rh8 S8 -","2","0.5","","Yu, Wei-Bin; He, Qing-Ya; Shi, Hua-Tian; Wei, Xianwen","Heterogeneous catalysis of water oxidation supported by a novel metallamacrocycle","New J. Chem.","2016","40","3","2354","","10.1039/C5NJ02931G","","","0.71073","MoKα","","0.1206","0.072","","","0.1871","0.2075","","","","","","1.096","","","","has coordinates","181772","2020-10-21","18:00:00",""
"7055281","8.5367","0.0004","10.2206","0.0005","16.4268","0.0008","90","","93.899","0.001","90","","1429.92","0.12","270","","270","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.0581","0.0362","","","0.0845","0.0929","","","","","","1.034","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055282","8.5008","0.0003","10.1744","0.0004","16.3606","0.0006","90","","93.684","0.001","90","","1412.11","0.09","210","","210","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.0484","0.032","","","0.0767","0.0835","","","","","","1.044","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055283","8.429","0.0004","10.0626","0.0005","16.2671","0.0008","90","","93.402","0.001","90","","1377.31","0.12","180","","180","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.0507","0.0335","","","0.076","0.0824","","","","","","1.034","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055284","8.3913","0.0004","10.0025","0.0005","16.2339","0.0008","90","","93.321","0.001","90","","1360.29","0.12","165","","165","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.0469","0.0311","","","0.0697","0.0755","","","","","","1.022","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055285","8.377","0.0009","9.982","0.0011","16.1977","0.0017","90","","93.306","0.002","90","","1352.2","0.3","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.0413","0.0293","","","0.07","0.0752","","","","","","1.043","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055286","8.3636","0.0008","9.9597","0.001","16.1984","0.0016","90","","93.114","0.002","90","","1347.3","0.2","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.0463","0.0328","","","0.0762","0.0813","","","","","","1.04","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055287","8.3411","0.0004","9.9442","0.0005","16.1668","0.0008","90","","93.112","0.001","90","","1338.99","0.11","30","","30","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.051","0.0341","","","0.0797","0.0859","","","","","","1.04","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055288","8.4505","0.0004","10.1273","0.0005","16.3033","0.0008","90","","93.491","0.001","90","","1392.66","0.12","30","","30","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.71073","MoKα","K-L~3~","0.0388","0.0311","","","0.0727","0.0758","","","","","","1.049","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055289","8.552","0.003","10.236","0.006","16.444","0.006","90","","93.978","0.011","90","","1436","1.1","296.15","0.02","296.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole)-bis(isothiocyanato)-iron(II)","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.56086","AgKα","","0.0616","0.043","","","0.0987","0.1098","","","","","","1.13","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055290","8.484","0.002","10.159","0.005","16.253","0.005","90","","93.894","0.012","90","","1397.6","0.9","296","2","296.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole)-bis(isothiocyanato)-iron(II)","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.56086","AgKα","","0.0428","0.0277","","","0.0561","0.062","","","","","","1.055","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055291","8.344","0.0015","9.955","0.003","15.96","0.003","90","","93.414","0.007","90","","1323.4","0.5","296","2","296.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","bis(4-amino-3,5-bis(pyridin-2-yl)-1,2,4-triazole)-bis(isothiocyanato)-iron(II)","","- C26 H20 Fe N14 S2 -","- C26 H20 Fe N14 S2 -","- C52 H40 Fe2 N28 S4 -","2","0.5","","Mason, Helen E.; Li, Wei; Carpenter, Michael A.; Hamilton, Michelle L.; Howard, Judith A. K.; Sparkes, Hazel A.","Structural and spectroscopic characterisation of the spin crossover in [Fe(abpt)2(NCS)2] polymorph A","New J. Chem.","2016","40","3","2466","","10.1039/C5NJ02359A","","x-ray","0.56086","AgKα","","0.031","0.0229","","","0.0492","0.053","","","","","","1.052","","","","has coordinates","181752","2020-10-21","18:00:00",""
"7055292","8.908","0.0008","10.6498","0.001","14.862","0.0015","90","","96.901","0.002","90","","1399.7","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 Cl2 Co N8 -","- C30 H24 Cl2 Co N8 -","- C60 H48 Cl4 Co2 N16 -","2","0.5","","Santos, Carina; Gómez, Margarita; Álvarez, Eleuterio; Ngoune, Jean; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio","Group 9 and 10 complexes with the bidentate di(1H-indazol-1-yl)methane and di(2H-indazol-2-yl)methane ligands: synthesis and structural characterization","New J. Chem.","2016","40","7","5695","","10.1039/C5NJ03135D","","","0.71073","MoKα","","0.0441","0.0342","","","0.0838","0.0892","","","","","","1.038","","","","has coordinates","185565","2020-10-21","18:00:00",""
"7055293","8.348","0.001","10.8244","0.0013","12.3168","0.0015","71.218","0.003","74.121","0.003","68.217","0.003","963.3","0.2","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H20 Cl2 Co N4 O4 -","- C15 H20 Cl2 Co N4 O4 -","- C30 H40 Cl4 Co2 N8 O8 -","2","1","","Santos, Carina; Gómez, Margarita; Álvarez, Eleuterio; Ngoune, Jean; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio","Group 9 and 10 complexes with the bidentate di(1H-indazol-1-yl)methane and di(2H-indazol-2-yl)methane ligands: synthesis and structural characterization","New J. Chem.","2016","40","7","5695","","10.1039/C5NJ03135D","","","0.71073","MoKα","","0.0637","0.0441","","","0.1111","0.1195","","","","","","1.032","","","","has coordinates","185565","2020-10-21","18:00:00",""
"7055294","8.933","0.002","10.599","0.002","14.768","0.003","90","","96.79","0.011","90","","1388.4","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H24 Cl2 N8 Ni -","- C30 H24 Cl2 N8 Ni -","- C60 H48 Cl4 N16 Ni2 -","2","0.5","","Santos, Carina; Gómez, Margarita; Álvarez, Eleuterio; Ngoune, Jean; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio","Group 9 and 10 complexes with the bidentate di(1H-indazol-1-yl)methane and di(2H-indazol-2-yl)methane ligands: synthesis and structural characterization","New J. Chem.","2016","40","7","5695","","10.1039/C5NJ03135D","","","0.71073","MoKα","","0.1266","0.0567","","","0.1172","0.1338","","","","","","0.921","","","","has coordinates","185565","2020-10-21","18:00:00",""
"7055295","29.0224","0.0014","12.4346","0.0008","21.629","0.002","90","","124.944","0.002","90","","6398.3","0.8","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Cl2 N8 Pd -","- C30 H24 Cl2 N8 Pd -","- C240 H192 Cl16 N64 Pd8 -","8","1","","Santos, Carina; Gómez, Margarita; Álvarez, Eleuterio; Ngoune, Jean; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio","Group 9 and 10 complexes with the bidentate di(1H-indazol-1-yl)methane and di(2H-indazol-2-yl)methane ligands: synthesis and structural characterization","New J. Chem.","2016","40","7","5695","","10.1039/C5NJ03135D","","","0.71073","MoKα","","0.0656","0.049","","","0.1261","0.1329","","","","","","1.079","","","","has coordinates","185565","2020-10-21","18:00:00",""
"7055296","10.034","0.003","10.625","0.003","10.67","0.003","85.207","0.009","76.725","0.01","89.439","0.009","1103.2","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H18 N4 O4 Pd -","- C19 H18 N4 O4 Pd -","- C38 H36 N8 O8 Pd2 -","2","1","","Santos, Carina; Gómez, Margarita; Álvarez, Eleuterio; Ngoune, Jean; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio","Group 9 and 10 complexes with the bidentate di(1H-indazol-1-yl)methane and di(2H-indazol-2-yl)methane ligands: synthesis and structural characterization","New J. Chem.","2016","40","7","5695","","10.1039/C5NJ03135D","","","0.71073","MoKα","","0.0452","0.0382","","","0.0978","0.1001","","","","","","1.057","","","","has coordinates","185565","2020-10-21","18:00:00",""
"7055297","8.8396","0.0004","10.93","0.0006","11.5282","0.0006","111.805","0.001","97.545","0.001","96.291","0.001","1009.89","0.09","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H20 N4 O5 Pd -","- C19 H20 N4 O5 Pd -","- C38 H40 N8 O10 Pd2 -","2","1","","Santos, Carina; Gómez, Margarita; Álvarez, Eleuterio; Ngoune, Jean; Marchetti, Fabio; Pettinari, Riccardo; Pettinari, Claudio","Group 9 and 10 complexes with the bidentate di(1H-indazol-1-yl)methane and di(2H-indazol-2-yl)methane ligands: synthesis and structural characterization","New J. Chem.","2016","40","7","5695","","10.1039/C5NJ03135D","","","0.71073","MoKα","","0.0264","0.0227","","","0.059","0.0609","","","","","","1.05","","","","has coordinates","185565","2020-10-21","18:00:00",""
"7055298","6.9512","0.0004","29.5028","0.0018","7.4215","0.0005","90","","108.876","0.006","90","","1440.15","0.16","120","0.1","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H14 N2 O2 -","- C18 H14 N2 O2 -","- C72 H56 N8 O8 -","4","1","","Yousef Ebrahimipour, S.; Sheikhshoaie, Iran; Simpson, Jim; Ebrahimnejad, Hadi; Dusek, Michal; Kharazmi, Nima; Eigner, Vaclav","Antimicrobial activity of aroylhydrazone-based oxido vanadium(v) complexes: in vitro and in silico studies","New J. Chem.","2016","40","3","2401","","10.1039/C5NJ02594J","","x-ray","1.54184","CuKα","","0.0428","0.0356","","","0.0953","0.1035","","","","1.24","1.24","1.21","","","","has coordinates","181762","2020-10-21","18:00:00",""
"7055299","17.8457","0.0018","5.9203","0.0005","18.1622","0.0013","90","","110.679","0.008","90","","1795.2","0.3","120","0.1","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17 N2 O4 V -","- C20 H17 N2 O4 V -","- C80 H68 N8 O16 V4 -","4","1","","Yousef Ebrahimipour, S.; Sheikhshoaie, Iran; Simpson, Jim; Ebrahimnejad, Hadi; Dusek, Michal; Kharazmi, Nima; Eigner, Vaclav","Antimicrobial activity of aroylhydrazone-based oxido vanadium(v) complexes: in vitro and in silico studies","New J. Chem.","2016","40","3","2401","","10.1039/C5NJ02594J","","x-ray","1.54184","CuKα","","0.07","0.051","","","0.1177","0.132","","","","1.35","1.35","1.28","","","","has coordinates","181762","2020-10-21","18:00:00",""
"7055300","34.6714","0.0016","6.0918","0.0003","17.8955","0.0005","90","","97.143","0.003","90","","3750.4","0.3","120","0.1","120","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C21 H19 N2 O4 V -","- C21 H19 N2 O4 V -","- C168 H152 N16 O32 V8 -","8","1","","Yousef Ebrahimipour, S.; Sheikhshoaie, Iran; Simpson, Jim; Ebrahimnejad, Hadi; Dusek, Michal; Kharazmi, Nima; Eigner, Vaclav","Antimicrobial activity of aroylhydrazone-based oxido vanadium(v) complexes: in vitro and in silico studies","New J. Chem.","2016","40","3","2401","","10.1039/C5NJ02594J","","x-ray","1.54184","CuKα","","0.0592","0.0385","","","0.0887","0.1001","","","","1.2","1.2","1.14","","","","has coordinates","181762","2020-10-21","18:00:00",""
"7055301","12.797","0.0008","7.84","0.0004","19.3207","0.0013","90","","104.308","0.005","90","","1878.3","0.2","121","2","121","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N2 O5 V -","- C20 H19 N2 O5 V -","- C80 H76 N8 O20 V4 -","4","1","","Yousef Ebrahimipour, S.; Sheikhshoaie, Iran; Simpson, Jim; Ebrahimnejad, Hadi; Dusek, Michal; Kharazmi, Nima; Eigner, Vaclav","Antimicrobial activity of aroylhydrazone-based oxido vanadium(v) complexes: in vitro and in silico studies","New J. Chem.","2016","40","3","2401","","10.1039/C5NJ02594J","","x-ray","0.71073","MoKα","","0.0378","0.0324","","","0.0969","0.1007","","","","1.88","1.88","1.83","","","","has coordinates","181762","2020-10-21","18:00:00",""
"7055302","11.2437","0.0005","15.033","0.0008","23.3412","0.0011","90","","90","","90","","3945.3","0.3","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C49 H39 N3 Pt -","- C49 H39 N3 Pt -","- C196 H156 N12 Pt4 -","4","1","","Zhang, Xiao-Peng; Liu, Fu-Qiang; Lai, Jian-Cheng; Li, Cheng-Hui; Li, Ai-Min; You, Xiao-Zeng","Novel redox responsive chiral cyclometalated platinum(ii) complexes with pinene functionalized C^N^N ligands","New J. Chem.","2016","40","3","2628","","10.1039/C5NJ02932E","","","0.71073","MoKα","","0.0283","0.0252","","","0.0624","0.0635","","","","","","1.042","","","","has coordinates,has disorder","181754","2020-10-21","18:00:00",""
"7055303","14.7779","0.0006","14.8743","0.0006","16.8574","0.0007","90","","90","","90","","3705.4","0.3","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C47 H36 N2 Pt -","- C47 H36 N2 Pt -","- C188 H144 N8 Pt4 -","4","1","","Zhang, Xiao-Peng; Liu, Fu-Qiang; Lai, Jian-Cheng; Li, Cheng-Hui; Li, Ai-Min; You, Xiao-Zeng","Novel redox responsive chiral cyclometalated platinum(ii) complexes with pinene functionalized C^N^N ligands","New J. Chem.","2016","40","3","2628","","10.1039/C5NJ02932E","","","0.71073","MoKα","","0.0312","0.0269","","","0.0666","0.0682","","","","","","1.006","","","","has coordinates","181754","2020-10-21","18:00:00",""
"7055304","6.2864","0.0016","6.4124","0.0016","17.4","0.004","91.512","0.004","95.518","0.004","96.508","0.004","693.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H38 N4 S4 Tl2 -","- C22 H38 N4 S4 Tl2 -","- C22 H38 N4 S4 Tl2 -","1","0.5","","Ramalingam, Kuppukkannu; Rizzoli, Corrado; Sivagurunathan, Gurunathan Senthilkumar","Mono and trivalent thallium‒sulfur interactions and their influence on the formation of nano thallium sulphide: single crystal X-ray structural and spectral studies on thallium(i)/(iii)‒cyclohexylpiperazine dithiocarbamates","New J. Chem.","2016","40","3","2489","","10.1039/C5NJ02980E","","","0.71073","MoKα","","0.0928","0.0751","","","0.2208","0.2309","","","","","","1.045","","","","has coordinates,has disorder","181768","2020-10-21","18:00:00",""
"7055305","10.218","0.003","14.477","0.004","16.718","0.004","77.688","0.004","75.525","0.004","88.076","0.005","2338.9","1.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H63 N6 S6 Tl -","- C39 H63 N6 S6 Tl -","- C78 H126 N12 S12 Tl2 -","2","1","","Ramalingam, Kuppukkannu; Rizzoli, Corrado; Sivagurunathan, Gurunathan Senthilkumar","Mono and trivalent thallium–sulfur interactions and their influence on the formation of nano thallium sulphide: single crystal X-ray structural and spectral studies on thallium(i)/(iii)–cyclohexylpiperazine dithiocarbamates","New J. Chem.","2016","40","3","2489","","10.1039/C5NJ02980E","","","0.71073","MoKα","","0.0784","0.0449","","","0.1095","0.1269","","","","","","0.952","","","","has coordinates,has disorder","288505","2023-12-22","15:12:03",""
"7055306","37.539","0.004","5.9129","0.0004","26.321","0.005","90","","121.1","0.02","90","","5002.6","1.6","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Potassium 2-{[(Z)-(2-hydroxy-3-methoxyphenyl)methylidene]amino}ethanesulfonate","","- C10 H12 K N O5 S -","- C10 H12 K N O5 S -","- C160 H192 K16 N16 O80 S16 -","16","2","","Pis Diez, Reinaldo; Echeverría, Gustavo A.; Piro, Oscar E.; Jios, Jorge Luis; Parajón Costa, Beatriz Susana","Structural, Spectroscopic and Theoretical Study of an o-vanillin Schiff base derivative involved in enol-imine and keto-amine tautomerism","New J. Chem.","2016","","","","","10.1039/C5NJ01039J","","","0.71073","MoKα","","0.0855","0.0499","","","0.1004","0.1191","","","","","","1.047","","","","has coordinates","187017","2020-10-21","18:00:00",""
"7055307","22.497","0.004","19.421","0.003","12.646","0.002","90","","90","","90","","5525.2","1.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C18 H18 Cd N4 O4 -","- C18 H18 Cd N4 O4 -","- C144 H144 Cd8 N32 O32 -","8","1","","Tomar, Kapil; Gupta, Anoop K.; Gupta, Mayank","Change in synthetic strategy for MOF fabrication: from 2D non-porous to 3D porous architecture and its sorption and emission property studies","New J. Chem.","2016","40","3","1953","","10.1039/C5NJ03044G","","","0.71073","MoKα","","0.0633","0.0485","","","0.1241","0.1295","","","","","","1.056","","","","has coordinates,has disorder","181755","2020-10-21","18:00:00",""
"7055308","11.616","0.004","11.825","0.004","36.389","0.011","90","","90","","90","","4998","3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C54 H42 N10 O8 Zn2 -","- C54 H42 N10 O8 Zn2 -","- C216 H168 N40 O32 Zn8 -","4","1","","Cheng, Hong-Jian; Shen, Ya-Li; Lu, Yi-Feng; Ma, Ji; Ji, Hong-Wei; Yin, Wen-Yu; Tang, Xiao-Yan; Ma, Yun-Sheng; Yuan, Rong-Xin","Alkyl group-directed assembly of coordination polymers based on bis-(4-imidazol-1-yl-phenyl)-amine and their photocatalytic properties","New J. Chem.","2016","40","3","2479","","10.1039/C5NJ02760H","","","0.71073","MoKα","","0.0674","0.0562","","","0.1393","0.1508","","","","","","1.073","","","","has coordinates","181763","2020-10-21","18:00:00",""
"7055309","16.404","0.004","11.977","0.003","20.202","0.005","90","","94.188","0.005","90","","3958.5","1.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H37 Cd2 N5 O13 -","- C36 H37 Cd2 N5 O13 -","- C144 H148 Cd8 N20 O52 -","4","1","","Cheng, Hong-Jian; Shen, Ya-Li; Lu, Yi-Feng; Ma, Ji; Ji, Hong-Wei; Yin, Wen-Yu; Tang, Xiao-Yan; Ma, Yun-Sheng; Yuan, Rong-Xin","Alkyl group-directed assembly of coordination polymers based on bis-(4-imidazol-1-yl-phenyl)-amine and their photocatalytic properties","New J. Chem.","2016","40","3","2479","","10.1039/C5NJ02760H","","","0.71073","MoKα","","0.0497","0.0367","","","0.1129","0.1403","","","","","","1.067","","","","has coordinates","181763","2020-10-21","18:00:00",""
"7055310","12.0219","0.0008","11.4303","0.0008","23.9587","0.0015","90","","116.82","0.003","90","","2938.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 N5 O6 Zn -","- C30 H31 N5 O6 Zn -","- C120 H124 N20 O24 Zn4 -","4","1","","Cheng, Hong-Jian; Shen, Ya-Li; Lu, Yi-Feng; Ma, Ji; Ji, Hong-Wei; Yin, Wen-Yu; Tang, Xiao-Yan; Ma, Yun-Sheng; Yuan, Rong-Xin","Alkyl group-directed assembly of coordination polymers based on bis-(4-imidazol-1-yl-phenyl)-amine and their photocatalytic properties","New J. Chem.","2016","40","3","2479","","10.1039/C5NJ02760H","","","0.71073","MoKα","","0.0694","0.0491","","","0.1402","0.1558","","","","","","1.036","","","","has coordinates,has disorder","181763","2020-10-21","18:00:00",""
"7055311","10.209","0.002","17.349","0.003","17.192","0.003","90","","96.73","0.03","90","","3024","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H29 Cd N5 O5 -","- C30 H29 Cd N5 O5 -","- C120 H116 Cd4 N20 O20 -","4","1","","Cheng, Hong-Jian; Shen, Ya-Li; Lu, Yi-Feng; Ma, Ji; Ji, Hong-Wei; Yin, Wen-Yu; Tang, Xiao-Yan; Ma, Yun-Sheng; Yuan, Rong-Xin","Alkyl group-directed assembly of coordination polymers based on bis-(4-imidazol-1-yl-phenyl)-amine and their photocatalytic properties","New J. Chem.","2016","40","3","2479","","10.1039/C5NJ02760H","","","0.71073","MoKα","","0.0744","0.0511","","","0.115","0.1239","","","","","","1.084","","","","has coordinates,has disorder","181763","2020-10-21","18:00:00",""
"7055312","11.84","0.005","10.52","0.005","23.1","0.005","90","0.005","96.951","0.005","90","0.005","2856.1","1.9","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 N4 O6 -","- C32 H30 N4 O6 -","- C128 H120 N16 O24 -","4","1","","Ghorai, Anupam; Mondal, Jahangir; Patra, Goutam K.","A new Schiff base and its metal complex as colorimetric and fluorescent‒colorimetric sensors for rapid detection of arginine","New J. Chem.","2016","40","9","7821","","10.1039/C5NJ02787J","","","0.71073","MoKα","","0.1756","0.0963","","","0.2211","0.286","","","","","","1.088","","","","has coordinates","186472","2020-10-21","18:00:00",""
"7055313","7.0612","0.0005","17.0603","0.0015","10.3203","0.001","90","","97.42","0.007","90","","1232.84","0.18","292.3","0.7","292.3","0.7","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H17 N3 O3 -","- C10 H17 N3 O3 -","- C40 H68 N12 O12 -","4","1","","Wei, Tai-Bao; Zhu, Yuan-Rong; Li, Hui; Yan, Guo-Tao; Lin, Qi; Yao, Hong; Zhang, You-Ming","A reversible fluorescent chemosensor for the rapid sensing of CN−in water: utilization of the intramolecular charge transfer blocking","New J. Chem.","2016","40","3","2327","","10.1039/C5NJ02413G","","","0.71073","MoKα","","0.0979","0.0629","","","0.1739","0.2025","","","","","","1.102","","","","has coordinates","181767","2020-10-21","18:00:00",""
"7055314","10.0792","0.0002","15.6628","0.0003","26.4166","0.0005","90","","90","","90","","4170.35","0.14","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C79 H18 P -","- C79 H18 P -","- C316 H72 P4 -","4","1","","Konarev, Dmitri V.; Khasanov, Salavat S.; Kuz`min, Alexey V.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","Effective magnetic coupling with strong spin frustration in (Ph3MeP+)(C60•) and reversible C60• dimerization in (Ph3MeP+)(C60•)C6H5CN . Effect of solvent on structure and properties","New J. Chem.","2016","","","","","10.1039/C5NJ02886H","","","0.71073","MoKα","","0.074","0.0571","","","0.1262","0.1423","","","","","","1.136","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7055315","12.576","0.0018","13.8505","0.0017","15.035","0.002","101.006","0.011","113.801","0.013","90.849","0.011","2339.7","0.6","120","2","120","2","","","","","","","no","4","P -1","-P 1","2","no","fullerene C60 salt with triphenylmethylphosphonium cations, benzonitrile solvate","","- C172 H46 N2 P2 -","- C172 H46 N2 P2 -","- C172 H46 N2 P2 -","1","0.5","","Konarev, Dmitri V.; Khasanov, Salavat S.; Kuz`min, Alexey V.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","Effective magnetic coupling with strong spin frustration in (Ph3MeP+)(C60•) and reversible C60• dimerization in (Ph3MeP+)(C60•)C6H5CN . Effect of solvent on structure and properties","New J. Chem.","2016","","","","","10.1039/C5NJ02886H","","","0.71073","MoKα","","0.1885","0.0719","","","0.1194","0.1662","","","","","","0.976","","","","has coordinates,has disorder","174601","2020-10-21","18:00:00",""
"7055316","12.725","0.003","13.759","0.002","15.056","0.002","100.102","0.015","112.513","0.018","90.15","0.015","2390.3","0.8","250.1","0.2","250.1","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C86 H23 N P -","- C86 H23 N P -","- C172 H46 N2 P2 -","2","1","","Konarev, Dmitri V.; Khasanov, Salavat S.; Kuz`min, Alexey V.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","Effective magnetic coupling with strong spin frustration in (Ph3MeP+)(C60•) and reversible C60• dimerization in (Ph3MeP+)(C60•)C6H5CN . Effect of solvent on structure and properties","New J. Chem.","2016","","","","","10.1039/C5NJ02886H","","","0.71073","MoKα","","0.2825","0.0801","","","0.1591","0.2423","","","","","","0.962","","","","has coordinates,has disorder","174601","2020-10-21","18:00:00",""
"7055317","29.4247","0.0016","5.29675","0.0003","7.49392","0.00045","90","","95.5986","0.0029","90","","1162.4","0.12","293","","293","","","","","","","","","5","C 1 2 1","C 2y","5","[Zn(Gly-L-Phe)2]","catena-(bis(glycyl-L-phenylalaninato))zinc(ii)","zinc(II) di(glycylphenylalaninate)","- C22 H26 N4 O6 Zn -","- C22 H26 N4 O6 Zn -","- C44 H52 N8 O12 Zn2 -","2","0.5","","Puškarić, Andreas; Halasz, Ivan; Gredičak, Matija; Palcic, Ana; Bronic, Josip","Synthesis and structure characterization of zinc and cadmium dipeptide coordination polymers","New J. Chem.","2016","","","","","10.1039/C5NJ03001C","powder diffraction","x-ray","1.5406","CuKα","","","","","","","","0.0303","","3.549","","","","","","","has coordinates","174602","2020-10-21","18:00:00",""
"7055318","30.4985","0.0018","5.34094","0.00039","7.63724","0.00045","90","","111.372","0.0027","90","","1158.49","0.13","293","","293","","","","","","","","","5","C 1 2 1","C 2y","5","[Cd(Gly-L-Phe)2]","catena-(bis(glycyl-L-phenylalaninato))cadmium(ii)","Cd(GlyPhe)2","- C22 H26 Cd N4 O6 -","- C22 H26 Cd N4 O6 -","- C44 H52 Cd2 N8 O12 -","2","0.5","","Puškarić, Andreas; Halasz, Ivan; Gredičak, Matija; Palcic, Ana; Bronic, Josip","Synthesis and structure characterization of zinc and cadmium dipeptide coordination polymers","New J. Chem.","2016","","","","","10.1039/C5NJ03001C","powder diffraction","x-ray","1.5406","CuKα","","0.0454","","","","","","","","4.561","","","","","","","has coordinates","174602","2020-10-21","18:00:00",""
"7055319","12.816","0.005","17.289","0.005","16.132","0.005","90","0.005","111.716","0.005","90","0.005","3320.8","1.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H40 Cu2 Mo8 N16 O26 -","- C48 H40 Cu2 Mo8 N16 O26 -","- C96 H80 Cu4 Mo16 N32 O52 -","2","0.5","","Sun, Wenlong; Yu, Jia; Pang, Haijun; Ma, Huiyuan; Zhao, Chunyan","“Pinwheel” Subunit-Directed A Polyoxometalate-Based Hybrid Compound [Cu(bimb)2]2[β-Mo8O26] with Both Helixes and Chiral Layers","New J. Chem.","2016","","","","","10.1039/C5NJ03183D","","","0.71069","MoKα","","0.0473","0.0311","","","0.0805","0.0881","","","","","","1.023","","","","has coordinates","174603","2020-10-21","18:00:00",""
"7055320","18.927","0.006","6.364","0.002","7.38","0.003","90","","93.784","0.008","90","","887","0.5","125","","125","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","AmPhOxam","N-phenyloxamic acid Ammonium Salt","","- C8 H10 N2 O3 -","- C8 H10 N2 O3 -","- C32 H40 N8 O12 -","4","1","","Maiore, Laura; Aragoni, Maria Carla; Carcangiu, Gianfranco; Cocco, Ombretta; Isaia, Francesco; Lippolis, Vito; Meloni, Paola; Murru, Arianna; Slawin, Alexandra; Tuveri, Enrica; Woollins, J. D.; Arca, Massimiliano","Oxamate salts as novel agents for the restoration of marble and limestone substrates: case study of ammonium N-phenyloxamate","New J. Chem.","2016","","","","","10.1039/C5NJ02505B","","","1.54187","CuKα","","0.1578","0.1491","","","0.4027","0.4063","","","","","","1.26","","","","has coordinates","174604","2020-10-21","18:00:00",""
"7055321","18.1249","0.0007","12.1064","0.0005","17.7333","0.0007","90","","107.301","0.001","90","","3715.1","0.3","293","2","293.2","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C56 H75 Co6 N5 Na2 O39 -","- C56 H75 Co6 N5 Na2 O39 -","- C112 H150 Co12 N10 Na4 O78 -","2","0.5","","Liu, Sui-Jun; Han, Song-De; Chang, Ze; Bu, Xian-He","Cluster- and chain-based magnetic MOFs derived from 3d metal ions and 1,3,5-benzenetricarboxylate","New J. Chem.","2016","40","3","2680","","10.1039/C5NJ02161H","","","0.71075","MoKα","","0.0902","0.074","","","0.1756","0.188","","","","","","1.073","","","","has coordinates,has disorder","181775","2020-10-21","18:00:00",""
"7055322","9.787","0.002","12.157","0.002","15.182","0.003","90","","90","","90","","1806.4","0.6","293","2","293","","","","","","","","","4","I m m 2","I 2 -2","44","","","","- C18 H12 Ni3 O16 -","- C18 H12 Ni3 O16 -","- C36 H24 Ni6 O32 -","2","0.25","","Liu, Sui-Jun; Han, Song-De; Chang, Ze; Bu, Xian-He","Cluster- and chain-based magnetic MOFs derived from 3d metal ions and 1,3,5-benzenetricarboxylate","New J. Chem.","2016","40","3","2680","","10.1039/C5NJ02161H","","","0.71073","MoKα","","0.034","0.0323","","","0.0762","0.0769","","","","","","1.118","","","","has coordinates","181775","2020-10-21","18:00:00",""
"7055323","12.692","0.003","14.424","0.003","21.492","0.004","90","","90","","90","","3934.5","1.4","293","2","293","","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C22 H12 Mn3 O16 -","- C22 H12 Mn3 O16 -","- C88 H48 Mn12 O64 -","4","0.5","","Liu, Sui-Jun; Han, Song-De; Chang, Ze; Bu, Xian-He","Cluster- and chain-based magnetic MOFs derived from 3d metal ions and 1,3,5-benzenetricarboxylate","New J. Chem.","2016","40","3","2680","","10.1039/C5NJ02161H","","","0.71073","MoKα","","0.1111","0.0852","","","0.173","0.1845","","","","","","1.151","","","","has coordinates,has disorder","181775","2020-10-21","18:00:00",""
"7055324","12.2394","0.0007","18.8894","0.0011","13.5842","0.0008","90","","92.6687","0.0018","90","","3137.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,7-Bis(4-methoxycarbonylphenyl)-9,9-diphenyl-9,10-dihydroacridine)","","- C41 H31 N O4 -","- C41 H31 N O4 -","- C164 H124 N4 O16 -","4","1","","Suzuki, Ryota; Tada, Reiki; Hosoda, Takumi; Miura, Youhei; Yoshioka, Naoki","Synthesis of ester-substituted dihydroacridine derivatives and their spectroscopic properties","New J. Chem.","2016","","","","","10.1039/C5NJ02839F","","","0.71073","MoKα","","0.0829","0.0458","","","0.135","0.1714","","","","","","1.035","","","","has coordinates","174672","2020-10-21","18:00:00",""
"7055325","35.973","0.009","9.0438","0.0019","21.966","0.006","90","","99.707","0.008","90","","7044","3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,8-Bis(4-methoxycarbonylphenyl)-10,10-diphenyl-5,10-dihydrophenazasiline","","- C42 H34 N2 O4 Si -","- C42 H34 N2 O4 Si -","- C336 H272 N16 O32 Si8 -","8","2","","Suzuki, Ryota; Tada, Reiki; Hosoda, Takumi; Miura, Youhei; Yoshioka, Naoki","Synthesis of ester-substituted dihydroacridine derivatives and their spectroscopic properties","New J. Chem.","2016","","","","","10.1039/C5NJ02839F","","","0.71073","MoKα","","0.2164","0.0745","","","0.1541","0.2138","","","","","","0.955","","","","has coordinates","174672","2020-10-21","18:00:00",""
"7055326","21.655","0.005","12.281","0.003","16.381","0.007","90","","120.371","0.006","90","","3759","2","223","2","223","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H113 Dy N24 O52 -","- C42 H50 Dy N24 O26 -","- C84 H100 Dy2 N48 O52 -","2","0.25","","Zhu, Qian-Jiang; Zhao, Wen-Xuan; Wang, Chuan-Zeng; Zhang, Ying; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Clegg, Jack Kay; Lindoy, Lenard F.; Wei, Gang","Adducts of Aqua Complexes of Ln3+ with hexanohydroxyhexanomethylcucurbit[6]uril: Potential Application in the Isolation of Heavy Lanthanides","New J. Chem.","2016","","","","","10.1039/C5NJ00964B","","","0.71073","MoKα","","0.0929","0.0905","","","0.2459","0.2489","","","","","","1.068","","","","has coordinates","174673","2020-10-21","18:00:00",""
"7055327","21.6886","0.0018","12.2264","0.001","16.42","0.002","90","","119.896","0.002","90","","3774.7","0.6","223","2","223","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H111 Er N24 O51 -","- C42 H47 Er N24 O26 -","- C84 H94 Er2 N48 O52 -","2","0.25","","Zhu, Qian-Jiang; Zhao, Wen-Xuan; Wang, Chuan-Zeng; Zhang, Ying; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Clegg, Jack Kay; Lindoy, Lenard F.; Wei, Gang","Adducts of Aqua Complexes of Ln3+ with hexanohydroxyhexanomethylcucurbit[6]uril: Potential Application in the Isolation of Heavy Lanthanides","New J. Chem.","2016","","","","","10.1039/C5NJ00964B","","","0.71073","MoKα","","0.0733","0.0689","","","0.1809","0.1848","","","","","","1.159","","","","has coordinates","174673","2020-10-21","18:00:00",""
"7055328","21.792","0.003","12.2562","0.0015","16.386","0.002","90","","120.021","0.004","90","","3789.3","0.9","223","2","223","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H111 Ho N24 O51 -","- C42 H48 Ho N24 O26 -","- C84 H96 Ho2 N48 O52 -","2","0.25","","Zhu, Qian-Jiang; Zhao, Wen-Xuan; Wang, Chuan-Zeng; Zhang, Ying; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Clegg, Jack Kay; Lindoy, Lenard F.; Wei, Gang","Adducts of Aqua Complexes of Ln3+ with hexanohydroxyhexanomethylcucurbit[6]uril: Potential Application in the Isolation of Heavy Lanthanides","New J. Chem.","2016","","","","","10.1039/C5NJ00964B","","","0.71073","MoKα","","0.0769","0.0578","","","0.1346","0.1429","","","","","","1.009","","","","has coordinates","174673","2020-10-21","18:00:00",""
"7055329","21.7182","0.0017","12.1691","0.0009","16.4253","0.0012","90","","120.018","0.002","90","","3758.8","0.5","223","2","223","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H107 Lu N24 O49 -","- C42 H50 Lu N24 O25 -","- C84 H100 Lu2 N48 O50 -","2","0.25","","Zhu, Qian-Jiang; Zhao, Wen-Xuan; Wang, Chuan-Zeng; Zhang, Ying; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Clegg, Jack Kay; Lindoy, Lenard F.; Wei, Gang","Adducts of Aqua Complexes of Ln3+ with hexanohydroxyhexanomethylcucurbit[6]uril: Potential Application in the Isolation of Heavy Lanthanides","New J. Chem.","2016","","","","","10.1039/C5NJ00964B","","","0.71073","MoKα","","0.0517","0.0493","","","0.1364","0.1399","","","","","","1.058","","","","has coordinates","174673","2020-10-21","18:00:00",""
"7055330","21.629","0.002","12.2839","0.0012","16.3898","0.0017","90","","119.976","0.003","90","","3772.1","0.7","223","2","223","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H115 N24 O53 Tb -","- C42 H48 N24 O26 Tb -","- C84 H96 N48 O52 Tb2 -","2","0.25","","Zhu, Qian-Jiang; Zhao, Wen-Xuan; Wang, Chuan-Zeng; Zhang, Ying; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Clegg, Jack Kay; Lindoy, Lenard F.; Wei, Gang","Adducts of Aqua Complexes of Ln3+ with hexanohydroxyhexanomethylcucurbit[6]uril: Potential Application in the Isolation of Heavy Lanthanides","New J. Chem.","2016","","","","","10.1039/C5NJ00964B","","","0.71073","MoKα","","0.0915","0.0848","","","0.2266","0.2366","","","","","","1.107","","","","has coordinates","174673","2020-10-21","18:00:00",""
"7055331","21.734","0.002","12.211","0.0012","16.448","0.003","90","","119.884","0.003","90","","3784.8","0.9","223","2","223","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H118 N24 O53 Tm -","- C42 H52 N24 O26 Tm -","- C84 H104 N48 O52 Tm2 -","2","0.25","","Zhu, Qian-Jiang; Zhao, Wen-Xuan; Wang, Chuan-Zeng; Zhang, Ying; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Clegg, Jack Kay; Lindoy, Lenard F.; Wei, Gang","Adducts of Aqua Complexes of Ln3+ with hexanohydroxyhexanomethylcucurbit[6]uril: Potential Application in the Isolation of Heavy Lanthanides","New J. Chem.","2016","","","","","10.1039/C5NJ00964B","","","0.71073","MoKα","","0.0982","0.0935","","","0.2492","0.2556","","","","","","1.214","","","","has coordinates","174673","2020-10-21","18:00:00",""
"7055332","21.793","0.0013","12.1907","0.0007","16.4222","0.0009","90","","120.043","0.002","90","","3776.8","0.4","223","2","223","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C42 H111 N24 O51 Yb -","- C42 H50 N24 O26 Yb -","- C84 H100 N48 O52 Yb2 -","2","0.25","","Zhu, Qian-Jiang; Zhao, Wen-Xuan; Wang, Chuan-Zeng; Zhang, Ying; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Clegg, Jack Kay; Lindoy, Lenard F.; Wei, Gang","Adducts of Aqua Complexes of Ln3+ with hexanohydroxyhexanomethylcucurbit[6]uril: Potential Application in the Isolation of Heavy Lanthanides","New J. Chem.","2016","","","","","10.1039/C5NJ00964B","","","0.71073","MoKα","","0.0538","0.0488","","","0.1301","0.1341","","","","","","1.1","","","","has coordinates","174673","2020-10-21","18:00:00",""
"7055333","15.3861","0.0012","7.2041","0.0007","15.4751","0.0012","90","","117.318","0.004","90","","1524","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H10 F N7 O -","- C15 H10 F N7 O -","- C60 H40 F4 N28 O4 -","4","1","","Nandeesh, K. N.; Ashok, Hassasn Swarup; Sandhya, Nagarakere C.; Mohan, Chakrabhavi Dhananjaya; Pavankumar, C. S.; Kempegowda, Mantelingu; Kumara, M. N.; Ananda, S.; Rangappa, Kanchugarakoppal S.","Synthesis and Antiproliferative efficiency of novel bis(imidazol-1-yl)vinyl-1,2,4-oxadiazoles","New J. Chem.","2016","","","","","10.1039/C5NJ02925B","","","1.54178","CuKα","","0.067","0.0473","","","0.113","0.1219","","","","","","0.943","","","","has coordinates","175058","2020-10-21","18:00:00",""
"7055334","10.1629","0.0003","10.3262","0.0003","10.3488","0.0003","109.48","0.0008","116.368","0.0008","102.253","0.0009","829.7","0.04","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H13 I N5 Na S -","- C14 H13 I N5 Na S -","- C28 H26 I2 N10 Na2 S2 -","2","1","","Kleisath, Elizabeth; Yutronkie, Nathan J.; Korobkov, Ilia; Gabidullin, Bulat M.; Brusso, Jaclyn L.","Alkyl-functionalization of 3,5-bis(2-pyridyl)-1,2,4,6-thiatriazine","New J. Chem.","2016","40","5","4472","","10.1039/C5NJ02611C","","","0.71073","MoKα","","0.0176","0.0167","","","0.0434","0.0439","","","","","","1.035","","","","has coordinates","183742","2020-10-21","18:00:00",""
"7055335","9.9995","0.0002","10.0313","0.0002","16.1233","0.0004","90","","90","","90","","1617.3","0.06","200","2","200","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 B F4 N5 S -","- C14 H14 B F4 N5 S -","- C56 H56 B4 F16 N20 S4 -","4","1","","Kleisath, Elizabeth; Yutronkie, Nathan J.; Korobkov, Ilia; Gabidullin, Bulat M.; Brusso, Jaclyn L.","Alkyl-functionalization of 3,5-bis(2-pyridyl)-1,2,4,6-thiatriazine","New J. Chem.","2016","40","5","4472","","10.1039/C5NJ02611C","","","0.71073","MoKα","","0.0445","0.0424","","","0.1191","0.1211","","","","","","1.046","","","","has coordinates","183742","2020-10-21","18:00:00",""
"7055336","8.938","0.004","11.927","0.005","12.9","0.005","96.902","0.019","108.004","0.018","107.987","0.017","1208.1","0.9","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H17 F6 N5 O6 S3 -","- C17.0002 H17 F6.0006 N5 O6.0006 S3.0002 -","- C34.0004 H34 F12.0012 N10 O12.0012 S6.0004 -","2","1","","Kleisath, Elizabeth; Yutronkie, Nathan J.; Korobkov, Ilia; Gabidullin, Bulat M.; Brusso, Jaclyn L.","Alkyl-functionalization of 3,5-bis(2-pyridyl)-1,2,4,6-thiatriazine","New J. Chem.","2016","40","5","4472","","10.1039/C5NJ02611C","","","0.71073","MoKα","","0.0685","0.0485","","","0.1266","0.1422","","","","","","1.026","","","","has coordinates,has disorder","183742","2020-10-21","18:00:00",""
"7055337","5.799","0.003","14.641","0.009","16.056","0.01","90","","90","","90","","1363.2","1.4","258","2","258","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H13 N5 S -","- C14 H13 N5 S -","- C56 H52 N20 S4 -","4","1","","Kleisath, Elizabeth; Yutronkie, Nathan J.; Korobkov, Ilia; Gabidullin, Bulat M.; Brusso, Jaclyn L.","Alkyl-functionalization of 3,5-bis(2-pyridyl)-1,2,4,6-thiatriazine","New J. Chem.","2016","40","5","4472","","10.1039/C5NJ02611C","","","0.71073","MoKα","","0.0608","0.0419","","","0.0933","0.0997","","","","","","1.066","","","","has coordinates","183742","2020-10-21","18:00:00",""
"7055338","27.2998","0.0016","10.028","0.0006","20.6463","0.0011","90","","111.911","0.004","90","","5243.9","0.5","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C52 H80 N6 S2 -","- C52 H80 N6 S2 -","- C208 H320 N24 S8 -","4","0.5","","Gressenbuch, Mathias; Lehmann, Ulrike; Kersting, Berthold","Synthesis and structural chemistry of bicyclic hexaaza-dithia macrocycles containing pendant donor groups","New J. Chem.","2016","40","7","5731","","10.1039/C5NJ03197D","","","0.71073","MoKα","","0.0716","0.0513","","","0.1393","0.1489","","","","","","1.085","","","","has coordinates,has disorder","185600","2020-10-21","18:00:00",""
"7055339","19.481","0.004","9.905","0.002","26.74","0.005","90","","99.08","0.03","90","","5095.1","1.8","213","2","213","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C52 H74 N12 S2 -","- C52 H74 N12 S2 -","- C208 H296 N48 S8 -","4","0.5","","Gressenbuch, Mathias; Lehmann, Ulrike; Kersting, Berthold","Synthesis and structural chemistry of bicyclic hexaaza-dithia macrocycles containing pendant donor groups","New J. Chem.","2016","40","7","5731","","10.1039/C5NJ03197D","","","0.71073","MoKα","","0.0618","0.0427","","","0.1029","0.1078","","","","","","0.889","","","","has coordinates","185600","2020-10-21","18:00:00",""
"7055340","12.894","0.002","13.432","0.002","20.463","0.003","91.86","0.02","100.24","0.02","106.8","0.02","3325.5","1","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H92 N6 O14 S4 -","- C56 H92 N6 O14 S4 -","- C112 H184 N12 O28 S8 -","2","1","","Gressenbuch, Mathias; Lehmann, Ulrike; Kersting, Berthold","Synthesis and structural chemistry of bicyclic hexaaza-dithia macrocycles containing pendant donor groups","New J. Chem.","2016","40","7","5731","","10.1039/C5NJ03197D","","","0.71073","MoKα","","0.0951","0.0506","","","0.1019","0.1127","","","","","","0.865","","","","has coordinates","185600","2020-10-21","18:00:00",""
"7055341","18.934","0.003","10.294","0.003","31.857","0.005","90","","105.36","0.02","90","","5987","2","180","2","180","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C48 H76 N6 O8 S2 -","- C48 H76 N6 O8 S2 -","- C192 H304 N24 O32 S8 -","4","0.5","","Gressenbuch, Mathias; Lehmann, Ulrike; Kersting, Berthold","Synthesis and structural chemistry of bicyclic hexaaza-dithia macrocycles containing pendant donor groups","New J. Chem.","2016","40","7","5731","","10.1039/C5NJ03197D","","","0.71073","MoKα","","0.0566","0.0458","","","0.1321","0.1387","","","","","","0.792","","","","has coordinates","185600","2020-10-21","18:00:00",""
"7055342","27.58","0.004","9.948","0.002","19.845","0.003","90","","109.5","0.02","90","","5132.5","1.6","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H84 N6 O4 S2 -","- C48.01 H84 N6 O4 S2 -","- C192.04 H336 N24 O16 S8 -","4","0.5","","Gressenbuch, Mathias; Lehmann, Ulrike; Kersting, Berthold","Synthesis and structural chemistry of bicyclic hexaaza-dithia macrocycles containing pendant donor groups","New J. Chem.","2016","40","7","5731","","10.1039/C5NJ03197D","","","0.71073","MoKα","","0.0875","0.0677","","","0.2012","0.2136","","","","","","0.987","","","","has coordinates,has disorder","185600","2020-10-21","18:00:00",""
"7055343","13.007","0.003","10.269","0.002","19.285","0.004","90","","97.5","0.03","90","","2553.8","1","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H80 N6 O4 S2 -","- C48 H80 N6 O4 S2 -","- C96 H160 N12 O8 S4 -","2","0.5","","Gressenbuch, Mathias; Lehmann, Ulrike; Kersting, Berthold","Synthesis and structural chemistry of bicyclic hexaaza-dithia macrocycles containing pendant donor groups","New J. Chem.","2016","40","7","5731","","10.1039/C5NJ03197D","","","0.71073","MoKα","","0.1038","0.036","","","0.0446","0.0519","","","","","","0.554","","","","has coordinates","185600","2020-10-21","18:00:00",""
"7055344","30.1303","0.0007","9.2069","0.0002","14.6698","0.0002","90","","90","","90","","4069.5","0.14","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C17 H17 I2 N3 O Pt -","- C17 H17 I2 N3 O Pt -","- C136 H136 I16 N24 O8 Pt8 -","8","1","","Borré, Etienne; Dahm, Georges; Guichard, Gilles; Bellemin-Laponnaz, Stéphane","Post-functionalization of platinum‒NHC complexes by oxime ligation for ligand targeted therapy","New J. Chem.","2016","40","4","3164","","10.1039/C5NJ03104D","","","0.71073","MoKα","","0.0463","0.0316","","","0.076","0.0899","","","","","","1.134","","","","has coordinates","182771","2020-10-21","18:00:00",""
"7055345","8.788","0.0004","13.2107","0.0005","15.6462","0.0006","112.549","0.002","91.335","0.002","104.644","0.002","1608.33","0.12","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H36 I2 N4 O Pt -","- C33 H36 I2 N4 O Pt -","- C66 H72 I4 N8 O2 Pt2 -","2","1","","Borré, Etienne; Dahm, Georges; Guichard, Gilles; Bellemin-Laponnaz, Stéphane","Post-functionalization of platinum‒NHC complexes by oxime ligation for ligand targeted therapy","New J. Chem.","2016","40","4","3164","","10.1039/C5NJ03104D","","","0.71073","MoKα","","0.054","0.039","","","0.1005","0.1173","","","","","","1.084","","","","has coordinates","182771","2020-10-21","18:00:00",""
"7055346","13.1253","0.0014","30.475","0.003","11.2124","0.0014","90","","107.676","0.007","90","","4273.2","0.8","90","0.5","90","0.5","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H34 Cl3 N9 O Zn -","- C50 H34 Cl3 N9 O Zn -","- C200 H136 Cl12 N36 O4 Zn4 -","4","1","","Mandoj, Federica; D'Urso, Alessandro; Nardis, Sara; Monti, Donato; Stefanelli, Manuela; Gangemi, Chiara M. A.; Randazzo, Rosalba; Fronczek, Frank R.; Smith, Kevin M.; Paolesse, Roberto","The interaction of a β-fused isoindoline‒porphyrin conjugate with nucleic acids","New J. Chem.","2016","40","7","5662","","10.1039/C5NJ03201F","","","1.54184","CuKα","","0.0434","0.0398","","","0.1071","0.11","","","","","","1.028","","","","has coordinates","185596","2020-10-21","18:00:00",""
"7055347","21.798","0.003","9.7924","0.0009","17.18","0.003","90","","111.803","0.018","90","","3404.8","0.9","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H28 Cl2 Cu2 N6 O2 -","- C38 H28 Cl2 Cu2 N6 O2 -","- C152 H112 Cl8 Cu8 N24 O8 -","4","0.5","","Patra, Shanti G.; Shee, Nirmal K.; Drew, Michael G. B.; Datta, Dipankar","Angle isomerism, as exemplified in a five-coordinate, dimeric copper(ii) Schiff base complex. Observation of Ostwald ripening","New J. Chem.","2016","40","4","3238","","10.1039/C5NJ02765A","","","0.71073","MoKα","","0.0788","0.0619","","","0.1515","0.1635","","","","","","1.041","","","","has coordinates","182773","2020-10-21","18:00:00",""
"7055348","7.1801","0.0006","10.2796","0.0007","12.3788","0.0008","99.208","0.006","95.428","0.006","108.174","0.007","846.66","0.12","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H28 Cl2 Cu2 N6 O2 -","- C38 H28 Cl2 Cu2 N6 O2 -","- C38 H28 Cl2 Cu2 N6 O2 -","1","0.5","","Patra, Shanti G.; Shee, Nirmal K.; Drew, Michael G. B.; Datta, Dipankar","Angle isomerism, as exemplified in a five-coordinate, dimeric copper(ii) Schiff base complex. Observation of Ostwald ripening","New J. Chem.","2016","40","4","3238","","10.1039/C5NJ02765A","","","0.71073","MoKα","","0.0432","0.0356","","","0.0858","0.0899","","","","","","1.038","","","","has coordinates","182773","2020-10-21","18:00:00",""
"7055349","11.8773","0.0007","11.8773","0.0007","44.58","0.003","90","","90","","90","","6288.9","0.7","173","2","173","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C66 H104 N6 O7 -","- C66 H104 N6 O7 -","- C264 H416 N24 O28 -","4","0.5","","Yuan, Minghui; Tanabe, Iori; Bernard-Schaaf, Jean-Marie; Shi, Qin-Yin; Schlegel, Vicki; Schurhammer, Rachel; Dowben, Peter A.; Doudin, Bernard; Routaboul, Lucie; Braunstein, Pierre","Influence of steric hindrance on the molecular packing and the anchoring of quinonoid zwitterions on gold surfaces","New J. Chem.","2016","40","7","5782","","10.1039/C5NJ03251B","","","0.71073","MoKα","","0.0685","0.0527","","","0.1145","0.1228","","","","","","1.074","","","","has coordinates,has disorder","185583","2020-10-21","18:00:00",""
"7055350","11.7927","0.0002","11.7927","0.0002","25.0037","0.0005","90","","90","","90","","3477.21","0.11","193","2","193","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C18 H26 N2 O2 -","- C18 H26 N2 O2 -","- C144 H208 N16 O16 -","8","1","","Yuan, Minghui; Tanabe, Iori; Bernard-Schaaf, Jean-Marie; Shi, Qin-Yin; Schlegel, Vicki; Schurhammer, Rachel; Dowben, Peter A.; Doudin, Bernard; Routaboul, Lucie; Braunstein, Pierre","Influence of steric hindrance on the molecular packing and the anchoring of quinonoid zwitterions on gold surfaces","New J. Chem.","2016","40","7","5782","","10.1039/C5NJ03251B","","","0.71073","MoKα","","0.0829","0.0571","","","0.1511","0.1635","","","","","","1.12","","","","has coordinates","185583","2020-10-21","18:00:00",""
"7055351","8.318","0.0003","14.3938","0.0005","18.1616","0.0006","90","","90","","90","","2174.45","0.13","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H26 N2 O2 -","- C26 H26 N2 O2 -","- C104 H104 N8 O8 -","4","1","","Yuan, Minghui; Tanabe, Iori; Bernard-Schaaf, Jean-Marie; Shi, Qin-Yin; Schlegel, Vicki; Schurhammer, Rachel; Dowben, Peter A.; Doudin, Bernard; Routaboul, Lucie; Braunstein, Pierre","Influence of steric hindrance on the molecular packing and the anchoring of quinonoid zwitterions on gold surfaces","New J. Chem.","2016","40","7","5782","","10.1039/C5NJ03251B","","","1.54178","CuKα","","0.0923","0.0899","","","0.2579","0.2608","","","","","","1.072","","","","has coordinates,has disorder","185583","2020-10-21","18:00:00",""
"7055352","11.4153","0.0008","6.849","0.0007","12.4992","0.0012","90","","110.314","0.006","90","","916.45","0.15","173","2","173","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C20 H30 Se -","- C20 H30 Se -","- C40 H60 Se2 -","2","0.5","","Boualy, Brahim; El Houssame, Soufiane; Sancineto, Luca; Santi, Claudio; Ait Ali, Mustapha; Stoeckli-Evans, Helen; El Firdoussi, Larbi","A mild and efficient method for the synthesis of a new optically active diallyl selenide and its catalytic activity in the allylic chlorination of natural terpenes","New J. Chem.","2016","40","4","3395","","10.1039/C5NJ02797G","","","0.71073","MoKα","","0.02","0.0195","","","0.0457","0.0458","","","","","","1.003","","","","has coordinates","182772","2020-10-21","18:00:00",""
"7055353","7.245","0.005","32.443","0.005","11.885","0.005","90","0.005","94.522","0.005","90","0.005","2785","2","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H26 Fe O4 -","- C42 H26 Fe O4 -","- C168 H104 Fe4 O16 -","4","1","","Singh, Thokchom Prasanta; Shunmugam, Raja","PCl3-mediated synthesis of green/cyan fluorescent protein chromophores using amino acids","New J. Chem.","2016","40","4","3024","","10.1039/C5NJ03144C","","","0.71069","MoKα","","0.3751","0.1386","","","0.2555","0.3588","","","","","","0.97","","","","has coordinates","182775","2020-10-21","18:00:00",""
"7055363","27.194","0.004","10.9496","0.0013","19.143","0.002","90","","100.772","0.004","90","","5599.6","1.2","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H28 B2 N4 -","- C34 H28 B2 N4 -","- C272 H224 B16 N32 -","8","1","","Gai, Lizhi; Xu, Jialiang; Wu, Yanping; Lu, Hua; Shen, Zhen","Synthesis and spectroscopic properties of novel N‒N linked bis-(diphenylboron) complexes","New J. Chem.","2016","40","7","5752","","10.1039/C5NJ03217B","","","0.71073","MoKα","","0.1262","0.061","","","0.1537","0.2144","","","","","","0.982","","","","has coordinates","185598","2020-10-21","18:00:00",""
"7055364","11.471","0.003","22.263","0.005","12.589","0.003","90","","94.037","0.004","90","","3207","1.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C38 H36 B2 N4 -","- C38 H36 B2 N4 -","- C152 H144 B8 N16 -","4","1","","Gai, Lizhi; Xu, Jialiang; Wu, Yanping; Lu, Hua; Shen, Zhen","Synthesis and spectroscopic properties of novel N‒N linked bis-(diphenylboron) complexes","New J. Chem.","2016","40","7","5752","","10.1039/C5NJ03217B","","","0.71073","MoKα","","0.1145","0.0571","","","0.1399","0.1687","","","","","","1.006","","","","has coordinates","185598","2020-10-21","18:00:00",""
"7055365","20.3791","0.0003","10.08862","0.00014","15.5172","0.0002","90","","110.049","0.0017","90","","2996.97","0.08","100.01","0.1","100.01","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Br P -","- C17 H16 Br P -","- C136 H128 Br8 P8 -","8","2","","Klingenberg, Margarita A.; Bogachenkov, Alexander S.; Kinzhalov, Mikhail A.; Vasilyev, Aleksander V.; Boyarskiy, Vadim P.","1,4-Dihydrophosphinolines and their complexes with group 10 metals","New J. Chem.","2016","40","4","3336","","10.1039/C5NJ03038B","","","1.5418","CuKα","","0.0305","0.0275","","","0.0735","0.0765","","","","","","1.016","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7055366","8.7824","0.0004","11.1066","0.0006","11.4473","0.0006","103.246","0.005","106.855","0.005","107.784","0.005","953.73","0.11","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H36 Br2 Cl6 P2 Pd -","- C36 H36 Br2 Cl6 P2 Pd -","- C36 H36 Br2 Cl6 P2 Pd -","1","0.5","","Klingenberg, Margarita A.; Bogachenkov, Alexander S.; Kinzhalov, Mikhail A.; Vasilyev, Aleksander V.; Boyarskiy, Vadim P.","1,4-Dihydrophosphinolines and their complexes with group 10 metals","New J. Chem.","2016","40","4","3336","","10.1039/C5NJ03038B","","","0.7107","MoKα","","0.0631","0.0511","","","0.1245","0.1339","","","","","","1.045","","","","has coordinates","182768","2020-10-21","18:00:00",""
"7055367","11.3816","0.0003","18.927","0.0004","16.0478","0.0004","90","","109.582","0.003","90","","3257.07","0.15","100","0.1","100","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 Br2 Cl2 P2 Pt -","- C34 H32 Br2 Cl2 P2 Pt -","- C136 H128 Br8 Cl8 P8 Pt4 -","4","1","","Klingenberg, Margarita A.; Bogachenkov, Alexander S.; Kinzhalov, Mikhail A.; Vasilyev, Aleksander V.; Boyarskiy, Vadim P.","1,4-Dihydrophosphinolines and their complexes with group 10 metals","New J. Chem.","2016","40","4","3336","","10.1039/C5NJ03038B","","","0.71073","MoKα","","0.0282","0.0238","","","0.0534","0.0552","","","","","","1.103","","","","has coordinates","182768","2020-10-21","18:00:00",""
"7055368","8.7628","0.0003","11.1119","0.0005","11.4634","0.0005","103.369","0.004","106.943","0.003","107.517","0.003","953.98","0.08","100","1","100","1","","","","","","","","6","P -1","-P 1","2","","","","- C18 H18 Br Cl3 P Pt0.5 -","- C18 H18 Br Cl3 P Pt0.5 -","- C36 H36 Br2 Cl6 P2 Pt -","2","1","","Klingenberg, Margarita A.; Bogachenkov, Alexander S.; Kinzhalov, Mikhail A.; Vasilyev, Aleksander V.; Boyarskiy, Vadim P.","1,4-Dihydrophosphinolines and their complexes with group 10 metals","New J. Chem.","2016","40","4","3336","","10.1039/C5NJ03038B","","","1.54184","CuKα","","0.0253","0.0209","","","0.0492","0.0507","","","","","","1.103","","","","has coordinates","182768","2020-10-21","18:00:00",""
"7055369","11.9317","0.0006","15.5172","0.0006","16.9442","0.0008","90","","100.854","0.005","90","","3081","0.2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H34 Cl2 P2 Pt -","- C34 H34 Cl2 P2 Pt -","- C136 H136 Cl8 P8 Pt4 -","4","1","","Klingenberg, Margarita A.; Bogachenkov, Alexander S.; Kinzhalov, Mikhail A.; Vasilyev, Aleksander V.; Boyarskiy, Vadim P.","1,4-Dihydrophosphinolines and their complexes with group 10 metals","New J. Chem.","2016","40","4","3336","","10.1039/C5NJ03038B","","","1.54184","CuKα","","0.0728","0.0557","","","0.1424","0.165","","","","","","1.075","","","","has coordinates","182768","2020-10-21","18:00:00",""
"7055370","12.2369","0.0004","8.2187","0.0002","15.0367","0.0005","90","","91.105","0.003","90","","1511.98","0.08","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H34 Cl2 P2 Pd -","- C34 H34 Cl2 P2 Pd -","- C68 H68 Cl4 P4 Pd2 -","2","0.5","","Klingenberg, Margarita A.; Bogachenkov, Alexander S.; Kinzhalov, Mikhail A.; Vasilyev, Aleksander V.; Boyarskiy, Vadim P.","1,4-Dihydrophosphinolines and their complexes with group 10 metals","New J. Chem.","2016","40","4","3336","","10.1039/C5NJ03038B","","","1.54184","CuKα","","0.0437","0.0383","","","0.0897","0.0938","","","","","","1.076","","","","has coordinates","182768","2020-10-21","18:00:00",""
"7055371","9.5958","0.0006","15.6026","0.0009","16.4916","0.001","90","","103.752","0.002","90","","2398.3","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H58 N4 O12 Zn3 -","- C46 H58 N4 O12 Zn3 -","- C92 H116 N8 O24 Zn6 -","2","0.5","","Akpan, Ekemini D.; Ojwach, Stephen O.; Omondi, Bernard; Nyamori, Vincent O.","Zn(ii) and Cu(ii) formamidine complexes: structural, kinetics and polymer tacticity studies in the ring-opening polymerization of ε-caprolactone and lactides","New J. Chem.","2016","40","4","3499","","10.1039/C5NJ03159A","","x-ray","0.71073","MoKα","","0.0287","0.0273","","","0.0715","0.0725","","","","","","1.059","","","","has coordinates","182770","2020-10-21","18:00:00",""
"7055372","13.957","0.0003","21.3908","0.0004","21.4967","0.0005","94.542","0.001","108.766","0.001","100.316","0.001","5913.7","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H84 N4 O8 Zn2 -","- C58 H84 N4 O8 Zn2 -","- C232 H336 N16 O32 Zn8 -","4","2","","Akpan, Ekemini D.; Ojwach, Stephen O.; Omondi, Bernard; Nyamori, Vincent O.","Zn(ii) and Cu(ii) formamidine complexes: structural, kinetics and polymer tacticity studies in the ring-opening polymerization of ε-caprolactone and lactides","New J. Chem.","2016","40","4","3499","","10.1039/C5NJ03159A","","","0.71073","MoKα","","0.0475","0.0338","","","0.0815","0.091","","","","","","1.041","","","","has coordinates,has disorder","182770","2020-10-21","18:00:00",""
"7055373","15.4331","0.001","12.4453","0.0009","16.2537","0.0011","90","","104.965","0.003","90","","3016","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C58 H84 Cu2 N4 O8 -","- C19.3333 H28 Cu0.666667 N1.33333 O2.66667 -","- C116 H168 Cu4 N8 O16 -","6","1.5","","Akpan, Ekemini D.; Ojwach, Stephen O.; Omondi, Bernard; Nyamori, Vincent O.","Zn(ii) and Cu(ii) formamidine complexes: structural, kinetics and polymer tacticity studies in the ring-opening polymerization of ε-caprolactone and lactides","New J. Chem.","2016","40","4","3499","","10.1039/C5NJ03159A","","x-ray","0.71073","MoKα","","0.0361","0.0312","","","0.0815","0.0875","","","","","","1.095","","","","has coordinates","182770","2020-10-21","18:00:00",""
"7055374","9.4219","0.0007","12.1061","0.0009","20.8673","0.0018","85.831","0.005","85.579","0.005","77.657","0.004","2314.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H60 N4 O8 Zn2 -","- C46 H60 N4 O8 Zn2 -","- C92 H120 N8 O16 Zn4 -","2","1","","Akpan, Ekemini D.; Ojwach, Stephen O.; Omondi, Bernard; Nyamori, Vincent O.","Zn(ii) and Cu(ii) formamidine complexes: structural, kinetics and polymer tacticity studies in the ring-opening polymerization of ε-caprolactone and lactides","New J. Chem.","2016","40","4","3499","","10.1039/C5NJ03159A","","","0.71073","MoKα","","0.0633","0.051","","","0.1165","0.1237","","","","","","1.135","","","","has coordinates,has disorder","182770","2020-10-21","18:00:00",""
"7055375","11.906","0.004","15.107","0.006","16.009","0.005","65.288","0.015","73.741","0.017","73.112","0.017","2461","1.5","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C26.5 H19 Cl N6 O3 S Zn -","- C26.5 H19 Cl N6 O3 S Zn -","- C106 H76 Cl4 N24 O12 S4 Zn4 -","4","2","","Indoria, Shikha; Lobana, Tarlok S.; Sood, Henna; Arora, Daljit S.; Hundal, Geeta; Jasinski, Jerry P.","Synthesis, spectroscopy, structures and antimicrobial activity of mixed-ligand zinc(ii) complexes of 5-nitro-salicylaldehyde thiosemicarbazones","New J. Chem.","2016","40","4","3642","","10.1039/C5NJ02822A","","","0.71073","MoKα","","0.1826","0.1169","","","0.3046","0.3884","","","","","","1.341","","","","has coordinates","182989","2020-10-21","18:00:00",""
"7055376","10.55","0.003","12.969","0.004","14.219","0.004","103.147","0.014","92.137","0.016","98.31","0.015","1869.6","1","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C73 H60 N24 O13 S4 Zn4 -","- C73 H56 N24 O13 S4 Zn4 -","- C73 H56 N24 O13 S4 Zn4 -","1","0.5","","Indoria, Shikha; Lobana, Tarlok S.; Sood, Henna; Arora, Daljit S.; Hundal, Geeta; Jasinski, Jerry P.","Synthesis, spectroscopy, structures and antimicrobial activity of mixed-ligand zinc(ii) complexes of 5-nitro-salicylaldehyde thiosemicarbazones","New J. Chem.","2016","40","4","3642","","10.1039/C5NJ02822A","","","0.71073","MoKα","","0.0478","0.0422","","","0.1205","0.1253","","","","","","1.018","","","","has coordinates","182774","2020-10-21","18:00:00",""
"7055377","6.0475","0.0006","12.1271","0.0011","14.1409","0.0015","86.254","0.003","82.737","0.004","81.271","0.003","1015.71","0.17","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H16 N6 O3 S Zn -","- C21 H16 N6 O3 S Zn -","- C42 H32 N12 O6 S2 Zn2 -","2","1","","Indoria, Shikha; Lobana, Tarlok S.; Sood, Henna; Arora, Daljit S.; Hundal, Geeta; Jasinski, Jerry P.","Synthesis, spectroscopy, structures and antimicrobial activity of mixed-ligand zinc(ii) complexes of 5-nitro-salicylaldehyde thiosemicarbazones","New J. Chem.","2016","40","4","3642","","10.1039/C5NJ02822A","","","0.71073","MoKα","","0.0552","0.0365","","","0.0885","0.0972","","","","","","0.987","","","","has coordinates","182774","2020-10-21","18:00:00",""
"7055378","22.2366","0.0008","12.0486","0.0005","17.9814","0.0006","90","","114.994","0.0012","90","","4366.4","0.3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 N6 O3 S Zn -","- C20 H18 N6 O3 S Zn -","- C160 H144 N48 O24 S8 Zn8 -","8","1","","Indoria, Shikha; Lobana, Tarlok S.; Sood, Henna; Arora, Daljit S.; Hundal, Geeta; Jasinski, Jerry P.","Synthesis, spectroscopy, structures and antimicrobial activity of mixed-ligand zinc(ii) complexes of 5-nitro-salicylaldehyde thiosemicarbazones","New J. Chem.","2016","40","4","3642","","10.1039/C5NJ02822A","","","0.71073","MoKα","","0.0561","0.0334","","","0.0844","0.0942","","","","","","1.028","","","","has coordinates","182774","2020-10-21","18:00:00",""
"7055379","7.9317","0.0014","11.671","0.002","14.471","0.003","111.165","0.009","91.581","0.01","102.581","0.009","1210.9","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H21 N7 O3 S Zn -","- C24 H21 N7 O3 S Zn -","- C48 H42 N14 O6 S2 Zn2 -","2","1","","Indoria, Shikha; Lobana, Tarlok S.; Sood, Henna; Arora, Daljit S.; Hundal, Geeta; Jasinski, Jerry P.","Synthesis, spectroscopy, structures and antimicrobial activity of mixed-ligand zinc(ii) complexes of 5-nitro-salicylaldehyde thiosemicarbazones","New J. Chem.","2016","40","4","3642","","10.1039/C5NJ02822A","","","0.71073","MoKα","","0.1074","0.0875","","","0.2298","0.2389","","","","","","1.102","","","","has coordinates","182774","2020-10-21","18:00:00",""
"7055380","9.7377","0.0013","10.8604","0.0012","11.9599","0.0015","67.51","0.011","76.142","0.011","76.077","0.011","1118.9","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H18 N6 O3 S Zn -","- C24 H18 N6 O3 S Zn -","- C48 H36 N12 O6 S2 Zn2 -","2","1","","Indoria, Shikha; Lobana, Tarlok S.; Sood, Henna; Arora, Daljit S.; Hundal, Geeta; Jasinski, Jerry P.","Synthesis, spectroscopy, structures and antimicrobial activity of mixed-ligand zinc(ii) complexes of 5-nitro-salicylaldehyde thiosemicarbazones","New J. Chem.","2016","40","4","3642","","10.1039/C5NJ02822A","","","1.54178","CuKα","","0.0416","0.0388","","","0.1045","0.1078","","","","","","1.054","","","","has coordinates","182774","2020-10-21","18:00:00",""
"7055381","12.389","0.0003","17.8502","0.0004","20.4246","0.0005","80.244","0.002","82.55","0.002","85.849","0.002","4408.04","0.18","183","1","183","1","","","","","","","","6","P -1","-P 1","2","","","","- C70 H89 Cr4 Dy N14 O43 -","- C70 H89 Cr4 Dy N14 O43 -","- C140 H178 Cr8 Dy2 N28 O86 -","2","1","","Blacque, Olivier; Amjad, Asma; Caneschi, Andrea; Sorace, Lorenzo; Car, Pierre-Emmanuel","Synthesis, structure, magnetic and magnetocaloric properties of a series of {CrIII4LnIII} complexes","New J. Chem.","2016","40","4","3571","","10.1039/C6NJ00136J","","x-ray","0.71073","MoKα","","0.0777","0.0474","","","0.0977","0.1145","","","","","","1.052","","","","has coordinates","182769","2020-10-21","18:00:00",""
"7055382","16.7984","0.0003","24.1625","0.0004","22.0725","0.0004","90","","95.739","0.002","90","","8914.1","0.3","183","1","183","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C70 H91 Cr4 Dy N14 O44 -","- C70 H51 Cr4 Dy N14 O44 -","- C280 H204 Cr16 Dy4 N56 O176 -","4","1","","Blacque, Olivier; Amjad, Asma; Caneschi, Andrea; Sorace, Lorenzo; Car, Pierre-Emmanuel","Synthesis, structure, magnetic and magnetocaloric properties of a series of {CrIII4LnIII} complexes","New J. Chem.","2016","40","4","3571","","10.1039/C6NJ00136J","","x-ray","0.71073","MoKα","","0.0763","0.0504","","","0.1237","0.1374","","","","","","1.052","","","","has coordinates,has disorder","182769","2020-10-21","18:00:00",""
"7055383","16.7168","0.0003","24.1981","0.0003","22.127","0.0004","90","","95.645","0.0017","90","","8907.3","0.3","183","1","183","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C70 H91 Cr4 N14 O44 Tb -","- C70 H51 Cr4 N14 O44 Tb -","- C280 H204 Cr16 N56 O176 Tb4 -","4","1","","Blacque, Olivier; Amjad, Asma; Caneschi, Andrea; Sorace, Lorenzo; Car, Pierre-Emmanuel","Synthesis, structure, magnetic and magnetocaloric properties of a series of {CrIII4LnIII} complexes","New J. Chem.","2016","40","4","3571","","10.1039/C6NJ00136J","","","1.54184","CuKα","","0.0949","0.0705","","","0.2068","0.2262","","","","","","1.05","","","","has coordinates,has disorder","182769","2020-10-21","18:00:00",""
"7055384","16.81501","0.00017","24.2384","0.0002","22.06575","0.00019","90","","95.8109","0.0009","90","","8947.1","0.14","183","1","183","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C70 H91 Cr4 Gd N14 O44 -","- C70 H51 Cr4 Gd N14 O44 -","- C280 H204 Cr16 Gd4 N56 O176 -","4","1","","Blacque, Olivier; Amjad, Asma; Caneschi, Andrea; Sorace, Lorenzo; Car, Pierre-Emmanuel","Synthesis, structure, magnetic and magnetocaloric properties of a series of {CrIII4LnIII} complexes","New J. Chem.","2016","40","4","3571","","10.1039/C6NJ00136J","","x-ray","1.54184","CuKα","","0.0594","0.047","","","0.1247","0.1347","","","","","","1.037","","","","has coordinates,has disorder","182769","2020-10-21","18:00:00",""
"7055385","7.5348","0.0005","8.5333","0.0004","17.6251","0.0012","76.322","0.005","79.285","0.005","69.702","0.005","1025.99","0.12","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H17 N6 O3 Re -","- C20 H17 N6 O3 Re -","- C40 H34 N12 O6 Re2 -","2","1","","Simpson, Peter V.; Skelton, Brian W.; Raiteri, Paolo; Massi, Massimiliano","Photophysical and photochemical studies of tricarbonyl rhenium(i) N-heterocyclic carbene complexes containing azide and triazolate ligands","New J. Chem.","2016","40","7","5797","","10.1039/C5NJ03301B","","x-ray","0.71073","MoKα","","0.0344","0.031","","","0.0718","0.0731","","","","","","1.125","","","","has coordinates,has disorder","185575","2020-10-21","18:00:00",""
"7055386","7.7716","0.0002","11.1256","0.0003","15.1208","0.0003","81.412","0.002","77.239","0.002","75.665","0.002","1229.19","0.05","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C19.69 H17.37 Cl1.37 N7 O3 Re -","- C19.687 H17.374 Cl1.374 N7 O3 Re -","- C39.374 H34.748 Cl2.748 N14 O6 Re2 -","2","1","","Simpson, Peter V.; Skelton, Brian W.; Raiteri, Paolo; Massi, Massimiliano","Photophysical and photochemical studies of tricarbonyl rhenium(i) N-heterocyclic carbene complexes containing azide and triazolate ligands","New J. Chem.","2016","40","7","5797","","10.1039/C5NJ03301B","","x-ray","0.71073","MoKα","","0.035","0.0341","","","0.0922","0.0929","","","","","","1.121","","","","has coordinates,has disorder","185575","2020-10-21","18:00:00",""
"7055387","11.3508","0.0002","14.0357","0.0002","16.9573","0.0002","90","","105.98","0.002","90","","2597.18","0.07","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H23 N6 O7 Re -","- C26 H23 N6 O7 Re -","- C104 H92 N24 O28 Re4 -","4","1","","Simpson, Peter V.; Skelton, Brian W.; Raiteri, Paolo; Massi, Massimiliano","Photophysical and photochemical studies of tricarbonyl rhenium(i) N-heterocyclic carbene complexes containing azide and triazolate ligands","New J. Chem.","2016","40","7","5797","","10.1039/C5NJ03301B","","x-ray","0.71073","MoKα","","0.0469","0.0326","","","0.0572","0.061","","","","","","1.086","","","","has coordinates","185575","2020-10-21","18:00:00",""
"7055388","10.6216","0.0002","11.4287","0.0001","21.8647","0.0003","90","","95.109","0.001","90","","2643.63","0.07","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H22 N7 O7 Re -","- C25 H22 N7 O7 Re -","- C100 H88 N28 O28 Re4 -","4","1","","Simpson, Peter V.; Skelton, Brian W.; Raiteri, Paolo; Massi, Massimiliano","Photophysical and photochemical studies of tricarbonyl rhenium(i) N-heterocyclic carbene complexes containing azide and triazolate ligands","New J. Chem.","2016","40","7","5797","","10.1039/C5NJ03301B","","x-ray","0.71073","MoKα","","0.0362","0.0275","","","0.0573","0.0607","","","","","","1.052","","","","has coordinates","185575","2020-10-21","18:00:00",""
"7055389","11.801","0.006","13.315","0.006","17.303","0.008","110.308","0.011","91.184","0.012","104.924","0.012","2446","2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H30 Cl2 Fe N10 O10 -","- C38 H30 Cl2 Fe N10 O10 -","- C76 H60 Cl4 Fe2 N20 O20 -","2","1","","Shen, Fu-Xing; Huang, Wei; Yamamoto, Takashi; Einaga, Yasuaki; Wu, Dayu","Preparation of dihydroquinazoline carbohydrazone Fe(ii) complexes for spin crossover","New J. Chem.","2016","40","5","4534","","10.1039/C5NJ03095A","","","0.71073","MoKα","","0.2083","0.1351","","","0.3517","0.4","","","","","","1.099","","","","has coordinates,has disorder","183745","2020-10-21","18:00:00",""
"7055390","11.891","0.0019","12.235","0.002","18.064","0.003","72.999","0.004","75.187","0.003","86.189","0.003","2429.6","0.7","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H30 B2 F8 Fe N10 O2 -","- C38 H30 B2 F8 Fe N10 O2 -","- C76 H60 B4 F16 Fe2 N20 O4 -","2","1","","Shen, Fu-Xing; Huang, Wei; Yamamoto, Takashi; Einaga, Yasuaki; Wu, Dayu","Preparation of dihydroquinazoline carbohydrazone Fe(ii) complexes for spin crossover","New J. Chem.","2016","40","5","4534","","10.1039/C5NJ03095A","","","0.71073","MoKα","","0.1105","0.0883","","","0.2567","0.2841","","","","","","1.086","","","","has coordinates,has disorder","183745","2020-10-21","18:00:00",""
"7055391","11.893","0.003","12.353","0.003","18.068","0.005","73.665","0.005","75.689","0.005","86.462","0.005","2468.2","1.1","180","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H30 B2 F8 Fe N10 O2 -","- C38 H30 B2 F8 Fe N10 O2 -","- C76 H60 B4 F16 Fe2 N20 O4 -","2","1","","Shen, Fu-Xing; Huang, Wei; Yamamoto, Takashi; Einaga, Yasuaki; Wu, Dayu","Preparation of dihydroquinazoline carbohydrazone Fe(ii) complexes for spin crossover","New J. Chem.","2016","40","5","4534","","10.1039/C5NJ03095A","","","0.71073","MoKα","","0.1297","0.0962","","","0.2812","0.3096","","","","","","1.081","","","","has coordinates,has disorder","183745","2020-10-21","18:00:00",""
"7055392","11.8477","0.0019","14.823","0.002","16.192","0.004","104","0.005","98.38","0.005","113.241","0.004","2440.7","0.8","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C40 H30 F6 Fe N10 O8 S2 -","- C40 H30 F6 Fe N10 O8 S2 -","- C80 H60 F12 Fe2 N20 O16 S4 -","2","1","","Shen, Fu-Xing; Huang, Wei; Yamamoto, Takashi; Einaga, Yasuaki; Wu, Dayu","Preparation of dihydroquinazoline carbohydrazone Fe(ii) complexes for spin crossover","New J. Chem.","2016","40","5","4534","","10.1039/C5NJ03095A","","","0.71073","MoKα","","0.1651","0.1121","","","0.3086","0.3498","","","","","","1.083","","","","has coordinates","183745","2020-10-21","18:00:00",""
"7055393","33.209","0.004","14.8798","0.0018","18.8479","0.0018","90","","90","","90","","9313.6","1.8","100","2","100","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C42 H34 Cl2 Fe N8 O13 -","- C42 H34 Cl2 Fe N8 O13 -","- C336 H272 Cl16 Fe8 N64 O104 -","8","0.5","","Shen, Fu-Xing; Huang, Wei; Yamamoto, Takashi; Einaga, Yasuaki; Wu, Dayu","Preparation of dihydroquinazoline carbohydrazone Fe(ii) complexes for spin crossover","New J. Chem.","2016","40","5","4534","","10.1039/C5NJ03095A","","","0.71073","MoKα","","0.1398","0.0961","","","0.2473","0.2876","","","","","","1.033","","","","has coordinates,has disorder","183745","2020-10-21","18:00:00",""
"7055394","33.402","0.006","15.304","0.003","19.044","0.003","90","","90","","90","","9735","3","296","2","296","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C42 H35.33 Cl2 Fe N8 O12.67 -","- C42 H35.3332 Cl2 Fe N8 O12.6666 -","- C336 H282.666 Cl16 Fe8 N64 O101.333 -","8","0.5","","Shen, Fu-Xing; Huang, Wei; Yamamoto, Takashi; Einaga, Yasuaki; Wu, Dayu","Preparation of dihydroquinazoline carbohydrazone Fe(ii) complexes for spin crossover","New J. Chem.","2016","40","5","4534","","10.1039/C5NJ03095A","","","0.71073","MoKα","","0.1077","0.0911","","","0.2336","0.2491","","","","","","1.017","","","","has coordinates,has disorder","183745","2020-10-21","18:00:00",""
"7055395","32.579","0.01","17.101","0.004","18.604","0.004","90","","90","","90","","10365","5","296","2","296","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C42 H34 Cl2 Fe N8 O12 -","- C42 H34 Cl2 Fe N8 O12 -","- C336 H272 Cl16 Fe8 N64 O96 -","8","0.5","","Shen, Fu-Xing; Huang, Wei; Yamamoto, Takashi; Einaga, Yasuaki; Wu, Dayu","Preparation of dihydroquinazoline carbohydrazone Fe(ii) complexes for spin crossover","New J. Chem.","2016","40","5","4534","","10.1039/C5NJ03095A","","","0.71073","MoKα","","0.2022","0.0958","","","0.2304","0.3048","","","","","","0.966","","","","has coordinates,has disorder","183745","2020-10-21","18:00:00",""
"7055396","8.701","0.0005","14.815","0.0006","17.4601","0.0009","90","","118.559","0.005","90","","1976.8","0.2","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 N4 Sn -","- C21 H22 N4 Sn -","- C84 H88 N16 Sn4 -","4","1","","Švec, Petr; Bartoš, Karel; Růžičková, Zdeňka; Cuřínová, Petra; Dušek, Libor; Turek, Jan; De Proft, Frank; Růžička, Aleš","C,N-Chelated organotin(iv) azides: synthesis, structure and use within click chemistry","New J. Chem.","2016","40","7","5808","","10.1039/C5NJ03187G","","","0.71073","MoKα","","0.0248","0.0189","","","0.0441","0.0514","","","","","","1.216","","","","has coordinates","185591","2020-10-21","18:00:00",""
"7055397","10.9088","0.0009","13.31","0.0007","28.147","0.003","81.282","0.007","80.812","0.008","68.233","0.008","3727.7","0.6","150","1","150","1","","","","","","","","6","P -1","-P 1","2","","","","- C71 H79 Cl6 N15 O Sn3 -","- C71 H79 Cl6 N15 O Sn3 -","- C142 H158 Cl12 N30 O2 Sn6 -","2","1","","Švec, Petr; Bartoš, Karel; Růžičková, Zdeňka; Cuřínová, Petra; Dušek, Libor; Turek, Jan; De Proft, Frank; Růžička, Aleš","C,N-Chelated organotin(iv) azides: synthesis, structure and use within click chemistry","New J. Chem.","2016","40","7","5808","","10.1039/C5NJ03187G","","","0.71073","MoKα","","0.0591","0.0548","","","0.1229","0.1262","","","","","","1.054","","","","has coordinates,has disorder","185591","2020-10-21","18:00:00",""
"7055398","9.965","0.0006","14.07","0.0006","16.8031","0.0011","90","","120.993","0.006","90","","2019.6","0.2","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H24 N8 Sn -","- C18 H24 N8 Sn -","- C72 H96 N32 Sn4 -","4","1","","Švec, Petr; Bartoš, Karel; Růžičková, Zdeňka; Cuřínová, Petra; Dušek, Libor; Turek, Jan; De Proft, Frank; Růžička, Aleš","C,N-Chelated organotin(iv) azides: synthesis, structure and use within click chemistry","New J. Chem.","2016","40","7","5808","","10.1039/C5NJ03187G","","","0.71073","MoKα","","0.0373","0.0298","","","0.0691","0.0755","","","","","","1.195","","","","has coordinates","185591","2020-10-21","18:00:00",""
"7055399","10.049","0.0003","13.4371","0.0012","18.4539","0.001","90","","103.31","0.004","90","","2424.9","0.3","150","1","150","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H35 N5 Sn -","- C24 H35 N5 Sn -","- C96 H140 N20 Sn4 -","4","1","","Švec, Petr; Bartoš, Karel; Růžičková, Zdeňka; Cuřínová, Petra; Dušek, Libor; Turek, Jan; De Proft, Frank; Růžička, Aleš","C,N-Chelated organotin(iv) azides: synthesis, structure and use within click chemistry","New J. Chem.","2016","40","7","5808","","10.1039/C5NJ03187G","","","0.71073","MoKα","","0.0396","0.0256","","","0.0506","0.058","","","","","","1.146","","","","has coordinates","185591","2020-10-21","18:00:00",""
"7055400","32.4123","0.0005","9.6582","0.0003","16.382","0.0003","90","","103.131","0.002","90","","4994.2","0.2","150","1","150","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H31 N5 Sn -","- C26 H31 N5 Sn -","- C208 H248 N40 Sn8 -","8","1","","Švec, Petr; Bartoš, Karel; Růžičková, Zdeňka; Cuřínová, Petra; Dušek, Libor; Turek, Jan; De Proft, Frank; Růžička, Aleš","C,N-Chelated organotin(iv) azides: synthesis, structure and use within click chemistry","New J. Chem.","2016","40","7","5808","","10.1039/C5NJ03187G","","","0.71073","MoKα","","0.0347","0.0244","","","0.0539","0.0615","","","","","","1.142","","","","has coordinates","185591","2020-10-21","18:00:00",""
"7055401","16.2012","0.0004","6.1332","0.0005","12.707","0.0002","90","","97.423","0.005","90","","1252.05","0.11","150","1","150","1","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C4 H9 N5 -","- C4 H9 N5 -","- C32 H72 N40 -","8","1","","Švec, Petr; Bartoš, Karel; Růžičková, Zdeňka; Cuřínová, Petra; Dušek, Libor; Turek, Jan; De Proft, Frank; Růžička, Aleš","C,N-Chelated organotin(iv) azides: synthesis, structure and use within click chemistry","New J. Chem.","2016","40","7","5808","","10.1039/C5NJ03187G","","","0.71073","MoKα","","0.0771","0.052","","","0.1251","0.1393","","","","","","1.117","","","","has coordinates","185591","2020-10-21","18:00:00",""
"7055402","13.389","0.0009","15.3861","0.0013","15.934","0.0007","90","","90","","90","","3282.5","0.4","150","1","150","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H21 N7 Sn -","- C13 H21 N7 Sn -","- C104 H168 N56 Sn8 -","8","1","","Švec, Petr; Bartoš, Karel; Růžičková, Zdeňka; Cuřínová, Petra; Dušek, Libor; Turek, Jan; De Proft, Frank; Růžička, Aleš","C,N-Chelated organotin(iv) azides: synthesis, structure and use within click chemistry","New J. Chem.","2016","40","7","5808","","10.1039/C5NJ03187G","","","0.71073","MoKα","","0.0516","0.0246","","","0.0486","0.0631","","","","","","1.168","","","","has coordinates","185591","2020-10-21","18:00:00",""
"7055403","6.816","0.0014","17.247","0.003","27.329","0.006","90","","91.03","0.03","90","","3212.2","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H44 Cl2 N12 O26 Pr2 -","- C36 H44 Cl2 N12 O26 Pr2 -","- C72 H88 Cl4 N24 O52 Pr4 -","2","0.5","","Liu, Qing-Ling; Yang, Li-Jing; Luo, Yang-Hui; Sun, Baiwang","Lanthanide-based coordination compounds assembled by 4-(4-carboxyphenyl)-1,2,4-triazole: synthesis, structures, Hirshfeld surface and luminescence properties","New J. Chem.","2016","","","","","10.1039/C5NJ03499J","","","0.71073","MoKα","","0.0935","0.0573","","","0.1381","0.1535","","","","","","0.963","","","","has coordinates","177276","2020-10-21","18:00:00",""
"7055404","21.171","0.004","14.704","0.003","10.024","0.002","90","","96.03","0.03","90","","3103.2","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H21 Er N6 O9 -","- C18 H21 Er N6 O9 -","- C72 H84 Er4 N24 O36 -","4","0.5","","Liu, Qing-Ling; Yang, Li-Jing; Luo, Yang-Hui; Sun, Baiwang","Lanthanide-based coordination compounds assembled by 4-(4-carboxyphenyl)-1,2,4-triazole: synthesis, structures, Hirshfeld surface and luminescence properties","New J. Chem.","2016","","","","","10.1039/C5NJ03499J","","","0.71073","MoKα","","0.1321","0.0827","","","0.1877","0.2108","","","","","","0.99","","","","has coordinates","177276","2020-10-21","18:00:00",""
"7055405","12.668","0.003","15.483","0.003","14.625","0.003","90","","113.28","0.03","90","","2635","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 Cl N6 O12 Sm -","- C20 H23 Cl N6 O12 Sm -","- C80 H92 Cl4 N24 O48 Sm4 -","4","1","","Liu, Qing-Ling; Yang, Li-Jing; Luo, Yang-Hui; Sun, Baiwang","Lanthanide-based coordination compounds assembled by 4-(4-carboxyphenyl)-1,2,4-triazole: synthesis, structures, Hirshfeld surface and luminescence properties","New J. Chem.","2016","","","","","10.1039/C5NJ03499J","","","0.71073","MoKα","","0.1681","0.0771","","","0.1076","0.1281","","","","","","1.001","","","","has coordinates","177276","2020-10-21","18:00:00",""
"7055406","21.218","0.004","14.37","0.003","9.954","0.002","90","","96.35","0.03","90","","3016.4","1.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 Lu N6 O9 -","- C18 H22 Lu N6 O9 -","- C72 H88 Lu4 N24 O36 -","4","0.5","","Liu, Qing-Ling; Yang, Li-Jing; Luo, Yang-Hui; Sun, Baiwang","Lanthanide-based coordination compounds assembled by 4-(4-carboxyphenyl)-1,2,4-triazole: synthesis, structures, Hirshfeld surface and luminescence properties","New J. Chem.","2016","","","","","10.1039/C5NJ03499J","","","0.71073","MoKα","","0.092","0.0696","","","0.1649","0.1773","","","","","","1.09","","","","has coordinates","177276","2020-10-21","18:00:00",""
"7055407","10.281","0.0006","18.6929","0.0013","24.7011","0.0016","90.145","0.002","99.641","0.002","104.611","0.002","4523.7","0.5","100","0.2","100","0.2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H101 I8 Mo6 N9 O19 -","- C70 H99 I8 Mo6 N9 O19 -","- C140 H198 I16 Mo12 N18 O38 -","2","1","","Mikhailov, Maksim A.; Brylev, Konstantin A.; Virovets, Alexandr V.; Gallyamov, Marsel R.; Novozhilov, Igor; Sokolov, Maxim N.","Complexes of {Mo6I8} with nitrophenolates: synthesis and luminescence","New J. Chem.","2016","40","2","1162","","10.1039/C5NJ02246K","","","0.71073","MoKα","","0.1161","0.0547","","","0.1022","0.1282","","","","","","0.969","","","","has coordinates,has disorder","177590","2020-10-21","18:00:00",""
"7055408","40.5","0.005","10.2557","0.0013","32.799","0.005","90","","123.367","0.007","90","","11378","3","100","0.2","100","0.2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C80 H114 I8 Mo6 N14 O33 -","- C80 H114 I8 Mo6 N14 O33 -","- C320 H456 I32 Mo24 N56 O132 -","4","0.5","","Mikhailov, Maksim A.; Brylev, Konstantin A.; Virovets, Alexandr V.; Gallyamov, Marsel R.; Novozhilov, Igor; Sokolov, Maxim N.","Complexes of {Mo6I8} with nitrophenolates: synthesis and luminescence","New J. Chem.","2016","40","2","1162","","10.1039/C5NJ02246K","","","0.71073","MoKα","","0.1087","0.0616","","","0.1352","0.1621","","","","","","1.085","","","","has coordinates,has disorder","177590","2020-10-21","18:00:00",""
"7055409","22.115","0.003","17.117","0.003","23.322","0.005","90","","109.896","0.003","90","","8301","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H27 F10 Ir N8 O P -","- C37 H27 F10 Ir N8 O P -","- C296 H216 F80 Ir8 N64 O8 P8 -","8","1","","Huang, Shao-Fen; Sun, Hai-Zhu; Shan, Guo-Gang; Wu, Yong; Zhang, Min; Su, Zhong-Min","Towards an efficient blue emission cationic Ir(iii) complex with azole-type ancillary ligands: a joint theoretical and experimental study","New J. Chem.","2016","40","5","4635","","10.1039/C5NJ03045E","","","0.71069","MoKα","","0.0747","0.0396","","","0.1001","0.117","","","","","","0.683","","","","has coordinates","208944","2020-10-21","18:00:00",""
"7055410","9.844","0.0004","24.218","0.0011","15.788","0.0007","90","","101.857","0.001","90","","3683.6","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H21 Cl2 F10 Ir N7 P -","- C33 H21 Cl2 F10 Ir N7 P -","- C132 H84 Cl8 F40 Ir4 N28 P4 -","4","1","","Huang, Shao-Fen; Sun, Hai-Zhu; Shan, Guo-Gang; Wu, Yong; Zhang, Min; Su, Zhong-Min","Towards an efficient blue emission cationic Ir(iii) complex with azole-type ancillary ligands: a joint theoretical and experimental study","New J. Chem.","2016","40","5","4635","","10.1039/C5NJ03045E","","","0.71069","MoKα","","0.0597","0.0422","","","0.1046","0.1197","","","","","","1.077","","","","has coordinates","183743","2020-10-21","18:00:00",""
"7055411","11.253","0.0008","11.583","0.0008","15.263","0.0011","103.296","0.0013","99.143","0.0015","109.752","0.0014","1760.3","0.2","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C28.5 H23 Cl3 F10 Ir N8 P -","- C28.5 H23 Cl3 F10 Ir N8 P -","- C57 H46 Cl6 F20 Ir2 N16 P2 -","2","1","","Huang, Shao-Fen; Sun, Hai-Zhu; Shan, Guo-Gang; Wu, Yong; Zhang, Min; Su, Zhong-Min","Towards an efficient blue emission cationic Ir(iii) complex with azole-type ancillary ligands: a joint theoretical and experimental study","New J. Chem.","2016","40","5","4635","","10.1039/C5NJ03045E","","","0.71069","MoKα","","0.0616","0.0419","","","0.083","0.0908","","","","","","1.041","","","","has coordinates,has disorder","183743","2020-10-21","18:00:00",""
"7055412","11.2861","0.0003","13.9823","0.0003","11.9367","0.0003","90","","91.985","0.002","90","","1882.55","0.08","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H30 Cu N8 O8 S2 -","- C34 H30 Cu N8 O8 S2 -","- C68 H60 Cu2 N16 O16 S4 -","2","0.5","","Sahu, Nilima; Das, Dipankar; Mondal, Sudipa; Roy, Suman; Dutta, Paramita; Sepay, Nayim; Gupta, Suvroma; López-Torres, Elena; Sinha, Chittaranjan","The structural characterization and biological activity of sulfamethoxazolyl-azo-p-cresol, its copper(ii) complex and their theoretical studies","New J. Chem.","2016","40","6","5019","","10.1039/C5NJ02983J","","","0.71073","MoKα","","0.0675","0.038","","","0.0999","0.1216","","","","","","1.074","","","","has coordinates","183739","2020-10-21","18:00:00",""
"7055413","29.8607","0.0016","6.3552","0.0004","17.473","0.0011","90","","95.254","0.003","90","","3301.9","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H16 N4 O4 S -","- C17 H16 N4 O4 S -","- C136 H128 N32 O32 S8 -","8","1","","Sahu, Nilima; Das, Dipankar; Mondal, Sudipa; Roy, Suman; Dutta, Paramita; Sepay, Nayim; Gupta, Suvroma; López-Torres, Elena; Sinha, Chittaranjan","The structural characterization and biological activity of sulfamethoxazolyl-azo-p-cresol, its copper(ii) complex and their theoretical studies","New J. Chem.","2016","40","6","5019","","10.1039/C5NJ02983J","","","0.71073","MoKα","","0.0539","0.0397","","","0.1013","0.1139","","","","","","1.055","","","","has coordinates","183739","2020-10-21","18:00:00",""
"7055414","16.979","0.001","10.3445","0.0009","15.9847","0.001","90","","90","","90","","2807.5","0.3","293","2","293","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C17 H16 N2 O -","- C17 H16 N2 O -","- C136 H128 N16 O8 -","8","2","","Palakollu, Veerabhadraiah; Vasu, Anuji K.; Thiruvenkatam, Vijay; Kanvah, Sriram","A sensitive AIEE probe for amphiphilic compounds","New J. Chem.","2016","40","5","4588","","10.1039/C5NJ02398J","","","1.54184","CuKα","","0.0609","0.0566","","","0.1344","0.1407","","","","","","1.13","","","","has coordinates","183744","2020-10-21","18:00:00",""
"7055415","11.5923","0.0003","16.9429","0.0003","14.1236","0.0003","90","","90.04","0.002","90","","2773.98","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H32 Cl8 N4 Pt -","- C17 H32 Cl8 N4 Pt -","- C68 H128 Cl32 N16 Pt4 -","4","1","","Bogojeski, Jovana; Volbeda, Jeroen; Bugarcic, Zivadin D.; Freytag, Matthias; Tamm, Matthias","Platinum(II) complexes with hybrid amine-imidazolin-2-imine ligands and their reactivity toward bio-molecules","New J. Chem.","2016","","","","","10.1039/C5NJ03360H","","","0.71073","MoKα","","0.0329","0.0231","","","0.0393","0.0419","","","","","","1.065","","","","has coordinates","178315","2020-10-21","18:00:00",""
"7055416","11.9748","0.0003","10.242","0.0003","16.6859","0.0004","90","","97.307","0.003","90","","2029.84","0.09","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H53 Au2 Cl7 N6 -","- C29 H53 Au2 Cl7 N6 -","- C58 H106 Au4 Cl14 N12 -","2","1","","Bogojeski, Jovana; Volbeda, Jeroen; Bugarcic, Zivadin D.; Freytag, Matthias; Tamm, Matthias","Platinum(II) complexes with hybrid amine-imidazolin-2-imine ligands and their reactivity toward bio-molecules","New J. Chem.","2016","","","","","10.1039/C5NJ03360H","","","0.71073","MoKα","","0.0542","0.0365","","","0.0722","0.0789","","","","","","1.055","","","","has coordinates","178315","2020-10-21","18:00:00",""
"7055417","12.6922","0.0003","8.9547","0.0002","21.1831","0.0006","90","","90","","90","","2407.56","0.1","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C112 H72 F32 N8 O8 -","8","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0523","0.0397","","","0.0953","0.107","","","","","","1.064","","","","has coordinates,has disorder","183733","2020-10-21","18:00:00",""
"7055418","7.3568","0.0017","27.672","0.006","12.434","0.003","90","","90","","90","","2531.3","1","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C14 H10 F4 N O1.5 -","- C14 H10 F4 N O1.5 -","- C112 H80 F32 N8 O12 -","8","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0613","0.0574","","","0.1396","0.1425","","","","","","1.108","","","","has coordinates,has disorder","183733","2020-10-21","18:00:00",""
"7055419","27.3179","0.0014","5.207","0.0002","8.3017","0.0003","90","","90","","90","","1180.87","0.09","100","2","100","2","","","","","","","","5","P 21 c n","P -2n 2a","33","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C56 H36 F16 N4 O4 -","4","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0569","0.0515","","","0.1201","0.1246","","","","","","1.105","","","","has coordinates","183733","2020-10-21","18:00:00",""
"7055420","8.0218","0.0001","39.7347","0.0006","7.8866","0.0001","90","","103.942","0.001","90","","2439.75","0.06","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C112 H72 F32 N8 O8 -","8","2","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0832","0.0541","","","0.1104","0.121","","","","","","1.028","","","","has coordinates","183733","2020-10-21","18:00:00",""
"7055421","7.156","0.003","7.072","0.003","23.277","0.009","90","","91.651","0.006","90","","1177.5","0.8","100","2","100","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C56 H36 F16 N4 O4 -","4","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0423","0.0381","","","0.0944","0.0959","","","","","","1.042","","","","has coordinates,has disorder","183733","2020-10-21","18:00:00",""
"7055422","15.4221","0.0004","7.9238","0.0002","19.9518","0.0005","90","","90.921","0.001","90","","2437.83","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C112 H72 F32 N8 O8 -","8","2","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0642","0.051","","","0.1361","0.1492","","","","","","1.083","","","","has coordinates","183733","2020-10-21","18:00:00",""
"7055423","12.9475","0.0016","9.5928","0.0011","10.0791","0.0012","90","","106.428","0.007","90","","1200.7","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C56 H36 F16 N4 O4 -","4","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0773","0.0609","","","0.1868","0.2121","","","","","","1.112","","","","has coordinates","183733","2020-10-21","18:00:00",""
"7055424","8.9068","0.0013","14.315","0.002","9.8311","0.0015","90","","90","","90","","1253.5","0.3","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C56 H36 F16 N4 O4 -","4","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0307","0.0302","","","0.0759","0.0763","","","","","","1.096","","","","has coordinates,has disorder","183733","2020-10-21","18:00:00",""
"7055425","11.0809","0.0003","21.8822","0.0005","15.3792","0.0004","90","","90.281","0.001","90","","3729.02","0.16","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C168 H108 F48 N12 O12 -","12","3","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0647","0.0427","","","0.0981","0.1077","","","","","","1.063","","","","has coordinates,has disorder","183733","2020-10-21","18:00:00",""
"7055426","4.8913","0.0003","25.8497","0.0015","9.6013","0.0007","90","","90.165","0.007","90","","1213.97","0.14","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C56 H36 F16 N4 O4 -","4","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0473","0.0395","","","0.0966","0.1021","","","","","","1.032","","","","has coordinates","183733","2020-10-21","18:00:00",""
"7055427","26.9156","0.0008","9.6838","0.0003","9.6832","0.0003","90","","90","","90","","2523.88","0.13","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C112 H72 F32 N8 O8 -","8","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.1226","0.0591","","","0.1514","0.1777","","","","","","1.053","","","","has coordinates,has disorder","183733","2020-10-21","18:00:00",""
"7055428","28.214","0.007","5.186","0.0012","16.02","0.004","90","","98.7","0.02","90","","2317","1","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C112 H72 F32 N8 O8 -","8","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.047","0.0373","","","0.0918","0.0973","","","","","","1.039","","","","has coordinates","183733","2020-10-21","18:00:00",""
"7055429","5.353","0.002","6.963","0.003","16.666","0.006","80.519","0.006","88.584","0.006","71.932","0.006","582.3","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H9 F4 N O -","- C14 H9 F4 N O -","- C28 H18 F8 N2 O2 -","2","1","","Panini, Piyush; Gonnade, Rajesh G.; Chopra, Deepak","Experimental and computational analysis of supramolecular motifs involving Csp2(aromatic)‒F and CF3groups in organic solids","New J. Chem.","2016","40","6","4981","","10.1039/C5NJ03211C","","","0.71073","MoKα","","0.0555","0.0443","","","0.1142","0.1198","","","","","","1.026","","","","has coordinates","183733","2020-10-21","18:00:00",""
"7055430","29.0413","0.0017","12.5389","0.0006","13.3299","0.0006","90","","92.096","0.004","90","","4850.8","0.4","110","","110","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","pyrrole derivative","pyrrolecyanoacetamide","","- C27 H20 Cl N3 O3 -","- C27 H20 Cl N3 O3 -","- C216 H160 Cl8 N24 O24 -","8","1","","Ambethkar, Sethurajan; Padmini, Vediappen; Bhuvanesh, Nattamai","A one-pot sequential five-component domino reaction for the expedient synthesis of polysubstituted pyrroles","New J. Chem.","2016","40","5","4705","","10.1039/C5NJ03444B","","","1.54178","CuKα","","0.0427","0.0343","","","0.0853","0.0888","","","","","","1.096","","","","has coordinates","183746","2020-10-21","18:00:00",""
"7055431","9.6519","0.0005","14.0468","0.0014","14.7341","0.0014","117.367","0.01","99.409","0.006","94.091","0.006","1725.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H56 Co3 N12 O18 -","- C74 H56 Co3 N12 O18 -","- C74 H56 Co3 N12 O18 -","1","0.5","","Fan, Yan; Hu, Dong-Cheng; Yao, Xiao-Qiang; Yang, Yun-Xia; Liu, Jia-Cheng","Four cobalt(ii) complexes based on a new tricarboxylate with a naphthalene ring and different N-containing ligands: synthesis, crystal structures and magnetic properties","New J. Chem.","2016","40","6","5010","","10.1039/C6NJ00065G","","","0.71073","MoKα","","0.0633","0.0477","","","0.1157","0.1272","","","","","","1.054","","","","has coordinates","183730","2020-10-21","18:00:00",""
"7055432","11.7113","0.0006","10.46","0.0005","33.108","0.0016","90","","94.187","0.001","90","","4044.9","0.3","296","2","296","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C92 H72 Co3 N12 O20 -","- C92 H72 Co3 N12 O20 -","- C184 H144 Co6 N24 O40 -","2","0.5","","Fan, Yan; Hu, Dong-Cheng; Yao, Xiao-Qiang; Yang, Yun-Xia; Liu, Jia-Cheng","Four cobalt(ii) complexes based on a new tricarboxylate with a naphthalene ring and different N-containing ligands: synthesis, crystal structures and magnetic properties","New J. Chem.","2016","40","6","5010","","10.1039/C6NJ00065G","","","0.71073","MoKα","","0.0845","0.058","","","0.0972","0.1105","","","","","","1.189","","","","has coordinates,has disorder","183730","2020-10-21","18:00:00",""
"7055433","16.136","0.002","9.3687","0.0013","21.052","0.003","90","","94.838","0.002","90","","3171.2","0.7","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H26 Co N4 O9 -","- C37 H26 Co N4 O9 -","- C148 H104 Co4 N16 O36 -","4","1","","Fan, Yan; Hu, Dong-Cheng; Yao, Xiao-Qiang; Yang, Yun-Xia; Liu, Jia-Cheng","Four cobalt(ii) complexes based on a new tricarboxylate with a naphthalene ring and different N-containing ligands: synthesis, crystal structures and magnetic properties","New J. Chem.","2016","40","6","5010","","10.1039/C6NJ00065G","","","0.71073","MoKα","","0.0758","0.0545","","","0.1425","0.1564","","","","","","1.014","","","","has coordinates","183730","2020-10-21","18:00:00",""
"7055434","21.087","0.004","21.087","0.004","12.382","0.003","90","","90","","90","","5506","2","296","2","296","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C30 H25 Co2 N2 O10 -","- C30 H25 Co2 N2 O10 -","- C240 H200 Co16 N16 O80 -","8","1","","Fan, Yan; Hu, Dong-Cheng; Yao, Xiao-Qiang; Yang, Yun-Xia; Liu, Jia-Cheng","Four cobalt(ii) complexes based on a new tricarboxylate with a naphthalene ring and different N-containing ligands: synthesis, crystal structures and magnetic properties","New J. Chem.","2016","40","6","5010","","10.1039/C6NJ00065G","","","0.71073","MoKα","","0.0474","0.0343","","","0.0725","0.0781","","","","","","1.027","","","","has coordinates","183730","2020-10-21","18:00:00",""
"7055435","10.8225","0.0004","18.3578","0.0007","32.9471","0.0013","90","","90","","90","","6545.8","0.4","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C29 H30 Cl2 N9 O8.5 Ru -","- C29 H30 Cl2 N9 O8.5 Ru -","- C232 H240 Cl16 N72 O68 Ru8 -","8","1","","Shee, Nirmal K.; Drew, Michael G. B.; Datta, Dipankar","Tuning of the lowest excited states in mixed ruthenium(ii) polypyridyl complexes having RuN6cores by the conformation of the ancillary ligand. Emission from a3ligand-to-ligand-charge-transfer state","New J. Chem.","2016","40","6","5002","","10.1039/C5NJ03329B","","","0.71073","MoKα","","0.1181","0.0562","","","0.1251","0.1381","","","","","","0.881","","","","has coordinates","183731","2020-10-21","18:00:00",""
"7055436","9.2008","0.0007","33.423","0.003","11.4925","0.0008","90","","92.999","0.007","90","","3529.3","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H32 Cl2 N9 O9.5 Ru -","- C33 H32 Cl2 N9 O9.5 Ru -","- C132 H128 Cl8 N36 O38 Ru4 -","4","1","","Shee, Nirmal K.; Drew, Michael G. B.; Datta, Dipankar","Tuning of the lowest excited states in mixed ruthenium(ii) polypyridyl complexes having RuN6cores by the conformation of the ancillary ligand. Emission from a3ligand-to-ligand-charge-transfer state","New J. Chem.","2016","40","6","5002","","10.1039/C5NJ03329B","","","0.71073","MoKα","","0.2066","0.0959","","","0.1334","0.1658","","","","","","0.974","","","","has coordinates","183731","2020-10-21","18:00:00",""
"7055437","12.2261","0.0003","27.7257","0.0006","17.0282","0.0004","90","","99.793","0.002","90","","5688.1","0.2","210","2","210","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-dichlorido-bis(1,3-bis(2-ethoxy-2-oxoethyl)-imidazol-2-ylidine)- palladium(II)","","- C22 H32 Cl2 N4 O8 Pd -","- C22 H32.0002 Cl2 N4 O8 Pd -","- C176 H256.002 Cl16 N32 O64 Pd8 -","8","2","","Steeples, Elliot; Kelling, Alexandra; Schilde, Uwe; Esposito, Davide","Amino acid-derived N-heterocyclic carbene palladium complexes for aqueous phase Suzuki‒Miyaura couplings","New J. Chem.","2016","40","6","4922","","10.1039/C5NJ03337C","","","0.71073","MoKα","","0.0362","0.0297","","","0.0823","0.0846","","","","","","1.063","","","","has coordinates,has disorder","183735","2020-10-21","18:00:00",""
"7055438","10.392","0.0005","12.0677","0.0007","25.5618","0.001","90","","98.377","0.003","90","","3171.4","0.3","210","2","210","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-dichlorido-bis(1,3-bis(2-ethoxy-2-oxopropyl)-imidazol-2-ylidine)- palladium(II)","","- C26 H40 Cl2 N4 O8 Pd -","- C26 H40 Cl2 N4 O8 Pd -","- C104 H160 Cl8 N16 O32 Pd4 -","4","0.5","","Steeples, Elliot; Kelling, Alexandra; Schilde, Uwe; Esposito, Davide","Amino acid-derived N-heterocyclic carbene palladium complexes for aqueous phase Suzuki‒Miyaura couplings","New J. Chem.","2016","40","6","4922","","10.1039/C5NJ03337C","","","0.71073","MoKα","","0.0251","0.0234","","","0.0601","0.061","","","","","","1.052","","","","has coordinates","183735","2020-10-21","18:00:00",""
"7055439","11.7256","0.0004","23.0938","0.0008","9.0944","0.0006","90","","99.52","0.004","90","","2428.7","0.2","210","2","210","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-dichlorido-(1,3-bis(2-ethoxy-2-oxoethyl)-imidazol-2-ylidine)- pyridine-palladium(II) chloroform solvate","","- C17 H22 Cl5 N3 O4 Pd -","- C17 H22 Cl5 N3 O4 Pd -","- C68 H88 Cl20 N12 O16 Pd4 -","4","1","","Steeples, Elliot; Kelling, Alexandra; Schilde, Uwe; Esposito, Davide","Amino acid-derived N-heterocyclic carbene palladium complexes for aqueous phase Suzuki‒Miyaura couplings","New J. Chem.","2016","40","6","4922","","10.1039/C5NJ03337C","","","0.71073","MoKα","","0.0327","0.0241","","","0.0581","0.0613","","","","","","1.015","","","","has coordinates","183735","2020-10-21","18:00:00",""
"7055440","9.4985","0.0008","9.7104","0.0007","12.2951","0.001","93.265","0.006","95.848","0.006","98.828","0.006","1111.72","0.15","210","2","210","2","","","","","","","","6","P -1","-P 1","2","","trans-dichlorido-(1,3-bis(2-ethoxy-2-oxopropyl)-imidazol-2-ylidine)- pyridine-palladium(II) chloroform solvate","","- C18 H25 Cl2 N3 O4 Pd -","- C18 H25 Cl2 N3 O4 Pd -","- C36 H50 Cl4 N6 O8 Pd2 -","2","1","","Steeples, Elliot; Kelling, Alexandra; Schilde, Uwe; Esposito, Davide","Amino acid-derived N-heterocyclic carbene palladium complexes for aqueous phase Suzuki‒Miyaura couplings","New J. Chem.","2016","40","6","4922","","10.1039/C5NJ03337C","","","0.71073","MoKα","","0.0213","0.0194","","","0.0525","0.0533","","","","","","1.059","","","","has coordinates","183735","2020-10-21","18:00:00",""
"7055441","12.1184","0.0007","17.2908","0.0011","13.0821","0.0009","90","","100.846","0.004","90","","2692.2","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C34 H29 N3 O4 -","- C34 H29 N3 O4 -","- C136 H116 N12 O16 -","4","1","","Mathusalini, Sadasivam; Arasakumar, Thangaraj; Lakshmi, Krishnasamy; Lin, Chia-Her; Mohan, Palathurai Subramaniam; Ramnath, Madhusudhanan Gogul; Thirugnanasampandan, Ramaraj","Synthesis and biological evaluation of new spirooxindoles with embedded pharmacophores","New J. Chem.","2016","40","6","5164","","10.1039/C6NJ00534A","","","0.71073","MoKα","","0.0798","0.0505","","","0.1104","0.1255","","","","","","1.04","","","","has coordinates","183732","2020-10-21","18:00:00",""
"7055442","12.0551","0.0003","18.3685","0.0004","12.3323","0.0003","90","","90.898","0.001","90","","2730.46","0.11","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 N4 O4 -","- C30 H26 N4 O4 -","- C120 H104 N16 O16 -","4","1","","Mathusalini, Sadasivam; Arasakumar, Thangaraj; Lakshmi, Krishnasamy; Lin, Chia-Her; Mohan, Palathurai Subramaniam; Ramnath, Madhusudhanan Gogul; Thirugnanasampandan, Ramaraj","Synthesis and biological evaluation of new spirooxindoles with embedded pharmacophores","New J. Chem.","2016","40","6","5164","","10.1039/C6NJ00534A","","","0.71073","MoKα","","0.0913","0.0533","","","0.1195","0.1326","","","","","","0.994","","","","has coordinates","183732","2020-10-21","18:00:00",""
"7055443","4.6149","0.0007","4.6149","0.0007","18.72","0.004","90","","90","","120","","345.27","0.1","153.15","","153.15","","","","","","","","","4","P -6 2 m","P -6 -2","189","","","","- Al4.68 B8 La2 O22 -","- Al4.68 B8 La2 O22 -","- Al4.68 B8 La2 O22 -","1","0.0833333","","Guo, Shu; Liu, Lijuan; Xia, Mingjun; Wang, Xiaoyang; Bai, Lei; Xu, Bo; Huang, Qian; Chen, Chuangtian","Crystal growth, structure and optical properties of a new acentric crystal La2Al4.68B8O22with a short UV absorption edge","New J. Chem.","2016","40","6","4870","","10.1039/C5NJ03646A","","","0.71073","MoKα","","0.0409","0.0379","","","0.1273","0.1322","","","","","","1.234","","","","has coordinates","183725","2020-10-21","18:00:00",""
"7055444","8.8082","0.0004","11.1431","0.0005","13.3105","0.0007","75.168","0.003","85.508","0.002","72.535","0.002","1204.68","0.1","115","2","115","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H35 N5 -","- C27 H35 N5 -","- C54 H70 N10 -","2","1","","Sok, Nicolas; Baglin, Isabelle; Rousselin, Yoann; Boschetti, Frederic; Bernhard, Claire; Goze, Christine; Denat, Franck","Reinforced cyclam derivatives functionalized on the bridging unit","New J. Chem.","2016","40","7","5829","","10.1039/C5NJ03488D","","x-ray","0.71073","MoKα","","0.1007","0.0726","","","0.1282","0.1428","","","","","","1.119","","","","has coordinates","185594","2020-10-21","18:00:00",""
"7055445","9.8695","0.0003","12.1158","0.0003","14.4185","0.0005","78.653","0.002","80.247","0.001","73.002","0.002","1605.02","0.09","115","2","115","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H27 N5 -","- C15 H27 N5 -","- C60 H108 N20 -","4","2","","Sok, Nicolas; Baglin, Isabelle; Rousselin, Yoann; Boschetti, Frederic; Bernhard, Claire; Goze, Christine; Denat, Franck","Reinforced cyclam derivatives functionalized on the bridging unit","New J. Chem.","2016","40","7","5829","","10.1039/C5NJ03488D","","x-ray","0.71073","MoKα","","0.0752","0.0558","","","0.1051","0.1153","","","","","","1.093","","","","has coordinates","185594","2020-10-21","18:00:00",""
"7055446","16.103","0.005","14.421","0.005","18.511","0.005","90","","90","","90","","4299","2","298","2","298","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H31 Cu N7 O8 -","- C15 H31 Cu N7 O8 -","- C120 H248 Cu8 N56 O64 -","8","1","","Sok, Nicolas; Baglin, Isabelle; Rousselin, Yoann; Boschetti, Frederic; Bernhard, Claire; Goze, Christine; Denat, Franck","Reinforced cyclam derivatives functionalized on the bridging unit","New J. Chem.","2016","40","7","5829","","10.1039/C5NJ03488D","","x-ray","0.71073","MoKα","","0.1309","0.1076","","","0.2621","0.2768","","","","","","1.139","","","","has coordinates","185594","2020-10-21","18:00:00",""
"7055447","15.5335","0.0005","7.686","0.0002","21.3414","0.0007","90","","91.061","0.001","90","","2547.52","0.13","115","2","115","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C28 H36 N6 -","- C28 H36 N6 -","- C112 H144 N24 -","4","0.5","","Sok, Nicolas; Baglin, Isabelle; Rousselin, Yoann; Boschetti, Frederic; Bernhard, Claire; Goze, Christine; Denat, Franck","Reinforced cyclam derivatives functionalized on the bridging unit","New J. Chem.","2016","40","7","5829","","10.1039/C5NJ03488D","","x-ray","0.71073","MoKα","","0.0566","0.0473","","","0.1008","0.106","","","","","","1.093","","","","has coordinates","185594","2020-10-21","18:00:00",""
"7055448","9.3978","0.0004","7.9771","0.0003","33.7475","0.0014","90","","96.782","0.001","90","","2512.25","0.18","115","2","115","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H36 N6 -","- C28 H36 N6 -","- C112 H144 N24 -","4","1","","Sok, Nicolas; Baglin, Isabelle; Rousselin, Yoann; Boschetti, Frederic; Bernhard, Claire; Goze, Christine; Denat, Franck","Reinforced cyclam derivatives functionalized on the bridging unit","New J. Chem.","2016","40","7","5829","","10.1039/C5NJ03488D","","x-ray","0.71073","MoKα","","0.0832","0.0627","","","0.119","0.1296","","","","","","1.096","","","","has coordinates","185594","2020-10-21","18:00:00",""
"7055449","9.0052","0.0003","14.4455","0.0004","23.8253","0.0007","90","","90","","90","","3099.31","0.16","115","2","115","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H40 Cu N8 O7 -","- C29 H40 Cu N8 O7 -","- C116 H160 Cu4 N32 O28 -","4","1","","Sok, Nicolas; Baglin, Isabelle; Rousselin, Yoann; Boschetti, Frederic; Bernhard, Claire; Goze, Christine; Denat, Franck","Reinforced cyclam derivatives functionalized on the bridging unit","New J. Chem.","2016","40","7","5829","","10.1039/C5NJ03488D","","x-ray","0.71073","MoKα","","0.1114","0.0778","","","0.1406","0.1621","","","","","","1.224","","","","has coordinates,has disorder","185594","2020-10-21","18:00:00",""
"7055450","8.7485","0.0009","11.5996","0.0013","12.3113","0.0013","109.625","0.0017","101.813","0.0015","104.241","0.0017","1082.6","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","N,N-dimethylethanol ammonium tetrakis(trifluoroacetato)cerate","","- C12 H12 Ce F12 N O9 -","- C12 H12 Ce F12 N O9 -","- C24 H24 Ce2 F24 N2 O18 -","2","1","","Mansoor, Muhammad Adil; Mazhar, Muhammad; Ebadi, Mehdi; Ming, Huang Nay; Mat Teridi, Mohd Asri; Kong Mun, Lo","Effect of synergic cooperation on optical and photoelectrochemical properties of CeO2‒MnO composite thin films","New J. Chem.","2016","40","6","5177","","10.1039/C5NJ03446A","","","0.71073","MoKα","","0.0372","0.0333","","","0.0798","0.0823","","","","","","1.061","","","","has coordinates,has disorder","183740","2020-10-21","18:00:00",""
"7055451","10.9142","0.0017","13.574","0.002","14.539","0.002","90","","76.691","0.008","90","","2096.1","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C58 H42 N4 -","- C58 H42 N4 -","- C116 H84 N8 -","2","0.5","","Le Poul, Pascal; Le Poul, Nicolas; Golhen, Stephane; Robin-Le Guen, Françoise; Caro, Bertrand","The synthesis of flexible tetrapyridylethanes from pyridylpyrylium dications","New J. Chem.","2016","40","7","5666","","10.1039/C5NJ03257A","","","0.71073","MoKα","","0.2867","0.0919","","","0.218","0.3083","","","","","","0.935","","","","has coordinates","185592","2020-10-21","18:00:00",""
"7055452","9.899","0.002","10.339","0.002","16.807","0.003","100.87","0.03","99","0.03","98.93","0.03","1637.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H32 Cl N4 O -","- C42 H32 Cl N4 O -","- C84 H64 Cl2 N8 O2 -","2","1","","Khan, Arshad; Wang, Mingliang; Usman, Rabia; Lu, Jiao; Sun, Hao; Du, Man; Zhang, Ruimin; Xu, Chunxiang","Organic charge-transfer complexes for the selective accommodation of aromatic isomers using anthracene derivatives and TCNQ","New J. Chem.","2016","40","6","5277","","10.1039/C5NJ03442F","","","0.71073","MoKα","","0.1915","0.1445","","","0.3293","0.3695","","","","","","1.288","","","","has coordinates","183720","2020-10-21","18:00:00",""
"7055453","9.928","0.002","10.632","0.002","16.282","0.003","76.58","0.03","72.43","0.03","77.68","0.03","1574.6","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H32 N4 O -","- C39 H32 N4 O -","- C78 H64 N8 O2 -","2","1","","Khan, Arshad; Wang, Mingliang; Usman, Rabia; Lu, Jiao; Sun, Hao; Du, Man; Zhang, Ruimin; Xu, Chunxiang","Organic charge-transfer complexes for the selective accommodation of aromatic isomers using anthracene derivatives and TCNQ","New J. Chem.","2016","40","6","5277","","10.1039/C5NJ03442F","","","0.71073","MoKα","","0.0979","0.0576","","","0.1583","0.1862","","","","","","1.038","","","","has coordinates","183720","2020-10-21","18:00:00",""
"7055454","9.719","0.0019","10.356","0.002","17.804","0.004","74.09","0.03","86.73","0.03","85.69","0.03","1717.2","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H34 N4 O -","- C43 H34 N4 O -","- C86 H68 N8 O2 -","2","1","","Khan, Arshad; Wang, Mingliang; Usman, Rabia; Lu, Jiao; Sun, Hao; Du, Man; Zhang, Ruimin; Xu, Chunxiang","Organic charge-transfer complexes for the selective accommodation of aromatic isomers using anthracene derivatives and TCNQ","New J. Chem.","2016","40","6","5277","","10.1039/C5NJ03442F","","","0.71073","MoKα","","0.1192","0.0642","","","0.1787","0.2047","","","","","","1.009","","","","has coordinates","183720","2020-10-21","18:00:00",""
"7055455","7.615","0.011","23.48","0.03","36.26","0.05","90","","90","","90","","6483","15","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C H O -","- C1.84293 H1.34031 O0.335079 -","- C352 H256 O64 -","191","23.875","","Wang, Xiu-Zhen; Yang, Hui-Hui; Li, Wei; Han, Bing-Jie; Liu, Yun-Jun","Studies on apoptosis in HeLa cells via the ROS-mediated mitochondrial pathway induced by new dibenzoxanthenes","New J. Chem.","2016","40","6","5255","","10.1039/C6NJ00250A","","","0.71073","MoKα","","0.0594","0.0428","","","0.1075","0.1169","","","","","","1.042","","","","has coordinates","183737","2020-10-21","18:00:00",""
"7055456","7.4491","","10.3933","","11.0563","","90","","109.711","","90","","805.831","","300","2","300","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Al N O8 Si Y4 -","- Al N O8 Si Y4 -","- Al4 N4 O32 Si4 Y16 -","4","1","","Hua, Youjie; Li, Xiaojun; Zhang, Dawei; Ma, Hongping; Deng, Degang; Xu, Shiqing","The crystal structure and luminescence properties of novel Ce3+and Ce3+, Sm3±activated Y4SiAlO8N phosphors for near-UV white LEDs","New J. Chem.","2016","40","6","5458","","10.1039/C5NJ03712C","","","0.71073","","","0.057","","","","","","","","","","","","","","","has coordinates","183729","2020-10-21","18:00:00",""
"7055457","10.091","0.0002","11.388","0.0003","13.479","0.0004","73.422","0.001","69.695","0.001","63.977","0.002","1289.05","0.06","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 N8 O43 Y4 -","- C28 H54 N8 O43 Y4 -","- C28 H54 N8 O43 Y4 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0875","0.048","","","0.1079","0.1227","","","","","","1.049","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055458","10.305","0.0004","11.599","0.0004","13.731","0.0006","73.85","0.002","70.201","0.002","64.115","0.002","1372.74","0.1","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 N8 O43 Yb4 -","- C28 H54 N8 O43 Yb4 -","- C28 H54 N8 O43 Yb4 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0538","0.0382","","","0.0887","0.0926","","","","","","0.87","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055459","10.056","0.0003","11.366","0.0003","13.431","0.0002","73.444","0.002","69.55","0.002","63.985","0.001","1276.72","0.06","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 N8 O43 Tm4 -","- C28 H54 N8 O43 Tm4 -","- C28 H54 N8 O43 Tm4 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0509","0.046","","","0.1018","0.1047","","","","","","1.117","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055460","10.128","0.0002","11.415","0.0003","13.52","0.0004","73.404","0.002","69.808","0.001","63.993","0.002","1301.64","0.06","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 N8 O43 Tb4 -","- C28 H54 N8 O43 Tb4 -","- C28 H54 N8 O43 Tb4 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.055","0.0412","","","0.0994","0.1081","","","","","","1.046","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055461","10.187","0.0002","11.469","0.0002","13.592","0.0003","73.47","0.001","69.91","0.001","64.02","0.001","1323.68","0.05","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 N8 O43 Sm4 -","- C28 H54 N8 O43 Sm4 -","- C28 H54 N8 O43 Sm4 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0473","0.0413","","","0.1","0.1058","","","","","","1.117","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055462","10.246","0.0002","11.534","0.0002","13.661","0.0004","73.662","0.001","70.046","0.002","64.068","0.002","1347.95","0.06","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 N8 O43 Pr4 -","- C28 H54 N8 O43 Pr4 -","- C28 H54 N8 O43 Pr4 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0535","0.0389","","","0.0924","0.1019","","","","","","1.039","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055463","10.224","0.0001","11.508","0.0001","13.638","0.0002","73.618","0.001","70.012","0.001","64.048","0.001","1339.14","0.03","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 N8 Nd4 O43 -","- C28 H54 N8 Nd4 O43 -","- C28 H54 N8 Nd4 O43 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0408","0.0368","","","0.0878","0.0901","","","","","","1.111","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055464","10.305","0.0004","11.599","0.0004","13.731","0.0006","73.85","0.002","70.201","0.002","64.115","0.002","1372.74","0.1","293.15","","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 La4 N8 O43 -","- C28 H54 La4 N8 O43 -","- C28 H54 La4 N8 O43 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0333","0.0297","","","0.071","0.073","","","","","","1.124","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055465","10.093","0.0002","11.385","0.0002","13.477","0.0003","73.394","0.001","69.724","0.001","63.98","0.001","1288.88","0.05","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 Ho4 N8 O43 -","- C28 H54 Ho4 N8 O43 -","- C28 H54 Ho4 N8 O43 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0381","0.0344","","","0.0928","0.0956","","","","","","1.08","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055466","10.15","0.0002","11.434","0.0002","13.55","0.0002","73.445","0.001","69.841","0.001","63.991","0.001","1309.92","0.04","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 Gd4 N8 O43 -","- C28 H54 Gd4 N8 O43 -","- C28 H54 Gd4 N8 O43 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0357","0.0322","","","0.0827","0.0844","","","","","","1.16","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055467","10.109","0.0003","11.399","0.0003","13.499","0.0004","73.409","0.002","69.756","0.002","63.988","0.002","1294.98","0.07","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","Dysuc1","","","- C28 H54 Dy4 N8 O43 -","- C28 H54 Dy4 N8 O43 -","- C28 H54 Dy4 N8 O43 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0551","0.0374","","","0.086","0.0956","","","","","","1.047","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055468","10.074","0.0002","11.371","0.0003","13.456","0.0003","73.413","0.002","69.658","0.001","63.977","0.001","1282.48","0.05","293","2","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 Er4 N8 O43 -","- C28 H54 Er4 N8 O43 -","- C28 H54 Er4 N8 O43 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0427","0.0388","","","0.0967","0.0988","","","","","","1.101","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055469","10.274","0.0002","11.564","0.0001","13.69","0.0002","73.749","0.001","70.114","0.001","64.092","0.001","1359.13","0.04","293.15","","293.15","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H54 Ce4 N8 O43 -","- C28 H54 Ce4 N8 O43 -","- C28 H54 Ce4 N8 O43 -","1","0.5","","Lahoud, Marcelo G.; Muniz, Elaine C.; Arroyos, Guilherme; Fávaro, Marcelo A.; Davolos, Marian R.; D'Vries, Richard F.; Ellena, Javier; Freitas, Rafael S.; Arrighi, Everton; Frem, Regina C. G.","Rare earth coordination dinuclear compounds constructed from 3,5-dicarboxypyrazolate and succinate intermetallic bridges","New J. Chem.","2016","40","6","5338","","10.1039/C6NJ00140H","","","0.71073","MoKα","","0.0409","0.0368","","","0.0948","0.099","","","","","","1.039","","","","has coordinates","183738","2020-10-21","18:00:00",""
"7055470","20.469","0.004","10.079","0.002","6.722","0.0013","90","","90","","90","","1386.8","0.5","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C17 H12 B F2 N3 O -","- C17 H12 B F2 N3 O -","- C68 H48 B4 F8 N12 O4 -","4","1","","Sharma, Ritambhara; Lakshmi, Vellanki; Chatterjee, Tamal; Ravikanth, Mangalampalli","Effects of five membered aromatic heterocycles at the meso-position on the electronic properties of 3-pyrrolyl BODIPY","New J. Chem.","2016","40","7","5855","","10.1039/C6NJ00118A","","","0.71073","MoKα","","0.0557","0.0517","","","0.1406","0.1459","","","","","","0.986","","","","has coordinates","185570","2020-10-21","18:00:00",""
"7055471","12.1337","0.0007","13.0987","0.0008","25.2928","0.0015","90","","90","","90","","4019.9","0.4","299","2","299","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C45 H36 Cu F3 N4 P2 -","- C45 H36 Cu F3 N4 P2 -","- C180 H144 Cu4 F12 N16 P8 -","4","1","","Chen, Jing-Lin; Guo, Zong-Hao; Luo, Yan-Sheng; Qiu, Lu; He, Li-Hua; Liu, Sui-Jun; Wen, He-Rui; Wang, Jin-Yun","Luminescent monometallic Cu(i) triphenylphosphine complexes based on methylated 5-trifluoromethyl-3-(2′-pyridyl)-1,2,4-triazole ligands","New J. Chem.","2016","40","6","5325","","10.1039/C5NJ03529E","","","0.71073","MoKα","","0.0658","0.0477","","","0.1077","0.1162","","","","","","1.021","","","","has coordinates","183721","2020-10-21","18:00:00",""
"7055472","13.0739","0.0007","21.8016","0.0011","14.4235","0.0008","90","","103.883","0.001","90","","3991.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H36 Cu F3 N4 P2 -","- C45 H36 Cu F3 N4 P2 -","- C180 H144 Cu4 F12 N16 P8 -","4","1","","Chen, Jing-Lin; Guo, Zong-Hao; Luo, Yan-Sheng; Qiu, Lu; He, Li-Hua; Liu, Sui-Jun; Wen, He-Rui; Wang, Jin-Yun","Luminescent monometallic Cu(i) triphenylphosphine complexes based on methylated 5-trifluoromethyl-3-(2′-pyridyl)-1,2,4-triazole ligands","New J. Chem.","2016","40","6","5325","","10.1039/C5NJ03529E","","","0.71073","MoKα","","0.0657","0.0465","","","0.1066","0.1212","","","","","","1.059","","","","has coordinates,has disorder","183721","2020-10-21","18:00:00",""
"7055473","12.1405","0.0009","12.9183","0.001","25.384","0.002","90","","90","","90","","3981.1","0.5","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C45 H36 Cu F3 N4 P2 -","- C45 H36 Cu F3 N4 P2 -","- C180 H144 Cu4 F12 N16 P8 -","4","1","","Chen, Jing-Lin; Guo, Zong-Hao; Luo, Yan-Sheng; Qiu, Lu; He, Li-Hua; Liu, Sui-Jun; Wen, He-Rui; Wang, Jin-Yun","Luminescent monometallic Cu(i) triphenylphosphine complexes based on methylated 5-trifluoromethyl-3-(2′-pyridyl)-1,2,4-triazole ligands","New J. Chem.","2016","40","6","5325","","10.1039/C5NJ03529E","","","0.71073","MoKα","","0.0663","0.0574","","","0.1137","0.1176","","","","","","1.183","","","","has coordinates","183721","2020-10-21","18:00:00",""
"7055474","37.228","0.003","15.266","0.0012","19.6526","0.0016","90","","120.178","0.002","90","","9655.3","1.4","300","2","300","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C46 H39 Cl3 Cu F3 N4 O4 P2 -","- C46 H39 Cl3 Cu F3 N4 O4 P2 -","- C368 H312 Cl24 Cu8 F24 N32 O32 P16 -","8","1","","Chen, Jing-Lin; Guo, Zong-Hao; Luo, Yan-Sheng; Qiu, Lu; He, Li-Hua; Liu, Sui-Jun; Wen, He-Rui; Wang, Jin-Yun","Luminescent monometallic Cu(i) triphenylphosphine complexes based on methylated 5-trifluoromethyl-3-(2′-pyridyl)-1,2,4-triazole ligands","New J. Chem.","2016","40","6","5325","","10.1039/C5NJ03529E","","","0.71073","MoKα","","0.1978","0.1079","","","0.2317","0.2876","","","","","","1.087","","","","has coordinates,has disorder","183721","2020-10-21","18:00:00",""
"7055475","10.4274","0.0004","15.7685","0.0007","27.1531","0.0012","90","","100.535","0.001","90","","4389.4","0.3","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C45 H37 Cl Cu F3 N4 O4 P2 -","- C45 H37 Cl Cu F3 N4 O4 P2 -","- C180 H148 Cl4 Cu4 F12 N16 O16 P8 -","4","1","","Chen, Jing-Lin; Guo, Zong-Hao; Luo, Yan-Sheng; Qiu, Lu; He, Li-Hua; Liu, Sui-Jun; Wen, He-Rui; Wang, Jin-Yun","Luminescent monometallic Cu(i) triphenylphosphine complexes based on methylated 5-trifluoromethyl-3-(2′-pyridyl)-1,2,4-triazole ligands","New J. Chem.","2016","40","6","5325","","10.1039/C5NJ03529E","","","0.71073","MoKα","","0.0809","0.0592","","","0.1563","0.1737","","","","","","1.044","","","","has coordinates","183721","2020-10-21","18:00:00",""
"7055476","9.107","0.0006","13.0905","0.0009","25.3601","0.0018","85.276","0.005","82.088","0.003","84.915","0.004","2975.2","0.4","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C48 H56 Cl10 Cu2 N8 O4 S4 -","- C48 H56 Cl10 Cu2 N8 O4 S4 -","- C96 H112 Cl20 Cu4 N16 O8 S8 -","2","1","","Selvakumaran, Nagamani; Sandhiya, Lakshmanan; Bhuvanesh, Nattamai S. P.; Senthilkumar, Kittusamy; Karvembu, Ramasamy","Structural diversity in aroylthiourea copper complexes ‒ formation and biological evaluation of [Cu(i)(μ-S)SCl]2, cis-Cu(ii)S2O2, trans-Cu(ii)S2O2and Cu(i)S3cores","New J. Chem.","2016","40","6","5401","","10.1039/C5NJ03536H","","","1.54178","CuKα","","0.0462","0.0371","","","0.0963","0.1009","","","","","","1.045","","","","has coordinates","183723","2020-10-21","18:00:00",""
"7055477","8.5233","0.0006","13.2721","0.0009","13.6992","0.0009","70.31","0.004","82.388","0.004","74.666","0.004","1405.52","0.17","110","2","110","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H26 Cl4 Cu N4 O2 S2 -","- C24 H26 Cl4 Cu N4 O2 S2 -","- C48 H52 Cl8 Cu2 N8 O4 S4 -","2","1","","Selvakumaran, Nagamani; Sandhiya, Lakshmanan; Bhuvanesh, Nattamai S. P.; Senthilkumar, Kittusamy; Karvembu, Ramasamy","Structural diversity in aroylthiourea copper complexes ‒ formation and biological evaluation of [Cu(i)(μ-S)SCl]2, cis-Cu(ii)S2O2, trans-Cu(ii)S2O2and Cu(i)S3cores","New J. Chem.","2016","40","6","5401","","10.1039/C5NJ03536H","","","1.54178","CuKα","","0.0419","0.0393","","","0.1011","0.1023","","","","","","1.132","","","","has coordinates","183723","2020-10-21","18:00:00",""
"7055478","13.7134","0.001","13.7134","0.001","53.18","0.007","90","","90","","120","","8661","1.4","110","2","110","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C48 H66 Cl7 Cu N6 O3 S3 -","- C48 H66 Cl7 Cu N6 O3 S3 -","- C288 H396 Cl42 Cu6 N36 O18 S18 -","6","0.333333","","Selvakumaran, Nagamani; Sandhiya, Lakshmanan; Bhuvanesh, Nattamai S. P.; Senthilkumar, Kittusamy; Karvembu, Ramasamy","Structural diversity in aroylthiourea copper complexes ‒ formation and biological evaluation of [Cu(i)(μ-S)SCl]2, cis-Cu(ii)S2O2, trans-Cu(ii)S2O2and Cu(i)S3cores","New J. Chem.","2016","40","6","5401","","10.1039/C5NJ03536H","","","0.71073","MoKα","","0.0553","0.0446","","","0.1134","0.1188","","","","","","1.103","","","","has coordinates,has disorder","183723","2020-10-21","18:00:00",""
"7055479","9.887","0.004","19.632","0.007","10.33","0.004","90","","111.326","0.004","90","","1867.8","1.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C32 H42 Cl4 Cu N4 O2 S2 -","- C32 H42 Cl4 Cu N4 O2 S2 -","- C64 H84 Cl8 Cu2 N8 O4 S4 -","2","0.5","","Selvakumaran, Nagamani; Sandhiya, Lakshmanan; Bhuvanesh, Nattamai S. P.; Senthilkumar, Kittusamy; Karvembu, Ramasamy","Structural diversity in aroylthiourea copper complexes ‒ formation and biological evaluation of [Cu(i)(μ-S)SCl]2, cis-Cu(ii)S2O2, trans-Cu(ii)S2O2and Cu(i)S3cores","New J. Chem.","2016","40","6","5401","","10.1039/C5NJ03536H","","","0.71073","MoKα","","0.0322","0.0288","","","0.0747","0.0773","","","","","","1.049","","","","has coordinates","183723","2020-10-21","18:00:00",""
"7055480","19.109","0.004","8.808","0.0018","20.086","0.004","90","","90","","90","","3380.7","1.2","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C18 H15 Cl N2 O2 S -","- C18 H15 Cl N2 O2 S -","- C144 H120 Cl8 N16 O16 S8 -","8","2","","Sharafi-Kolkeshvandi, Mahnaz; Nematollahi, Davood; Nikpour, Farzad; Salahifar, Eslam","Electrochemical synthesis of 1-N-phenyl-4-(sulfonyl)benzene-1,2-diamine derivatives: a mild and regioselective protocol","New J. Chem.","2016","40","6","5442","","10.1039/C5NJ03514G","","","0.71073","MoKα","","0.0549","0.0344","","","0.0617","0.0654","","","","","","0.852","","","","has coordinates","183724","2020-10-21","18:00:00",""
"7055481","14.054","0.002","14.054","0.002","14.669","0.003","90","","90","","120","","2509.2","0.7","100","2","100","2","","","","","","","","4","P 3 1 c","P 3 -2c","159","","","","- Co2 K7 O112 U24 -","- Co2 K7 O112 U24 -","- Co2 K7 O112 U24 -","1","0.166667","","Zhang, Yingjie; Čejka, Jiří; Lumpkin, Gregory R.; Tran, Toan Trong; Aharonovich, Igor; Karatchevtseva, Inna; Price, Jason R.; Scales, Nicholas; Lu, Kim","Hydrothermal synthesis, structures and properties of two uranyl oxide hydroxyl hydrate phases with Co(ii) or Ni(ii) ions","New J. Chem.","2016","40","6","5357","","10.1039/C5NJ03055B","","","0.7294","Synchrotron","","0.0286","0.0284","","","0.0689","0.069","","","","","","1.13","","","","has coordinates","183726","2020-10-21","18:00:00",""
"7055482","14.042","0.002","14.042","0.002","14.643","0.003","90","","90","","120","","2500.5","0.7","100","2","100","2","","","","","","","","4","P 3 1 c","P 3 -2c","159","","","","- K7 Ni2 O112 U24 -","- K7 Ni2 O112 U24 -","- K7 Ni2 O112 U24 -","1","0.166667","","Zhang, Yingjie; Čejka, Jiří; Lumpkin, Gregory R.; Tran, Toan Trong; Aharonovich, Igor; Karatchevtseva, Inna; Price, Jason R.; Scales, Nicholas; Lu, Kim","Hydrothermal synthesis, structures and properties of two uranyl oxide hydroxyl hydrate phases with Co(ii) or Ni(ii) ions","New J. Chem.","2016","40","6","5357","","10.1039/C5NJ03055B","","","0.7294","Synchrotron","","0.026","0.026","","","0.0637","0.0637","","","","","","1.109","","","","has coordinates","183726","2020-10-21","18:00:00",""
"7055483","6.7527","0.0002","12.1817","0.0004","13.4598","0.0005","70.658","0.001","76.203","0.001","86.532","0.001","1014.35","0.06","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 N4 O10 V -","- C16 H20 N4 O10 V -","- C32 H40 N8 O20 V2 -","2","1","","Fernández, Belén; Gómez-Vílchez, Alejandro; Sánchez-González, Cristina; Bayón, Jakelhyne; San Sebastián, Eider; Gómez-Ruiz, Santiago; López-Chaves, Carlos; Aranda, Pilar; Llopis, Juan; Rodríguez-Diéguez, Antonio","Novel anti-diabetic and luminescent coordination compounds based on vanadium","New J. Chem.","2016","40","6","5387","","10.1039/C5NJ02907D","","","0.71073","MoKα","","0.0348","0.0283","","","0.0685","0.0715","","","","","","1.052","","","","has coordinates","183728","2020-10-21","18:00:00",""
"7055484","9.1728","0.0007","23.781","0.002","8.3034","0.0007","90","","93.441","0.001","90","","1808","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H20 N4 O10 V -","- C12 H20 N4 O10 V -","- C48 H80 N16 O40 V4 -","4","1","","Fernández, Belén; Gómez-Vílchez, Alejandro; Sánchez-González, Cristina; Bayón, Jakelhyne; San Sebastián, Eider; Gómez-Ruiz, Santiago; López-Chaves, Carlos; Aranda, Pilar; Llopis, Juan; Rodríguez-Diéguez, Antonio","Novel anti-diabetic and luminescent coordination compounds based on vanadium","New J. Chem.","2016","40","6","5387","","10.1039/C5NJ02907D","","","0.71069","MoKα","","0.0403","0.0342","","","0.0893","0.0932","","","","","","1.068","","","","has coordinates","183728","2020-10-21","18:00:00",""
"7055485","23.9537","0.0005","41.5149","0.0009","23.8634","0.0004","90","","108.316","0.002","90","","22528.4","0.8","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C96 H104 F15 N18.5 O32.5 P2.5 Ru3 Tb -","- C96 H66 F15 N18.5 O32.5 P2.5 Ru3 Tb -","- C768 H528 F120 N148 O260 P20 Ru24 Tb8 -","8","1","","Zhang, Lu-Yin; Li, Kang; Pan, Mei; Fan, Ya-Nan; Wang, Hai-Ping; Su, Cheng-Yong","Observation of cascade f →d →f energy transfer in sensitizing near-infrared (NIR) lanthanide complexes containing the Ru(ii) polypyridine metalloligand","New J. Chem.","2016","40","6","5379","","10.1039/C6NJ00089D","","","1.54178","CuKα","","0.1222","0.0826","","","0.2135","0.2516","","","","","","1.035","","","","has coordinates","183734","2020-10-21","18:00:00",""
"7055486","28.487","0.002","24.612","0.004","12.984","0.005","90","","90","","90","","9103","4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C60 H112 Cl6 Cu6 N24 O29 -","- C60 H112 Cl6 Cu6 N24 O29 -","- C240 H448 Cl24 Cu24 N96 O116 -","4","0.5","","Pitarch-Jarque, Javier; Belda, Raquel; Blasco, Salvador; Navarro, Pilar; Tejero, Roberto; Junquera-Hernández, José Miguel; Pérez-Mondéjar, Vicente; García-España, Enrique","A water molecule in the interior of a 1H-pyrazole Cu2+metallocage","New J. Chem.","2016","40","7","5670","","10.1039/C5NJ03234B","","","0.71073","MoKα","","0.2355","0.0811","","","0.2095","0.2836","","","","","","0.889","","","","has coordinates,has disorder","185597","2020-10-21","18:00:00",""
"7055487","8.919","0.0003","9.336","0.0004","9.741","0.0003","65.97","0.002","89.173","0.002","70.563","0.002","691.66","0.05","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H38 Cl2 N8 O8 -","- C20 H38 Cl2 N8 O8 -","- C20 H38 Cl2 N8 O8 -","1","0.5","","Pitarch-Jarque, Javier; Belda, Raquel; Blasco, Salvador; Navarro, Pilar; Tejero, Roberto; Junquera-Hernández, José Miguel; Pérez-Mondéjar, Vicente; García-España, Enrique","A water molecule in the interior of a 1H-pyrazole Cu2+metallocage","New J. Chem.","2016","40","7","5670","","10.1039/C5NJ03234B","","","0.71073","MoKα","","0.0644","0.0507","","","0.1291","0.1403","","","","","","1.033","","","","has coordinates,has disorder","185597","2020-10-21","18:00:00",""
"7055488","23.503","0.0007","14.462","0.0004","17.167","0.0004","90","","101.723","0.001","90","","5713.4","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H70 Cl4 Cu4 N16 O17 -","- C40 H70 Cl4 Cu4 N16 O17 -","- C160 H280 Cl16 Cu16 N64 O68 -","4","0.5","","Pitarch-Jarque, Javier; Belda, Raquel; Blasco, Salvador; Navarro, Pilar; Tejero, Roberto; Junquera-Hernández, José Miguel; Pérez-Mondéjar, Vicente; García-España, Enrique","A water molecule in the interior of a 1H-pyrazole Cu2+metallocage","New J. Chem.","2016","40","7","5670","","10.1039/C5NJ03234B","","","0.71073","MoKα","","0.1107","0.0717","","","0.1991","0.2247","","","","","","1.038","","","","has coordinates,has disorder","185597","2020-10-21","18:00:00",""
"7055489","28.221","0.003","24.265","0.01","12.8478","0.0009","90","","90","","90","","8798","4","120","0.1","120","0.1","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C120 H228 Cl12 Cu12 N48 O61 -","- C120 H228 Cl12 Cu12 N48 O61 -","- C240 H456 Cl24 Cu24 N96 O122 -","2","0.25","","Pitarch-Jarque, Javier; Belda, Raquel; Blasco, Salvador; Navarro, Pilar; Tejero, Roberto; Junquera-Hernández, José Miguel; Pérez-Mondéjar, Vicente; García-España, Enrique","A water molecule in the interior of a 1H-pyrazole Cu2+metallocage","New J. Chem.","2016","40","7","5670","","10.1039/C5NJ03234B","","x-ray","0.71073","MoKα","","0.2546","0.0996","","","0.2376","0.3457","","","","","","1.016","","","","has coordinates,has disorder","185597","2020-10-21","18:00:00",""
"7055490","12.0759","0.0005","14.4835","0.0006","18.6853","0.0008","88.419","0.003","80.246","0.004","70.061","0.004","3026.2","0.2","120","0.1","120","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C40 H76 Cl4 Cu4 N16 O20 -","- C40 H76 Cl4 Cu4 N16 O20 -","- C80 H152 Cl8 Cu8 N32 O40 -","2","1","","Pitarch-Jarque, Javier; Belda, Raquel; Blasco, Salvador; Navarro, Pilar; Tejero, Roberto; Junquera-Hernández, José Miguel; Pérez-Mondéjar, Vicente; García-España, Enrique","A water molecule in the interior of a 1H-pyrazole Cu2+metallocage","New J. Chem.","2016","40","7","5670","","10.1039/C5NJ03234B","","","0.7107","MoKα","","0.0628","0.0475","","","0.1167","0.1309","","","","","","1.045","","","","has coordinates,has disorder","185597","2020-10-21","18:00:00",""
"7055491","15.483","0.003","5.4173","0.001","19.632","0.003","90","","114.484","0.012","90","","1498.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11 N9 O10 -","- C8 H11 N9 O10 -","- C32 H44 N36 O40 -","4","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Wu, Le","Energetic salts based on 3-hydrazino-4-amino-1,2,4-triazole (HATr): synthesis and properties","New J. Chem.","2016","40","6","5414","","10.1039/C6NJ00308G","","","0.71073","MoKα","","0.1109","0.0544","","","0.1211","0.1514","","","","","","1.001","","","","has coordinates","183722","2020-10-21","18:00:00",""
"7055492","8.0048","0.0018","11.527","0.002","13.178","0.002","69.469","0.009","73.214","0.009","80.053","0.01","1086.7","0.4","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H14 N12 O15 -","- C14 H14 N12 O15 -","- C28 H28 N24 O30 -","2","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Wu, Le","Energetic salts based on 3-hydrazino-4-amino-1,2,4-triazole (HATr): synthesis and properties","New J. Chem.","2016","40","6","5414","","10.1039/C6NJ00308G","","","0.71073","MoKα","","0.0833","0.0544","","","0.1486","0.2111","","","","","","1.095","","","","has coordinates","183722","2020-10-21","18:00:00",""
"7055493","7.9601","0.0018","15.917","0.004","7.096","0.0016","90","","106.398","0.003","90","","862.5","0.4","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C2 H8 N8 O6 -","- C2 H8 N8 O6 -","- C8 H32 N32 O24 -","4","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Wu, Le","Energetic salts based on 3-hydrazino-4-amino-1,2,4-triazole (HATr): synthesis and properties","New J. Chem.","2016","40","6","5414","","10.1039/C6NJ00308G","","","0.71073","MoKα","","0.0411","0.0342","","","0.0754","0.079","","","","","","1.002","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7055494","12.455","0.004","7.156","0.002","22.215","0.007","90","","103.497","0.004","90","","1925.3","1","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H8 N10 O3 -","- C4 H8 N10 O3 -","- C32 H64 N80 O24 -","8","2","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Wu, Le","Energetic salts based on 3-hydrazino-4-amino-1,2,4-triazole (HATr): synthesis and properties","New J. Chem.","2016","40","6","5414","","10.1039/C6NJ00308G","","","0.71073","MoKα","","0.0812","0.0587","","","0.1455","0.1631","","","","","","0.997","","","","has coordinates","198632","2020-10-21","18:00:00",""
"7055495","7.972","0.0006","8.1923","0.0008","10.269","0.0009","90.378","0.001","110.218","0.002","115.52","0.002","558.28","0.09","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 H8 N16 O2 -","- C4 H8 N16 O2 -","- C8 H16 N32 O4 -","2","1","","Wu, Jin-Ting; Zhang, Jian-Guo; Yin, Xin; Wu, Le","Energetic salts based on 3-hydrazino-4-amino-1,2,4-triazole (HATr): synthesis and properties","New J. Chem.","2016","40","6","5414","","10.1039/C6NJ00308G","","","0.71073","MoKα","","0.1465","0.0996","","","0.279","0.3041","","","","","","1.052","","","","has coordinates","183722","2020-10-21","18:00:00",""
"7055496","15.27","0.004","9.4879","0.0019","33.952","0.006","90","","90","","90","","4919","1.8","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-(3-(3-cyano-6-methyl-2-oxo-4-phenylpyridin-1(2H)-yl)propoxy)-4-methyl-6-phenylnicotinonitrile","","- C29 H24 N4 O2 -","- C29 H24 N4 O2 -","- C232 H192 N32 O16 -","8","1","","Rai, Sunil K.; Singh, Praveen; Khanam, Shaziya; Tewari, Ashish K.","Polymorphic study and anti-inflammatory activity of a 3-cyano-2-pyridone based flexible model","New J. Chem.","2016","40","6","5577","","10.1039/C5NJ03683F","","","0.71073","MoKα","","0.1471","0.0786","","","0.1839","0.2383","","","","","","1.027","","","","has coordinates","183727","2020-10-21","18:00:00",""
"7055497","7.2217","0.0006","14.0412","0.0013","24.134","0.002","90","","95.641","0.009","90","","2435.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-(3-(3-cyano-6-methyl-2-oxo-4-phenylpyridin-1(2H)-yl)propoxy)-4-methyl-6-phenylnicotinonitrile","","- C29 H24 N4 O2 -","- C29 H24 N4 O2 -","- C116 H96 N16 O8 -","4","1","","Rai, Sunil K.; Singh, Praveen; Khanam, Shaziya; Tewari, Ashish K.","Polymorphic study and anti-inflammatory activity of a 3-cyano-2-pyridone based flexible model","New J. Chem.","2016","40","6","5577","","10.1039/C5NJ03683F","","","0.71073","MoKα","","0.0956","0.0531","","","0.1172","0.1393","","","","","","0.992","","","","has coordinates","183727","2020-10-21","18:00:00",""
"7055498","10.5846","0.0004","7.6098","0.0003","21.9235","0.001","90","","100.651","0.002","90","","1735.44","0.12","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","mono BODIPY of 1,4-di(2-pyridyl)aminophthalazine","","","- C18 H15 B F2 N6 O -","- C18 H15 B F2 N6 O -","- C72 H60 B4 F8 N24 O4 -","4","1","","Vuong, Thi Minh Ha; Weimmerskirch-Aubatin, Jennifer; Lohier, Jean-François; Bar, Nathalie; Boudin, Sophie; Labbé, Christophe; Gourbilleau, Fabrice; Nguyen, Hien; Dang, Tung Thanh; Villemin, Didier","Blue highly fluorescent boron difluoride complexes based on phthalazine‒pyridine","New J. Chem.","2016","40","7","6070","","10.1039/C6NJ00726K","","","0.71073","MoKα","","0.0506","0.0388","","","0.0996","0.1076","","","","","","1.034","","","","has coordinates","185567","2020-10-21","18:00:00",""
"7055499","18.6371","0.0006","7.9394","0.0002","23.778","0.0008","90","","92.779","0.002","90","","3514.23","0.19","115","","115","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H36 Cu N6 O13 P2 -","- C32 H36 Cu N6 O13 P2 -","- C128 H144 Cu4 N24 O52 P8 -","4","1","","Mitrofanov, Alexander Yu.; Rousselin, Yoann; Guilard, Roger; Brandès, Stéphane; Bessmertnykh-Lemeune, Alla G.; Uvarova, Marina A.; Nefedov, Sergey E.","Copper(ii) complexes with phosphorylated 1,10-phenanthrolines: from molecules to infinite supramolecular arrays","New J. Chem.","2016","40","7","5896","","10.1039/C5NJ03572D","","x-ray","0.71073","MoKα","","0.0567","0.0403","","","0.0966","0.1055","","","","","","1.079","","","","has coordinates,has disorder","185579","2020-10-21","18:00:00",""
"7055500","15.6819","0.0007","10.5814","0.0005","25.5715","0.0014","90","","90","","90","","4243.2","0.4","115","","115","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H17 Cu N4 O9 P -","- C16 H17 Cu N4 O9 P -","- C128 H136 Cu8 N32 O72 P8 -","8","1","","Mitrofanov, Alexander Yu.; Rousselin, Yoann; Guilard, Roger; Brandès, Stéphane; Bessmertnykh-Lemeune, Alla G.; Uvarova, Marina A.; Nefedov, Sergey E.","Copper(ii) complexes with phosphorylated 1,10-phenanthrolines: from molecules to infinite supramolecular arrays","New J. Chem.","2016","40","7","5896","","10.1039/C5NJ03572D","","x-ray","0.71073","MoKα","","0.0572","0.0362","","","0.0803","0.0889","","","","","","1.03","","","","has coordinates,has disorder","185579","2020-10-21","18:00:00",""
"7055501","7.7003","0.0006","9.8407","0.0008","17.8602","0.0016","105.813","0.002","92.591","0.003","90.967","0.002","1300.23","0.19","115","","115","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H52 Cu2 N8 O24 P4 -","- C40 H52 Cu2 N8 O24 P4 -","- C40 H52 Cu2 N8 O24 P4 -","1","0.5","","Mitrofanov, Alexander Yu.; Rousselin, Yoann; Guilard, Roger; Brandès, Stéphane; Bessmertnykh-Lemeune, Alla G.; Uvarova, Marina A.; Nefedov, Sergey E.","Copper(ii) complexes with phosphorylated 1,10-phenanthrolines: from molecules to infinite supramolecular arrays","New J. Chem.","2016","40","7","5896","","10.1039/C5NJ03572D","","x-ray","0.71073","MoKα","","0.0471","0.0319","","","0.0792","0.0867","","","","","","1.039","","","","has coordinates","185579","2020-10-21","18:00:00",""
"7055502","9.6399","0.0012","12.1111","0.0014","12.1162","0.0016","77.046","0.006","88.932","0.006","77.832","0.006","1347","0.3","115","","115","","","","","","","","","6","P -1","-P 1","2","","","","- C40 H52 Cu2 N8 O24 P4 -","- C40 H52 Cu2 N8 O24 P4 -","- C40 H52 Cu2 N8 O24 P4 -","1","0.5","","Mitrofanov, Alexander Yu.; Rousselin, Yoann; Guilard, Roger; Brandès, Stéphane; Bessmertnykh-Lemeune, Alla G.; Uvarova, Marina A.; Nefedov, Sergey E.","Copper(ii) complexes with phosphorylated 1,10-phenanthrolines: from molecules to infinite supramolecular arrays","New J. Chem.","2016","40","7","5896","","10.1039/C5NJ03572D","","x-ray","0.71073","MoKα","","0.0495","0.0336","","","0.0756","0.0813","","","","","","1.05","","","","has coordinates","185579","2020-10-21","18:00:00",""
"7055503","16.2508","0.0006","9.204","0.0004","34.9028","0.0015","90","","90","","90","","5220.5","0.4","100","","100","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H26 Cu N4 O12 P2 -","- C20 H26 Cu N4 O12 P2 -","- C160 H208 Cu8 N32 O96 P16 -","8","1","","Mitrofanov, Alexander Yu.; Rousselin, Yoann; Guilard, Roger; Brandès, Stéphane; Bessmertnykh-Lemeune, Alla G.; Uvarova, Marina A.; Nefedov, Sergey E.","Copper(ii) complexes with phosphorylated 1,10-phenanthrolines: from molecules to infinite supramolecular arrays","New J. Chem.","2016","40","7","5896","","10.1039/C5NJ03572D","","x-ray","1.54178","CuKα","","0.1029","0.0994","","","0.2459","0.248","","","","","","1.181","","","","has coordinates,has disorder","185579","2020-10-21","18:00:00",""
"7055504","12.7108","0.0004","22.8673","0.0005","14.7326","0.0003","90","","94.369","0.002","90","","4269.76","0.19","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","di-(μ~2~-2,6-diacetylpyridine bis(3-chloropyridazine-6-hydrazonato))- μ~2~-peroxido-di-cobalt(III)) tetrahydrate","di-(μ~2~-2,6-diacetylpyridine bis(3-chloropyridazine-6-hydrazonato))- μ~2~-peroxido-di-cobalt(III)) tetrahydrate","","- C34 H34 Cl4 Co2 N18 O6 -","- C34 H26 Cl4 Co2 N18 O6 -","- C136 H104 Cl16 Co8 N72 O24 -","4","0.5","","Barta Holló, B.; Magyari, J.; Armaković, S.; Bogdanović, G. A.; Rodić, M. V.; Armaković, S. J.; Molnár, J.; Spengler, G.; Leovac, V. M.; Mészáros Szécsényi, K.","Coordination compounds of a hydrazone derivative with Co(iii), Ni(ii), Cu(ii) and Zn(ii): synthesis, characterization, reactivity assessment and biological evaluation","New J. Chem.","2016","40","7","5885","","10.1039/C6NJ00560H","","","0.71073","MoKα","","0.0548","0.0375","","","0.0934","0.1007","","","","","","1.053","","","","has coordinates","185590","2020-10-21","18:00:00",""
"7055505","32.5727","0.0006","11.6539","0.0003","22.851","0.0005","90","","92.546","0.002","90","","8665.7","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5a","","- C39 H68 Fe N12 P4 -","- C39 H68 Fe N12 P4 -","- C312 H544 Fe8 N96 P32 -","8","1","","Okumuş, Aytuğ; Elmas, Gamze; Cemaloğlu, Reşit; Aydın, Betül; Binici, Arzu; Şimşek, Hülya; Açık, Leyla; Türk, Mustafa; Güzel, Remziye; Kılıç, Zeynel; Hökelek, Tuncer","Phosphorus‒nitrogen compounds. Part 35. Syntheses, spectroscopic and electrochemical properties, and antituberculosis, antimicrobial and cytotoxic activities of mono-ferrocenyl-spirocyclotetraphosphazenes","New J. Chem.","2016","40","6","5588","","10.1039/C6NJ00204H","","","0.71073","MoKα","","0.0478","0.039","","","0.0942","0.0995","","","","","","1.037","","","","has coordinates","183736","2020-10-21","18:00:00",""
"7055506","33.4714","0.0006","11.0459","0.0003","23.2196","0.0004","90","","94.801","0.002","90","","8554.7","0.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4a","","- C38 H66 Fe N12 P4 -","- C38 H66 Fe N12 P4 -","- C304 H528 Fe8 N96 P32 -","8","1","","Okumuş, Aytuğ; Elmas, Gamze; Cemaloğlu, Reşit; Aydın, Betül; Binici, Arzu; Şimşek, Hülya; Açık, Leyla; Türk, Mustafa; Güzel, Remziye; Kılıç, Zeynel; Hökelek, Tuncer","Phosphorus‒nitrogen compounds. Part 35. Syntheses, spectroscopic and electrochemical properties, and antituberculosis, antimicrobial and cytotoxic activities of mono-ferrocenyl-spirocyclotetraphosphazenes","New J. Chem.","2016","40","6","5588","","10.1039/C6NJ00204H","","","0.71073","MoKα","","0.0797","0.0624","","","0.1612","0.1751","","","","","","1.031","","","","has coordinates","183736","2020-10-21","18:00:00",""
"7055507","8.2316","0.0005","9.5937","0.0005","12.7855","0.0007","93.595","0.004","102.892","0.005","96.844","0.004","973.06","0.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","1-(3,5-dinitropyrazol-1-yl)-2-nitrazapropane","","- C5 H6 N6 O6 -","- C5 H6 N6 O6 -","- C20 H24 N24 O24 -","4","2","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.048","0.0316","","","0.0755","0.0797","","","","","","0.943","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055508","17.1342","0.0016","9.368","0.0008","12.5388","0.0012","90","","107.4","0.01","90","","1920.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(3,4-dinitropyrazol-1-yl)-2-nitrazapropane","","- C5 H6 N6 O6 -","- C5 H6 N6 O6 -","- C40 H48 N48 O48 -","8","2","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71069","MoKα","","0.1104","0.0375","","","0.0492","0.0575","","","","","","0.728","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055509","8.5617","0.0009","9.3986","0.0009","9.7876","0.001","113.277","0.009","106.073","0.009","92.266","0.008","685.23","0.14","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","1-(3,4,4'-Trinitro-1,3'-bipyrazol-2'-yl)-2-nitrazapropane","","- C8 H7 N9 O8 -","- C8 H7 N9 O8 -","- C16 H14 N18 O16 -","2","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.068","0.0356","","","0.064","0.0696","","","","","","0.822","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055510","5.6441","0.0006","12.082","0.0012","15.3446","0.0015","90","","98.068","0.01","90","","1036.02","0.18","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-(5-chloro-3,4-dinitropyrazol-1-yl)-2-nitrazapropane","","- C5 H5 Cl N6 O6 -","- C5 H5 Cl N6 O6 -","- C20 H20 Cl4 N24 O24 -","4","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.0647","0.0335","","","0.0669","0.0723","","","","","","0.849","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055511","6.3027","0.0008","6.8628","0.0008","10.6253","0.0014","72.876","0.011","87.968","0.011","77.54","0.011","428.68","0.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","ANTAnap","1-(5-amino-3-nitro-1,2,4-triazol-1-yl)-2-nitrazapropane","","- C4 H7 N7 O4 -","- C4 H7 N7 O4 -","- C8 H14 N14 O8 -","2","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.0466","0.0332","","","0.0755","0.0839","","","","","","1.073","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055512","17.5192","0.0017","6.4082","0.0006","14.2","0.0014","90","","99.184","0.009","90","","1573.7","0.3","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","DNBTdinap","5,5-bis(1-(2-aza-2-nitropropanyl)-3-nitro-1,2,4-triazole","","- C8 H10 N12 O8 -","- C8 H10 N12 O8 -","- C32 H40 N48 O32 -","4","0.5","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.0627","0.0411","","","0.0895","0.1022","","","","","","1.043","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055513","15.9508","0.0016","5.6426","0.0007","10.6832","0.0011","90","","97.579","0.009","90","","953.13","0.18","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-amino-3,5-dinitropyrazol-1-yl)-2-nitrazapropane","","- C5 H7 N7 O6 -","- C5 H7 N7 O6 -","- C20 H28 N28 O24 -","4","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.0591","0.0433","","","0.0946","0.1081","","","","","","1.104","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055514","15.831","0.004","7.0572","0.0007","11.133","0.003","90","","132.07","0.04","90","","923.3","0.7","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1-(3,5-Dinitro-1,2,4-triazol-1-yl)-2-nitrazapropane","","- C4 H5 N7 O6 -","- C4 H5 N7 O6 -","- C16 H20 N28 O24 -","4","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71069","MoKα","","0.0472","0.0306","","","0.0515","0.0547","","","","","","0.895","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055515","5.7787","0.0008","20.764","0.003","7.719","0.0011","90","","92.393","0.012","90","","925.4","0.2","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1-(4,5-dinitroimidazol-1-yl)-2-nitrazapropane","","- C5 H6 N6 O6 -","- C5 H6 N6 O6 -","- C20 H24 N24 O24 -","4","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71069","MoKα","","0.0653","0.0388","","","0.0782","0.0834","","","","","","0.861","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055516","11.4913","0.0012","6.9525","0.0005","12.8652","0.0011","90","","113.537","0.01","90","","942.33","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(2,4-dinitroimidazol-1-yl)-2-nitrazapropane","","- C5 H6 N6 O6 -","- C5 H6 N6 O6 -","- C20 H24 N24 O24 -","4","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.0635","0.0322","","","0.063","0.068","","","","","","0.835","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055517","10.828","0.002","5.5849","0.0011","12.363","0.003","90","","107.59","0.03","90","","712.7","0.3","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2,4-bis(methyl(nitro)amino)methyl)-3-nitro-1,2,4-triazol-5-one","","- C6 H11 N9 O10 -","- C6 H11 N9 O10 -","- C12 H22 N18 O20 -","2","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.0529","0.0349","","","0.0577","0.0611","","","","","","0.865","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055518","6.761","0.0006","5.5064","0.0006","11.3925","0.001","90","","97.072","0.009","90","","420.9","0.07","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1-(3-nitro-1H-1,2,4-triazol-5-on-4-yl)-2-nitrazapropane","","- C4 H6 N6 O5 -","- C4 H6 N6 O5 -","- C8 H12 N12 O10 -","2","1","","Klapötke, Thomas M.; Penger, Alexander; Pflüger, Carolin; Stierstorfer, Jörg","Melt-cast materials: combining the advantages of highly nitrated azoles and open-chain nitramines","New J. Chem.","2016","40","7","6059","","10.1039/C6NJ00202A","","","0.71073","MoKα","","0.0567","0.0344","","","0.0488","0.0527","","","","","","0.84","","","","has coordinates","185599","2020-10-21","18:00:00",""
"7055519","11.1967","0.0004","11.1967","0.0004","44.0828","0.0016","90","","90","","120","","4786.1","0.3","273","","273","","","","","","","","","5","P 65 2 2","P 65 2 (0 0 1)","179","","","","- C36.5 H29.5 N3 O7 Zn -","- C36.5 H29.5 N3 O7 Zn -","- C219 H177 N18 O42 Zn6 -","6","0.5","","Tanaka, Koichi; Hotta, Naoki; Nagase, Shohei; Yoza, Kenji","Efficient HPLC enantiomer separation using a pillared homochiral metal‒organic framework as a novel chiral stationary phase","New J. Chem.","2016","40","6","4891","","10.1039/C6NJ00090H","","","1.54178","CuKα","","0.0271","0.0269","","","0.073","0.0731","","","","","","1.106","","","","has coordinates,has disorder","183741","2020-10-21","18:00:00",""
"7055520","21.9801","0.001","13.6765","0.0006","25.5651","0.0011","90","","102.217","0.002","90","","7511.1","0.6","93","","93","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C72 H53 N5 O13 Zn2 -","- C72 H53 N5 O13 Zn2 -","- C288 H212 N20 O52 Zn8 -","4","1","","Tanaka, Koichi; Hotta, Naoki; Nagase, Shohei; Yoza, Kenji","Efficient HPLC enantiomer separation using a pillared homochiral metal‒organic framework as a novel chiral stationary phase","New J. Chem.","2016","40","6","4891","","10.1039/C6NJ00090H","","","1.54178","CuKα","","0.0374","0.0353","","","0.089","0.0902","","","","","","1.039","","","","has coordinates,has disorder","183741","2020-10-21","18:00:00",""
"7055521","16.9299","0.0006","14.845","0.0008","19.6945","0.0008","90","","90","","90","","4949.7","0.4","291","2","291.15","","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C36 H40 Cu4 I8 N8 -","- C36 H40 Cu4 I8 N8 -","- C144 H160 Cu16 I32 N32 -","4","0.25","","Xu, Man-Man; Li, Yao; Zheng, Lin-Jie; Niu, Yun-Yin; Hou, Hong-Wei","Three cation-templated Cu(i) self-assemblies: synthesis, structures, and photocatalytic properties","New J. Chem.","2016","40","7","6086","","10.1039/C5NJ03321G","","","0.71073","MoKα","","0.074","0.0569","","","0.1578","0.1712","","","","","","1.054","","","","has coordinates,has disorder","185573","2020-10-21","18:00:00",""
"7055522","10.8207","0.0006","12.6826","0.0006","9.658","0.0005","90","","108.391","0.006","90","","1257.72","0.12","291","2","291.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 Cu N4 S2 -","- C11 H10 Cu N4 S2 -","- C44 H40 Cu4 N16 S8 -","4","1","","Xu, Man-Man; Li, Yao; Zheng, Lin-Jie; Niu, Yun-Yin; Hou, Hong-Wei","Three cation-templated Cu(i) self-assemblies: synthesis, structures, and photocatalytic properties","New J. Chem.","2016","40","7","6086","","10.1039/C5NJ03321G","","","0.71073","MoKα","","0.052","0.0369","","","0.0756","0.0831","","","","","","1.024","","","","has coordinates","185573","2020-10-21","18:00:00",""
"7055523","13.7812","0.0013","7.501","0.0008","15.1787","0.0014","90","","99.598","0.001","90","","1547.1","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 N2 O18 U2 -","- C28 H22 N2 O18 U2 -","- C56 H44 N4 O36 U4 -","2","0.5","","Gao, Xue; Song, Jian; Sun, Li Xian; Xing, Yong Heng; Bai, Feng Ying; Shi, Zhan","A family of uranium‒carboxylic acid hybrid materials: synthesis, structure and mixed-dye selective adsorption","New J. Chem.","2016","40","7","6077","","10.1039/C6NJ00109B","","","0.71073","MoKα","","0.0215","0.0181","","","0.0425","0.0434","","","","","","1.061","","","","has coordinates","185578","2020-10-21","18:00:00",""
"7055524","5.6911","0.0005","7.4024","0.0006","9.8667","0.0008","106.561","0.001","105.897","0.001","99.948","0.001","368.73","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H12 N2 O8 U -","- C12 H12 N2 O8 U -","- C12 H12 N2 O8 U -","1","0.5","","Gao, Xue; Song, Jian; Sun, Li Xian; Xing, Yong Heng; Bai, Feng Ying; Shi, Zhan","A family of uranium‒carboxylic acid hybrid materials: synthesis, structure and mixed-dye selective adsorption","New J. Chem.","2016","40","7","6077","","10.1039/C6NJ00109B","","","0.71073","MoKα","","0.0167","0.0167","","","0.0431","0.0431","","","","","","1.067","","","","has coordinates","185578","2020-10-21","18:00:00",""
"7055525","20.379","0.003","11.7334","0.0018","12.529","0.002","90","","103.34","0.002","90","","2915","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H29 N O8 U -","- C29 H29 N O8 U -","- C116 H116 N4 O32 U4 -","4","1","","Gao, Xue; Song, Jian; Sun, Li Xian; Xing, Yong Heng; Bai, Feng Ying; Shi, Zhan","A family of uranium‒carboxylic acid hybrid materials: synthesis, structure and mixed-dye selective adsorption","New J. Chem.","2016","40","7","6077","","10.1039/C6NJ00109B","","","0.71073","MoKα","","0.0765","0.0396","","","0.0773","0.0859","","","","","","0.909","","","","has coordinates","185578","2020-10-21","18:00:00",""
"7055526","5.5561","0.0004","15.252","0.0011","13.3506","0.0009","90","","93.974","0.001","90","","1128.63","0.14","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C2 H6 O13 U2 -","- C2 H6 O13 U2 -","- C8 H24 O52 U8 -","4","1","","Gao, Xue; Song, Jian; Sun, Li Xian; Xing, Yong Heng; Bai, Feng Ying; Shi, Zhan","A family of uranium‒carboxylic acid hybrid materials: synthesis, structure and mixed-dye selective adsorption","New J. Chem.","2016","40","7","6077","","10.1039/C6NJ00109B","","","0.71073","MoKα","","0.0318","0.0269","","","0.063","0.0649","","","","","","1.109","","","","has coordinates","185578","2020-10-21","18:00:00",""
"7055527","10.9314","0.0001","13.1412","0.0002","18.7929","0.0003","90","","117.028","0.001","90","","2404.79","0.06","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 N3 O4 Rh -","- C28 H22 N3 O4 Rh -","- C112 H88 N12 O16 Rh4 -","4","1","","Zhang, Hai-Rong; Liu, Yan-Cheng; Chen, Zhen-Feng; Meng, Ting; Zou, Bi-Qun; Liu, You-Nian; Liang, Hong","Studies on the structures, cytotoxicity and apoptosis mechanism of 8-hydroxylquinoline rhodium(iii) complexes in T-24 cells","New J. Chem.","2016","40","7","6005","","10.1039/C6NJ00182C","","","0.7107","MoKα","","0.0353","0.0288","","","0.0652","0.0685","","","","","","1.037","","","","has coordinates","185585","2020-10-21","18:00:00",""
"7055528","8.0116","0.0006","11.7397","0.001","12.2484","0.0007","78.326","0.006","88.221","0.005","89.46","0.006","1127.63","0.15","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H14 Br2 Cl N2 O4 Rh -","- C19 H14 Br2 Cl N2 O4 Rh -","- C38 H28 Br4 Cl2 N4 O8 Rh2 -","2","1","","Zhang, Hai-Rong; Liu, Yan-Cheng; Chen, Zhen-Feng; Meng, Ting; Zou, Bi-Qun; Liu, You-Nian; Liang, Hong","Studies on the structures, cytotoxicity and apoptosis mechanism of 8-hydroxylquinoline rhodium(iii) complexes in T-24 cells","New J. Chem.","2016","40","7","6005","","10.1039/C6NJ00182C","","","0.7107","MoKα","","0.0549","0.0442","","","0.1156","0.1228","","","","","","1.059","","","","has coordinates,has disorder","185585","2020-10-21","18:00:00",""
"7055529","10.4051","0.0018","17.875","0.003","17.596","0.003","90","","104.341","0.002","90","","3170.7","0.9","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","IPrTaCl5","","","- C27 H36 Cl5 N2 Ta -","- C27 H36 Cl5 N2 Ta -","- C108 H144 Cl20 N8 Ta4 -","4","1","","Wei, ZhenHong; Zhang, Wenbiao; Luo, Guangming; Xu, Feng; Mei, YingXuan; Cai, Hu","Mono- and bis-N-heterocyclic carbene complexes of tantalum and niobium with high oxidation states","New J. Chem.","2016","40","7","6270","","10.1039/C6NJ00223D","","","0.71073","MoKα","","0.0568","0.0377","","","0.098","0.1053","","","","","","1.069","","","","has coordinates","185571","2020-10-21","18:00:00",""
"7055530","13.8499","0.001","15.0205","0.001","16.9789","0.0011","66.765","0.003","86.819","0.004","71.851","0.003","3075","0.4","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H56 Cl18 N4 Nb2 -","- C46 H56 Cl18 N4 Nb2 -","- C92 H112 Cl36 N8 Nb4 -","2","1","","Wei, ZhenHong; Zhang, Wenbiao; Luo, Guangming; Xu, Feng; Mei, YingXuan; Cai, Hu","Mono- and bis-N-heterocyclic carbene complexes of tantalum and niobium with high oxidation states","New J. Chem.","2016","40","7","6270","","10.1039/C6NJ00223D","","","0.71073","MoKα","","0.0802","0.06","","","0.1252","0.1417","","","","","","1.072","","","","has coordinates,has disorder","185571","2020-10-21","18:00:00",""
"7055531","13.87","0.002","15.029","0.002","17.015","0.003","66.68","0.002","86.872","0.002","71.673","0.002","3081.9","0.8","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H56 Cl18 N4 Ta2 -","- C46 H56 Cl18 N4 Ta2 -","- C92 H112 Cl36 N8 Ta4 -","2","1","","Wei, ZhenHong; Zhang, Wenbiao; Luo, Guangming; Xu, Feng; Mei, YingXuan; Cai, Hu","Mono- and bis-N-heterocyclic carbene complexes of tantalum and niobium with high oxidation states","New J. Chem.","2016","40","7","6270","","10.1039/C6NJ00223D","","","0.71073","MoKα","","0.0584","0.0454","","","0.1064","0.1165","","","","","","1.08","","","","has coordinates","185571","2020-10-21","18:00:00",""
"7055532","8.3421","0.0006","13.3327","0.001","16.7969","0.0012","90","","90","","90","","1868.2","0.2","170","2","170","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C17 H25 N O5 S Si -","- C17 H25 N O5 S Si -","- C68 H100 N4 O20 S4 Si4 -","4","1","","Singh, Gurjaspreet; Rani, Sunita; Arora, Aanchal; Aulakh, Darpandeep; Wriedt, Mario","Thioester-appended organosilatranes: synthetic investigations and application in the modification of magnetic silica surfaces","New J. Chem.","2016","40","7","6200","","10.1039/C6NJ00011H","","","0.71073","MoKα","","0.0405","0.0373","","","0.0975","0.1007","","","","","","1.039","","","","has coordinates,has disorder","185588","2020-10-21","18:00:00",""
"7055533","7.2068","0.0002","8.9671","0.0003","16.5006","0.0006","90","","93.343","0.001","90","","1064.52","0.06","170","2","170","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H27 N O4 S Si -","- C22 H27 N O4 S Si -","- C44 H54 N2 O8 S2 Si2 -","2","1","","Singh, Gurjaspreet; Rani, Sunita; Arora, Aanchal; Aulakh, Darpandeep; Wriedt, Mario","Thioester-appended organosilatranes: synthetic investigations and application in the modification of magnetic silica surfaces","New J. Chem.","2016","40","7","6200","","10.1039/C6NJ00011H","","","0.71073","MoKα","","0.0313","0.0287","","","0.0713","0.0726","","","","","","1.037","","","","has coordinates","185588","2020-10-21","18:00:00",""
"7055534","16.5717","0.001","22.3081","0.0013","11.7698","0.0007","90","","99.701","0.004","90","","4288.9","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 B N5 -","- C28 H20 B N5 -","- C224 H160 B8 N40 -","8","2","","Crandall, Laura A.; Rhoda, Hannah M.; Nemykin, Victor N.; Ziegler, Christopher J.","Boron templated synthesis of a BODIPY analogue from a phthalocyanine precursor","New J. Chem.","2016","40","7","5675","","10.1039/C6NJ00085A","","","1.54178","CuKα","","0.0563","0.0403","","","0.0898","0.0993","","","","","","0.962","","","","has coordinates","185564","2020-10-21","18:00:00",""
"7055535","8.8161","0.0005","10.6099","0.0006","13.5285","0.0008","78.972","0.002","86.357","0.003","84.524","0.003","1235.06","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H21 B Cl2 N4 O -","- C29 H21 B Cl2 N4 O -","- C58 H42 B2 Cl4 N8 O2 -","2","1","","Crandall, Laura A.; Rhoda, Hannah M.; Nemykin, Victor N.; Ziegler, Christopher J.","Boron templated synthesis of a BODIPY analogue from a phthalocyanine precursor","New J. Chem.","2016","40","7","5675","","10.1039/C6NJ00085A","","","0.71073","MoKα","","0.1833","0.0509","","","0.1268","0.1401","","","","","","1.125","","","","has coordinates,has disorder","185564","2020-10-21","18:00:00",""
"7055536","8.7931","0.0011","10.5963","0.0013","13.5308","0.0018","78.771","0.005","86.503","0.006","84.592","0.006","1229.9","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H20 B Cl2 N3 O2 -","- C29 H20 B Cl2 N3 O2 -","- C58 H40 B2 Cl4 N6 O4 -","2","1","","Crandall, Laura A.; Rhoda, Hannah M.; Nemykin, Victor N.; Ziegler, Christopher J.","Boron templated synthesis of a BODIPY analogue from a phthalocyanine precursor","New J. Chem.","2016","40","7","5675","","10.1039/C6NJ00085A","","","0.71073","MoKα","","0.0734","0.0572","","","0.1466","0.1611","","","","","","1.08","","","","has coordinates","185564","2020-10-21","18:00:00",""
"7055537","11.2845","0.0008","11.5944","0.0008","12.0744","0.0009","90","","114.97","0.009","90","","1432.1","0.2","290.8","0.1","290.8","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-arylidene-5-imidazolinone","","- C17 H14 N2 O2 -","- C17 H14 N2 O2 -","- C68 H56 N8 O8 -","4","1","","Singh, Thokchom Prasanta; Shunmugam, Raja","PCl3-mediated synthesis of green/cyan fluorescent protein chromophores using amino acids","New J. Chem.","2016","40","4","3024","","10.1039/C5NJ03144C","","x-ray","0.71073","MoKα","","0.0772","0.0598","","","0.1489","0.1637","","","","","","1.05","","","","has coordinates","182591","2020-10-21","18:00:00",""
"7055538","7.8357","0.0009","9.7387","0.0011","11.0588","0.0012","115.506","0.002","92.671","0.002","96.763","0.002","751.88","0.15","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H11 Au Cl3 N3 -","- C13 H11 Au Cl3 N3 -","- C26 H22 Au2 Cl6 N6 -","2","1","","Nandy, Abhishek; Samanta, Tapastaru; Mallick, Sumana; Mitra, Partha; Seth, Saikat Kumar; Saha, Krishna Das; Al-Deyab, Salem S.; Dinda, Joydev","Synthesis of gold(iii) ←gold(i)‒NHC through disproportionation: the role of gold(i)‒NHC in the induction of apoptosis in HepG2 cells","New J. Chem.","2016","40","7","6289","","10.1039/C5NJ02979A","","","0.71073","MoKα","","0.0345","0.0269","","","0.0487","0.0508","","","","","","1.038","","","","has coordinates","185595","2020-10-21","18:00:00",""
"7055539","7.6118","0.001","19.781","0.003","18.635","0.002","90","","90.601","0.003","90","","2805.7","0.6","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H25 Au F6 N7 P -","- C28 H25 Au F6 N7 P -","- C112 H100 Au4 F24 N28 P4 -","4","1","","Nandy, Abhishek; Samanta, Tapastaru; Mallick, Sumana; Mitra, Partha; Seth, Saikat Kumar; Saha, Krishna Das; Al-Deyab, Salem S.; Dinda, Joydev","Synthesis of gold(iii) ←gold(i)‒NHC through disproportionation: the role of gold(i)‒NHC in the induction of apoptosis in HepG2 cells","New J. Chem.","2016","40","7","6289","","10.1039/C5NJ02979A","","","0.71073","MoKα","","0.0734","0.0394","","","0.0788","0.0899","","","","","","1.057","","","","has coordinates","185595","2020-10-21","18:00:00",""
"7055540","4.3231","0.0016","9.305","0.004","19.116","0.007","87.056","0.01","86.072","0.01","79.91","0.01","754.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 Au Cl3 N3 -","- C13 H12 Au Cl3 N3 -","- C26 H24 Au2 Cl6 N6 -","2","1","","Nandy, Abhishek; Samanta, Tapastaru; Mallick, Sumana; Mitra, Partha; Seth, Saikat Kumar; Saha, Krishna Das; Al-Deyab, Salem S.; Dinda, Joydev","Synthesis of gold(iii) ←gold(i)‒NHC through disproportionation: the role of gold(i)‒NHC in the induction of apoptosis in HepG2 cells","New J. Chem.","2016","40","7","6289","","10.1039/C5NJ02979A","","","0.71073","MoKα","","0.0527","0.028","","","0.0602","0.0679","","","","","","0.997","","","","has coordinates","185595","2020-10-21","18:00:00",""
"7055541","16.837","0.002","19.023","0.0016","19.862","0.003","115.622","0.011","101.572","0.012","90.31","0.009","5588.8","1.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H27 Cl Cu N2 P -","- C34 H27 Cl Cu N2 P -","- C272 H216 Cl8 Cu8 N16 P8 -","8","4","","Safin, Damir A.; Vande Velde, Christophe M. L.; Babashkina, Maria G.; Robeyns, Koen; Filinchuk, Yaroslav","Mononuclear heteroleptic complexes of copper(i) with 5-phenyl-2,2′-bipyridine and triphenylphosphine: crystal structures, Hirshfeld surface analysis and luminescence properties","New J. Chem.","2016","40","7","6156","","10.1039/C6NJ00833J","","","0.71073","MoKα","","0.0746","0.0545","","","0.1353","0.1435","","","","","","1.044","","","","has coordinates","185568","2020-10-21","18:00:00",""
"7055542","9.5272","0.0003","18.5794","0.0006","32.0159","0.0014","90","","90","","90","","5667.1","0.4","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C34 H27 Br Cu N2 P -","- C34 H27 Br Cu N2 P -","- C272 H216 Br8 Cu8 N16 P8 -","8","1","","Safin, Damir A.; Vande Velde, Christophe M. L.; Babashkina, Maria G.; Robeyns, Koen; Filinchuk, Yaroslav","Mononuclear heteroleptic complexes of copper(i) with 5-phenyl-2,2′-bipyridine and triphenylphosphine: crystal structures, Hirshfeld surface analysis and luminescence properties","New J. Chem.","2016","40","7","6156","","10.1039/C6NJ00833J","","","0.71073","MoKα","","0.0604","0.0407","","","0.0763","0.0827","","","","","","1.064","","","","has coordinates","185568","2020-10-21","18:00:00",""
"7055543","11.8421","0.0004","25.8186","0.001","15.2975","0.0006","90","","98.783","0.002","90","","4622.3","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H55 Cl Co2 N4 O11 -","- C49 H55 Cl Co2 N4 O11 -","- C196 H220 Cl4 Co8 N16 O44 -","4","1","","Davila, Ruben; Farias, Nicolas; Carolina Sañudo, E.; Vega, Andrés; Escuer, Albert; Soler, Mónica; Manzur, Jorge","Dinuclear cobalt(iii) and mixed valence trinuclear MnIII‒MnII‒MnIIIcomplexes with a tripodal bridging pyridylaminophenol ligand","New J. Chem.","2016","40","7","6164","","10.1039/C5NJ03670D","","","0.71073","MoKα","","0.0895","0.0534","","","0.1394","0.1754","","","","","","1.102","","","","has coordinates","185581","2020-10-21","18:00:00",""
"7055544","11.829","0.004","12.643","0.004","21.233","0.006","78.054","0.013","89.491","0.013","64.271","0.011","2786.9","1.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C58 H76 Mn3 N4 O12 -","- C50 H56 Mn3 N4 O10 -","- C100 H112 Mn6 N8 O20 -","2","1","","Davila, Ruben; Farias, Nicolas; Carolina Sañudo, E.; Vega, Andrés; Escuer, Albert; Soler, Mónica; Manzur, Jorge","Dinuclear cobalt(iii) and mixed valence trinuclear MnIII‒MnII‒MnIIIcomplexes with a tripodal bridging pyridylaminophenol ligand","New J. Chem.","2016","40","7","6164","","10.1039/C5NJ03670D","","","0.71073","MoKα","","0.1705","0.1307","","","0.3185","0.3482","","","","","","1.06","","","","has coordinates","185581","2020-10-21","18:00:00",""
"7055545","26.143","0.003","25.5375","0.0012","16.485","0.0016","90","","90","","90","","11005.8","1.7","150","2","150","2","","","","","","","synthesis as described","6","P n m a","-P 2ac 2n","62","","","","- C61 H53 F6 O2 P3 Ru -","- C61 H53 F6 O2 P3 Ru -","- C488 H424 F48 O16 P24 Ru8 -","8","1","","Spörler, Susanne; Strinitz, Frank; Rodehutskors, Philipp; Müller, Lisa; Waterloo, Andreas R.; Dürr, Maximilian; Hübner, Eike; Ivanović-Burmazović, Ivana; Tykwinski, Rik R.; Burzlaff, Nicolai","Carbon-rich cyclopentadienyl ruthenium allenylidene complexes","New J. Chem.","2016","40","7","6127","","10.1039/C5NJ03556B","","x-ray","0.71073","MoKα","","0.083","0.0599","","","0.1745","0.1953","","","","","","1.099","","","","has coordinates","185586","2020-10-21","18:00:00",""
"7055546","10.0465","0.0008","15.395","0.0012","20.6856","0.0018","73.3","0.006","84.013","0.006","75.746","0.007","2968.1","0.4","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C72 H63 F6 O3 P3 Ru -","- C72 H63 F6 O3 P3 Ru -","- C144 H126 F12 O6 P6 Ru2 -","2","1","","Spörler, Susanne; Strinitz, Frank; Rodehutskors, Philipp; Müller, Lisa; Waterloo, Andreas R.; Dürr, Maximilian; Hübner, Eike; Ivanović-Burmazović, Ivana; Tykwinski, Rik R.; Burzlaff, Nicolai","Carbon-rich cyclopentadienyl ruthenium allenylidene complexes","New J. Chem.","2016","40","7","6127","","10.1039/C5NJ03556B","","x-ray","0.71073","MoKα","","0.0984","0.0731","","","0.2016","0.241","","","","","","1.044","","","","has coordinates","185586","2020-10-21","18:00:00",""
"7055547","20.6123","0.0006","22.6218","0.0006","25.5409","0.0007","90","","105.389","0.003","90","","11482.4","0.6","100","","100","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C63 H47 Cl2 F6 P3 Ru -","- C63 H47 Cl2 F6 P3 Ru -","- C504 H376 Cl16 F48 P24 Ru8 -","8","1","","Spörler, Susanne; Strinitz, Frank; Rodehutskors, Philipp; Müller, Lisa; Waterloo, Andreas R.; Dürr, Maximilian; Hübner, Eike; Ivanović-Burmazović, Ivana; Tykwinski, Rik R.; Burzlaff, Nicolai","Carbon-rich cyclopentadienyl ruthenium allenylidene complexes","New J. Chem.","2016","40","7","6127","","10.1039/C5NJ03556B","","x-ray","0.71073","MoKα","","0.0513","0.0437","","","0.1249","0.1298","","","","","","1.057","","","","has coordinates","185586","2020-10-21","18:00:00",""
"7055548","15.481","0.0006","16.085","0.0005","16.886","0.0004","84.904","0.002","68.132","0.003","68.142","0.003","3615.6","0.2","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C31.5 H27 Cl F6 N8.5 O0.5 P Ru -","- C31.5 H27 Cl F6 N8.5 O0.5 P Ru -","- C126 H108 Cl4 F24 N34 O2 P4 Ru4 -","4","2","","Hadadzadeh, Hassan; Farrokhpour, Hossein; Simpson, Jim; Shakeri, Jamaladin; Daryanavard, Marzieh; Shokrollahi, Marzieh","Electrocatalytic reduction of CO2to CO by a mononuclear ruthenium(ii) complex","New J. Chem.","2016","40","7","6347","","10.1039/C5NJ03600C","","","1.5418","CuKα","","0.0753","0.0649","","","0.1787","0.1886","","","","","","1.047","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7055549","19.8876","0.0013","9.0457","0.0005","18.9565","0.0011","90","","105.766","0.005","90","","3281.9","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Co Compound","","","- C48 H96.8 Cl2 Co2 N12 O22.4 -","- C48 H93.4 Cl2 Co2 N12 O22.4 -","- C96 H186.8 Cl4 Co4 N24 O44.8 -","2","0.25","","Sing, Nilam; Roy, Sanjay; Guin, Partha Sarathi; Mahali, Kalachand; Majee, Prakash; Mondal, Sudip Kumar; Mahata, Partha; Sengupta, Partha Sarathi; Mondal, Palash","A Co(ii) complex of a vitamer of vitamin B6acts as a sensor for Hg2+and pH in aqueous media","New J. Chem.","2016","40","7","6396","","10.1039/C6NJ00410E","","","0.71073","MoKα","","0.0958","0.0641","","","0.1851","0.2082","","","","","","1.099","","","","has coordinates,has disorder","185574","2020-10-21","18:00:00",""
"7055550","10.669","0.002","11.771","0.002","14.278","0.003","90","","90","","90","","1793.1","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H18 O2 -","- C24 H18 O2 -","- C96 H72 O8 -","4","1","","Zhang, Ruimin; Wang, Mingliang; Sun, Hao; Khan, Arshad; Usman, Rabia; Wang, Shengzhi; Gu, Xiantao; Wang, Jia; Xu, Chunxiang","Effect of configurational isomerism and polymorphism on chalcone fluorescent properties","New J. Chem.","2016","40","7","6441","","10.1039/C6NJ00976J","","","0.71073","MoKα","","0.1189","0.058","","","0.1496","0.1862","","","","","","1.002","","","","has coordinates","185584","2020-10-21","18:00:00",""
"7055551","11.343","0.002","7.989","0.0016","21.559","0.004","90","","104.06","0.03","90","","1895.1","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H18 O2 -","- C26 H18 O2 -","- C104 H72 O8 -","4","1","","Zhang, Ruimin; Wang, Mingliang; Sun, Hao; Khan, Arshad; Usman, Rabia; Wang, Shengzhi; Gu, Xiantao; Wang, Jia; Xu, Chunxiang","Effect of configurational isomerism and polymorphism on chalcone fluorescent properties","New J. Chem.","2016","40","7","6441","","10.1039/C6NJ00976J","","","0.71073","MoKα","","0.1264","0.0578","","","0.1387","0.1686","","","","","","1.002","","","","has coordinates","185584","2020-10-21","18:00:00",""
"7055552","29.981","0.006","5.74","0.0011","21.533","0.004","90","","91.25","0.03","90","","3704.8","1.2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 O2 -","- C26 H18 O2 -","- C208 H144 O16 -","8","1","","Zhang, Ruimin; Wang, Mingliang; Sun, Hao; Khan, Arshad; Usman, Rabia; Wang, Shengzhi; Gu, Xiantao; Wang, Jia; Xu, Chunxiang","Effect of configurational isomerism and polymorphism on chalcone fluorescent properties","New J. Chem.","2016","40","7","6441","","10.1039/C6NJ00976J","","","0.71073","MoKα","","0.1849","0.0871","","","0.1647","0.204","","","","","","1.01","","","","has coordinates","185584","2020-10-21","18:00:00",""
"7055553","16.727","0.003","5.641","0.0011","18.544","0.004","90","","109.35","0.03","90","","1650.9","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H16 O -","- C23 H16 O -","- C92 H64 O4 -","4","1","","Zhang, Ruimin; Wang, Mingliang; Sun, Hao; Khan, Arshad; Usman, Rabia; Wang, Shengzhi; Gu, Xiantao; Wang, Jia; Xu, Chunxiang","Effect of configurational isomerism and polymorphism on chalcone fluorescent properties","New J. Chem.","2016","40","7","6441","","10.1039/C6NJ00976J","","","0.71073","MoKα","","0.1635","0.0675","","","0.1412","0.1823","","","","","","1.002","","","","has coordinates","185584","2020-10-21","18:00:00",""
"7055554","27.135","0.005","5.83","0.0012","20.776","0.004","90","","98.03","0.03","90","","3254.5","1.1","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C23 H16 O -","- C23 H16 O -","- C184 H128 O8 -","8","1","","Zhang, Ruimin; Wang, Mingliang; Sun, Hao; Khan, Arshad; Usman, Rabia; Wang, Shengzhi; Gu, Xiantao; Wang, Jia; Xu, Chunxiang","Effect of configurational isomerism and polymorphism on chalcone fluorescent properties","New J. Chem.","2016","40","7","6441","","10.1039/C6NJ00976J","","","0.71073","MoKα","","0.1709","0.0698","","","0.1151","0.1422","","","","","","1.001","","","","has coordinates","185584","2020-10-21","18:00:00",""
"7055555","12.9207","0.0002","22.2792","0.0007","7.8597","0.0004","90","","102.627","0.003","90","","2207.79","0.14","120","0.1","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dichlorido-4,7-diphenyl-2,9-dimethyl-1,10-phenantrolinecobalt(II)","","- C26 H20 Cl2 Co N2 -","- C26 H20 Cl2 Co N2 -","- C104 H80 Cl8 Co4 N8 -","4","1","","Smolko, Lukáš; Černák, Juraj; Dušek, Michal; Titiš, Ján; Boča, Roman","Tetracoordinate Co(ii) complexes containing bathocuproine and single molecule magnetism","New J. Chem.","2016","40","8","6593","","10.1039/C6NJ00372A","","x-ray","1.54184","CuKα","","0.0385","0.0341","","","0.0882","0.092","","","","1.42","1.42","1.4","","","","has coordinates","185608","2020-10-21","18:00:00",""
"7055556","12.9571","0.0004","22.7711","0.0011","7.8738","0.0007","90","","103.018","0.004","90","","2263.4","0.2","119.95","0.14","119.95","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","dibromido-4,7-diphenyl-2,9-dimethyl-1,10-phenantrolinecobalt(II)","","- C26 H20 Br2 Co N2 -","- C26 H20 Br2 Co N2 -","- C104 H80 Br8 Co4 N8 -","4","1","","Smolko, Lukáš; Černák, Juraj; Dušek, Michal; Titiš, Ján; Boča, Roman","Tetracoordinate Co(ii) complexes containing bathocuproine and single molecule magnetism","New J. Chem.","2016","40","8","6593","","10.1039/C6NJ00372A","","x-ray","1.54184","CuKα","","0.0707","0.0588","","","0.1401","0.1478","","","","1.83","1.83","1.73","","","","has coordinates","185608","2020-10-21","18:00:00",""
"7055557","12.7126","0.0003","23.7131","0.0007","8.0118","0.0004","90","","98.626","0.003","90","","2387.88","0.15","120","0.1","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 Co I2 N2 -","- C26 H20 Co I2 N2 -","- C104 H80 Co4 I8 N8 -","4","1","","Smolko, Lukáš; Černák, Juraj; Dušek, Michal; Titiš, Ján; Boča, Roman","Tetracoordinate Co(ii) complexes containing bathocuproine and single molecule magnetism","New J. Chem.","2016","40","8","6593","","10.1039/C6NJ00372A","","x-ray","1.54184","CuKα","","0.0408","0.0301","","","0.0779","0.0866","","","","1.18","1.18","1.17","","","","has coordinates","185608","2020-10-21","18:00:00",""
"7055558","11.3302","0.0008","10.5415","0.0007","16.9754","0.0012","90","","95.253","0.001","90","","2019","0.2","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C27 H23 N O -","- C27 H23 N O -","- C108 H92 N4 O4 -","4","1","","Gupta, Kankatala S. V.; Ramana, Daggupati V.; Vinayak, Botla; Sridhar, Balasubramanian; Chandrasekharam, Malapaka","Copper-catalyzed regio and diastereoselective three component C‒N, C‒C and C‒O bond forming reaction: oxidative sp3C‒H functionalization","New J. Chem.","2016","40","7","6389","","10.1039/C5NJ03707G","","","0.71073","MoKα","","0.0651","0.0509","","","0.1306","0.1405","","","","","","1.024","","","","has coordinates","185576","2020-10-21","18:00:00",""
"7055559","16.33","0.0018","5.5498","0.0005","21.308","0.003","90","","110.785","0.006","90","","1805.4","0.4","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H38 N4 Ni2 O6 -","- C44 H38 N4 Ni2 O6 -","- C88 H76 N8 Ni4 O12 -","2","0.5","","Novoa, Néstor; Roisnel, Thierry; Dorcet, Vincent; Cador, Olivier; Manzur, Carolina; Carrillo, David; Hamon, Jean-René","Efficient preparation of multimetallic ONO-based Schiff base complexes of nickel(ii) and copper(ii)","New J. Chem.","2016","40","7","5920","","10.1039/C6NJ00932H","","x-ray","0.71073","MoKα","","0.1231","0.0596","","","0.1123","0.1355","","","","","","1.016","","","","has coordinates","185566","2020-10-21","18:00:00",""
"7055560","7.1379","0.0003","26.0949","0.0011","21.8414","0.0007","90","","95.142","0.001","90","","4051.9","0.3","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H42 Fe2 N4 Ni2 O4 -","- C50 H42 Fe2 N4 Ni2 O4 -","- C200 H168 Fe8 N16 Ni8 O16 -","4","1","","Novoa, Néstor; Roisnel, Thierry; Dorcet, Vincent; Cador, Olivier; Manzur, Carolina; Carrillo, David; Hamon, Jean-René","Efficient preparation of multimetallic ONO-based Schiff base complexes of nickel(ii) and copper(ii)","New J. Chem.","2016","40","7","5920","","10.1039/C6NJ00932H","","x-ray","0.71073","MoKα","","0.1026","0.0489","","","0.0915","0.1097","","","","","","0.999","","","","has coordinates","185566","2020-10-21","18:00:00",""
"7055561","8.678","0.0015","19.302","0.004","11.5537","0.0016","90","","108.72","0.008","90","","1832.9","0.6","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 Cu N2 O3 -","- C22 H19 Cu N2 O3 -","- C88 H76 Cu4 N8 O12 -","4","1","","Novoa, Néstor; Roisnel, Thierry; Dorcet, Vincent; Cador, Olivier; Manzur, Carolina; Carrillo, David; Hamon, Jean-René","Efficient preparation of multimetallic ONO-based Schiff base complexes of nickel(ii) and copper(ii)","New J. Chem.","2016","40","7","5920","","10.1039/C6NJ00932H","","x-ray","0.71073","MoKα","","0.2134","0.0818","","","0.1397","0.1858","","","","","","0.935","","","","has coordinates","185566","2020-10-21","18:00:00",""
"7055562","9.4089","0.001","12.3402","0.0012","15.4689","0.0016","73.418","0.004","75.461","0.005","78.263","0.005","1649.3","0.3","150","2","150","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C40 H34 Cu2 Fe2 N2 O4 -","- C40 H34 Cu2 Fe2 N2 O4 -","- C80 H68 Cu4 Fe4 N4 O8 -","2","1","","Novoa, Néstor; Roisnel, Thierry; Dorcet, Vincent; Cador, Olivier; Manzur, Carolina; Carrillo, David; Hamon, Jean-René","Efficient preparation of multimetallic ONO-based Schiff base complexes of nickel(ii) and copper(ii)","New J. Chem.","2016","40","7","5920","","10.1039/C6NJ00932H","","x-ray","0.71073","MoKα","","0.0403","0.0331","","","0.0812","0.0852","","","","","","1.045","","","","has coordinates","185566","2020-10-21","18:00:00",""
"7055563","14.3337","0.0013","8.0972","0.0007","21.2171","0.0019","90","","91.838","0.003","90","","2461.2","0.4","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C28 H28 O4 P2 -","- C28 H28 O4 P2 -","- C112 H112 O16 P8 -","4","0.5","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.0545","0.0431","","","0.1095","0.1157","","","","","","1.035","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055564","7.5386","0.0003","16.2636","0.0007","18.9268","0.0008","90","","100.154","0.001","90","","2284.17","0.17","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 P2 -","- C28 H28 P2 -","- C112 H112 P8 -","4","1","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.0429","0.0326","","","0.0768","0.0816","","","","","","1.017","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055565","11.5426","0.0008","16.0408","0.0011","14.5815","0.0011","90","","90","","90","","2699.8","0.3","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C28 H28 Au2 Cl2 P2 -","- C28 H28 Au2 Cl2 P2 -","- C112 H112 Au8 Cl8 P8 -","4","1","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.032","0.0232","","","0.0451","0.0482","","","","","","1.061","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055566","15.401","0.002","12.9857","0.0019","14.468","0.003","90","","100.885","0.006","90","","2841.4","0.8","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H28 Au2 Cl2 O4 P2 -","- C28 H28 Au2 Cl2 O4 P2 -","- C112 H112 Au8 Cl8 O16 P8 -","4","0.5","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.0284","0.0209","","","0.0386","0.0412","","","","","","1.03","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055567","10.3579","0.0007","10.4563","0.0007","11.1637","0.0007","62.997","0.002","68.316","0.002","78.142","0.002","1000","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H44 Au2 Cl6 N4 P2 -","- C34 H44 Au2 Cl6 N4 P2 -","- C34 H44 Au2 Cl6 N4 P2 -","1","0.5","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.035","0.0272","","","0.0516","0.0546","","","","","","1.03","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055568","10.9838","0.0005","12.5329","0.0006","13.3045","0.0006","77.741","0.002","80.078","0.002","75.775","0.002","1720.84","0.14","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H36 Au2 Cl2 O5 P2 -","- C32 H36 Au2 Cl2 O5 P2 -","- C64 H72 Au4 Cl4 O10 P4 -","2","1","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.0536","0.0364","","","0.0832","0.0909","","","","","","1.025","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055569","11.4972","0.0005","15.3421","0.0007","21.1914","0.001","94.108","0.002","90.027","0.002","92.97","0.002","3723.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H40 Au2 Cl2 N4 P2 -","- C32 H40 Au2 Cl2 N4 P2 -","- C128 H160 Au8 Cl8 N16 P8 -","4","2","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.0918","0.0488","","","0.079","0.0911","","","","","","1.055","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055570","7.3242","0.0005","11.2949","0.0008","13.0454","0.0009","110.027","0.002","105.628","0.002","93.035","0.002","963.8","0.12","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H28 Au2 F10 O4 P2 -","- C40 H28 Au2 F10 O4 P2 -","- C40 H28 Au2 F10 O4 P2 -","1","0.5","","Molitor, Sebastian; Mahler, Christoph; Gessner, Viktoria H.","Synthesis and Solid-State Structures of Gold(I) Complexes of Diphosphines","New J. Chem.","2016","","","","","10.1039/C6NJ00786D","","","0.71073","MoKα","","0.0247","0.0226","","","0.0522","0.0531","","","","","","1.088","","","","has coordinates","182985","2020-10-21","18:00:00",""
"7055571","9.0642","0.0011","11.8519","0.0014","18.732","0.002","86.072","0.002","83.458","0.002","81.905","0.002","1976.5","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H42 N6 O4 S -","- C46 H42 N6 O4 S -","- C92 H84 N12 O8 S2 -","2","1","","Das, Sangita; Aich, Krishnendu; Goswami, Shyamaprosad; Quah, Ching Kheng; Fun, Hoong-Kun","FRET-based fluorescence ratiometric and colorimetric sensor to discriminate Fe3+from Fe2+","New J. Chem.","2016","40","7","6414","","10.1039/C5NJ03598H","","","0.71073","MoKα","","0.0791","0.0481","","","0.1027","0.119","","","","","","1.023","","","","has coordinates","185587","2020-10-21","18:00:00",""
"7055572","10.0882","0.0008","12.863","0.001","11.871","0.001","90","","102.335","0.006","90","","1504.9","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C32 H42 O2 Se2 -","- C32 H42 O2 Se2 -","- C64 H84 O4 Se4 -","2","1","","Ścianowski, Jacek; Pacuła, Agata J.; Zielińska-Błajet, Mariola; Wojtczak, Andrzej","New diphenyl diselenides o-substituted by an O(S,Se)-caranyl skeleton ‒ synthesis and application in asymmetric reactions","New J. Chem.","2016","40","8","6697","","10.1039/C6NJ00487C","","","0.71073","MoKα","","0.095","0.0587","","","0.1367","0.1535","","","","","","0.879","","","","has coordinates","185603","2020-10-21","18:00:00",""
"7055573","11.55","0.0008","29.977","0.002","9.144","0.001","90","","90","","90","","3166","0.5","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C21 H39 Cl3 Cu2 N2 O15 -","- C21 H35 Cl3 Cu2 N2 O15 -","- C84 H140 Cl12 Cu8 N8 O60 -","4","0.5","","Sanyal, Ria; Kundu, Priyanka; Rychagova, Elena; Zhigulin, Grigory; Ketkov, Sergey; Ghosh, Bipinbihari; Chattopadhyay, Shyamal Kumar; Zangrando, Ennio; Das, Debasis","Catecholase activity of Mannich-based dinuclear CuIIcomplexes with theoretical modeling: new insight into the solvent role in the catalytic cycle","New J. Chem.","2016","40","8","6623","","10.1039/C6NJ00105J","","","0.71073","MoKα","","0.1017","0.077","","","0.2234","0.2468","","","","","","1.056","","","","has coordinates","185621","2020-10-21","18:00:00",""
"7055574","9.7971","0.0004","11.2747","0.0004","18.5531","0.0009","97.974","0.002","92.99","0.002","114.816","0.001","1828.2","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H40 Cl4 Cu2 N2 O15 -","- C26 H38 Cl4 Cu2 N2 O15 -","- C52 H76 Cl8 Cu4 N4 O30 -","2","1","","Sanyal, Ria; Kundu, Priyanka; Rychagova, Elena; Zhigulin, Grigory; Ketkov, Sergey; Ghosh, Bipinbihari; Chattopadhyay, Shyamal Kumar; Zangrando, Ennio; Das, Debasis","Catecholase activity of Mannich-based dinuclear CuIIcomplexes with theoretical modeling: new insight into the solvent role in the catalytic cycle","New J. Chem.","2016","40","8","6623","","10.1039/C6NJ00105J","","","0.71073","MoKα","","0.0804","0.0583","","","0.1771","0.1934","","","","","","1.04","","","","has coordinates","185621","2020-10-21","18:00:00",""
"7055575","14.1999","0.0004","13.2826","0.0004","17.8412","0.0005","90","","90","","90","","3365.06","0.17","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H38 Cl2 Cu2 N4 O12 -","- C26 H38 Cl2 Cu2 N4 O12 -","- C104 H152 Cl8 Cu8 N16 O48 -","4","0.5","","Sanyal, Ria; Kundu, Priyanka; Rychagova, Elena; Zhigulin, Grigory; Ketkov, Sergey; Ghosh, Bipinbihari; Chattopadhyay, Shyamal Kumar; Zangrando, Ennio; Das, Debasis","Catecholase activity of Mannich-based dinuclear CuIIcomplexes with theoretical modeling: new insight into the solvent role in the catalytic cycle","New J. Chem.","2016","40","8","6623","","10.1039/C6NJ00105J","","","0.71073","MoKα","","0.0377","0.0279","","","0.0764","0.0823","","","","","","1.03","","","","has coordinates","185621","2020-10-21","18:00:00",""
"7055576","8.9325","0.0019","9.701","0.002","11.314","0.002","79.587","0.006","71.215","0.006","80.545","0.006","907","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H46 Cl2 Cu2 N2 O11 -","- C30 H44 Cl2 Cu2 N2 O11 -","- C30 H44 Cl2 Cu2 N2 O11 -","1","0.5","","Sanyal, Ria; Kundu, Priyanka; Rychagova, Elena; Zhigulin, Grigory; Ketkov, Sergey; Ghosh, Bipinbihari; Chattopadhyay, Shyamal Kumar; Zangrando, Ennio; Das, Debasis","Catecholase activity of Mannich-based dinuclear CuIIcomplexes with theoretical modeling: new insight into the solvent role in the catalytic cycle","New J. Chem.","2016","40","8","6623","","10.1039/C6NJ00105J","","","0.71073","MoKα","","0.0859","0.0724","","","0.2003","0.2221","","","","","","1.096","","","","has coordinates","185621","2020-10-21","18:00:00",""
"7055577","10.8439","0.0011","10.9199","0.0011","12.5692","0.0012","79.521","0.006","65.587","0.006","62.424","0.006","1201.2","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H28 F6 N4 O15 Re2 S2 -","- C36 H28 F6 N4 O15 Re2 S2 -","- C36 H28 F6 N4 O15 Re2 S2 -","1","0.5","","Mella, Pablo; Cabezas, Karina; Cerda, Carla; Cepeda, Marjorie; Günther, German; Pizarro, Nancy Alejandra; Vega, Andres","Solvent, Coordinating and Hydrogen-Bond Effects on the Chromic Luminescence of the Cationic Complex [(phen)(H2O)Re(CO)3]+","New J. Chem.","2016","","","","","10.1039/C6NJ00885B","","","0.71073","MoKα","","0.0593","0.0513","","","0.1388","0.1448","","","","","","1.04","","","","has coordinates","183040","2020-10-21","18:00:00",""
"7055578","8.9613","0.0015","10.9689","0.0019","11.7044","0.0019","94.367","0.004","97.337","0.004","94.165","0.004","1133.8","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","'triluoromethenesulfonate of aquobromotricarbonylrhenium(I)'","","- C17 H12 Cl2 F3 N2 O7 Re S -","- C17 H12 Cl2 F3 N2 O7 Re S -","- C34 H24 Cl4 F6 N4 O14 Re2 S2 -","2","1","","Mella, Pablo; Cabezas, Karina; Cerda, Carla; Cepeda, Marjorie; Günther, German; Pizarro, Nancy Alejandra; Vega, Andres","Solvent, Coordinating and Hydrogen-Bond Effects on the Chromic Luminescence of the Cationic Complex [(phen)(H2O)Re(CO)3]+","New J. Chem.","2016","","","","","10.1039/C6NJ00885B","","","0.71073","MoKα","","0.0487","0.039","","","0.0875","0.0931","","","","","","1.016","","","","has coordinates","183040","2020-10-21","18:00:00",""
"7055579","10.9653","0.0008","24.1931","0.0017","10.7357","0.0007","90","","93.07","0.002","90","","2843.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 Hg1.5 N O3 S -","- C28 H34 Hg1.5 N O3 S -","- C112 H136 Hg6 N4 O12 S4 -","4","1","","Casas, José S.; Couce, María D.; García-Vega, Manuel; Sánchez, Agustín; Sordo, José; Vázquez López, Ezequiel M.","Phenylmercury(ii) sulfanylpropenoates: an example of symmetrization with the 3-(2-methoxyphenyl)-2-sulfanylpropenoato ligand","New J. Chem.","2016","40","8","6735","","10.1039/C6NJ00624H","","","0.71073","MoKα","","0.1357","0.0381","","","0.0455","0.0568","","","","","","0.701","","","","has coordinates","185602","2020-10-21","18:00:00",""
"7055580","9.977","0.003","10.614","0.003","12.809","0.003","111.613","0.004","95.651","0.004","109.288","0.004","1152.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H29 Hg N O3 S -","- C22 H29 Hg N O3 S -","- C44 H58 Hg2 N2 O6 S2 -","2","1","","Casas, José S.; Couce, María D.; García-Vega, Manuel; Sánchez, Agustín; Sordo, José; Vázquez López, Ezequiel M.","Phenylmercury(ii) sulfanylpropenoates: an example of symmetrization with the 3-(2-methoxyphenyl)-2-sulfanylpropenoato ligand","New J. Chem.","2016","40","8","6735","","10.1039/C6NJ00624H","","","0.71073","MoKα","","0.0384","0.0279","","","0.0621","0.0676","","","","","","1.033","","","","has coordinates","185602","2020-10-21","18:00:00",""
"7055581","10.1999","0.0008","11.0816","0.0008","12.1792","0.001","101.713","0.001","103.418","0.002","113.876","0.001","1154.21","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H29 Hg N O3 S -","- C22 H29 Hg N O3 S -","- C44 H58 Hg2 N2 O6 S2 -","2","1","","Casas, José S.; Couce, María D.; García-Vega, Manuel; Sánchez, Agustín; Sordo, José; Vázquez López, Ezequiel M.","Phenylmercury(ii) sulfanylpropenoates: an example of symmetrization with the 3-(2-methoxyphenyl)-2-sulfanylpropenoato ligand","New J. Chem.","2016","40","8","6735","","10.1039/C6NJ00624H","","","0.71073","MoKα","","0.0582","0.0418","","","0.0841","0.088","","","","","","0.891","","","","has coordinates","185602","2020-10-21","18:00:00",""
"7055582","10.9515","0.0009","15.1588","0.0012","16.0378","0.0013","91.515","0.002","109.962","0.002","92.162","0.002","2498.5","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H52 F6 Hg2 N2 O6 S2 -","- C44 H52 F6 Hg2 N2 O6 S2 -","- C88 H104 F12 Hg4 N4 O12 S4 -","2","1","","Casas, José S.; Couce, María D.; García-Vega, Manuel; Sánchez, Agustín; Sordo, José; Vázquez López, Ezequiel M.","Phenylmercury(ii) sulfanylpropenoates: an example of symmetrization with the 3-(2-methoxyphenyl)-2-sulfanylpropenoato ligand","New J. Chem.","2016","40","8","6735","","10.1039/C6NJ00624H","","","0.71073","MoKα","","0.1022","0.0443","","","0.1018","0.134","","","","","","0.895","","","","has coordinates","185602","2020-10-21","18:00:00",""
"7055583","21.201","0.007","10.863","0.002","32.16","0.006","90","","98.94","0.04","90","","7317","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","5-(4-tert-butylphenyl)-15-bipyridine-porphyrin zinc","zinc{5-(4-tert-butylphenyl)-15-[4-(2,2'-bipyridine)]-porphyrinato}","","- C44 H38 N6 O Zn -","- C44 H38 N6 O Zn -","- C352 H304 N48 O8 Zn8 -","8","1","","Charisiadis, Asterios; Nikolaou, Vasilis; Karikis, Kostas; Giatagana, Chrysa; Chalepli, Konstantina; Ladomenou, Kalliopi; Biswas, Suhayan; Sharma, Ganesh D.; Coutsolelos, Athanassios G.","Two new bulky substituted Zn porphyrins bearing carboxylate anchoring groups as promising dyes for DSSCs","New J. Chem.","2016","40","7","5930","","10.1039/C6NJ00634E","","","0.71073","MoKα","","0.1568","0.068","","","0.0981","0.1178","","","","","","1.035","","","","has coordinates,has disorder","185569","2020-10-21","18:00:00",""
"7055584","8.9739","0.0006","8.5841","0.0006","30.686","0.003","90","","90","","90","","2363.8","0.3","293","2","293","2","","","","","","","","5","P n a m","-P 2c 2n","62","","","","- C26 H20 N O5 Pb -","- C26 H26 N O5 Pb -","- C104 H104 N4 O20 Pb4 -","4","0.5","","Dai, Fangna; Fan, Weidong; Bi, Jiahui; Zhang, Qian; Zhang, XiRui; Liang, Tuo; Wang, Xingyi; Dong, Bin; Gao, Jing","Four Pb(ii) metal‒organic frameworks with increasing dimensions: structural diversities by varying the ligands","New J. Chem.","2016","40","8","6867","","10.1039/C5NJ03632A","","","0.71073","MoKα","","0.0644","0.0446","","","0.0666","0.074","","","","","","1.004","","","","has coordinates,has disorder","185606","2020-10-21","18:00:00",""
"7055585","7.7028","0.0003","5.3856","0.0002","35.9661","0.0015","90","","95.458","0.004","90","","1485.26","0.1","200","0.1","200","0.1","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","","- C20 H12 O4 Pb -","- C20 H12 O4 Pb -","- C80 H48 O16 Pb4 -","4","0.5","","Dai, Fangna; Fan, Weidong; Bi, Jiahui; Zhang, Qian; Zhang, XiRui; Liang, Tuo; Wang, Xingyi; Dong, Bin; Gao, Jing","Four Pb(ii) metal‒organic frameworks with increasing dimensions: structural diversities by varying the ligands","New J. Chem.","2016","40","8","6867","","10.1039/C5NJ03632A","","","0.71073","MoKα","","0.0287","0.0268","","","0.0539","0.0555","","","","","","1.078","","","","has coordinates","185606","2020-10-21","18:00:00",""
"7055586","16.734","0.0006","8.002","0.0002","34.8764","0.0009","90","","101.383","0.003","90","","4578.3","0.2","293","2","293","2","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","","","- C25 H23 N O5 Pb -","- C25 H23 N O5 Pb -","- C200 H184 N8 O40 Pb8 -","8","1","","Dai, Fangna; Fan, Weidong; Bi, Jiahui; Zhang, Qian; Zhang, XiRui; Liang, Tuo; Wang, Xingyi; Dong, Bin; Gao, Jing","Four Pb(ii) metal‒organic frameworks with increasing dimensions: structural diversities by varying the ligands","New J. Chem.","2016","40","8","6867","","10.1039/C5NJ03632A","","","0.71","MoKα","","0.0451","0.0315","","","0.0568","0.0622","","","","","","1.048","","","","has coordinates,has disorder","185606","2020-10-21","18:00:00",""
"7055587","19.6153","0.0005","7.10613","0.00016","18.5113","0.0004","90","","94.072","0.002","90","","2573.76","0.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H12 Cl2 N4 O8 Pb3 -","- C24 H12 Cl2 N4 O8 Pb3 -","- C96 H48 Cl8 N16 O32 Pb12 -","4","0.5","","Dai, Fangna; Fan, Weidong; Bi, Jiahui; Zhang, Qian; Zhang, XiRui; Liang, Tuo; Wang, Xingyi; Dong, Bin; Gao, Jing","Four Pb(ii) metal‒organic frameworks with increasing dimensions: structural diversities by varying the ligands","New J. Chem.","2016","40","8","6867","","10.1039/C5NJ03632A","","","0.71","MoKα","","0.0432","0.0332","","","0.065","0.0719","","","","","","1.063","","","","has coordinates","185606","2020-10-21","18:00:00",""
"7055588","11.9003","0.0004","14.8271","0.0005","16.7978","0.0006","78.317","0.003","79.682","0.003","79.942","0.003","2825.97","0.17","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H60 N4 Ni4 O12 -","- C60 H60 N4 Ni4 O12 -","- C120 H120 N8 Ni8 O24 -","2","1","","Cindrić, Marina; Pavlović, Gordana; Pajić, Damir; Zadro, Krešo; Cinčić, Dominik; Hrenar, Tomica; Lekšić, Edislav; Belen Pinar Prieto, Ana; Lazić, Predrag; Šišak Jung, Dubravka","Correlation between structural, physical and chemical properties of three new tetranuclear NiIIclusters","New J. Chem.","2016","40","8","6604","","10.1039/C6NJ00287K","","","0.71073","MoKα","","0.1251","0.0613","","","0.0987","0.1163","","","","","","0.974","","","","has coordinates","185610","2020-10-21","18:00:00",""
"7055589","11.7984","0.0003","14.6129","0.0004","16.862","0.0005","77.752","0.002","79.495","0.002","79.732","0.002","2763.74","0.13","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C60.32 H60 N4 Ni4 O12.64 -","- C60.32 H60 N4 Ni4 O12.64 -","- C120.64 H120 N8 Ni8 O25.28 -","2","1","","Cindrić, Marina; Pavlović, Gordana; Pajić, Damir; Zadro, Krešo; Cinčić, Dominik; Hrenar, Tomica; Lekšić, Edislav; Belen Pinar Prieto, Ana; Lazić, Predrag; Šišak Jung, Dubravka","Correlation between structural, physical and chemical properties of three new tetranuclear NiIIclusters","New J. Chem.","2016","40","8","6604","","10.1039/C6NJ00287K","","","0.71073","MoKα","","0.0586","0.0387","","","0.0774","0.0839","","","","","","1.009","","","","has coordinates,has disorder","185610","2020-10-21","18:00:00",""
"7055590","11.9649","0.0004","14.7344","0.0005","16.9441","0.0006","78.05","0.003","80.183","0.003","79.885","0.003","2848.97","0.17","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H60 N4 Ni4 O12 -","- C60 H60 N4 Ni4 O12 -","- C120 H120 N8 Ni8 O24 -","2","1","","Cindrić, Marina; Pavlović, Gordana; Pajić, Damir; Zadro, Krešo; Cinčić, Dominik; Hrenar, Tomica; Lekšić, Edislav; Belen Pinar Prieto, Ana; Lazić, Predrag; Šišak Jung, Dubravka","Correlation between structural, physical and chemical properties of three new tetranuclear NiIIclusters","New J. Chem.","2016","40","8","6604","","10.1039/C6NJ00287K","","","0.71073","MoKα","","0.1137","0.0629","","","0.1357","0.1568","","","","","","1.004","","","","has coordinates","185610","2020-10-21","18:00:00",""
"7055591","11.8638","0.0005","14.6263","0.0006","16.9277","0.0007","77.775","0.004","79.854","0.003","79.725","0.004","2795.3","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C60.63 H60 N4 Ni4 O12.63 -","- C60.63 H60 N4 Ni4 O12.63 -","- C121.26 H120 N8 Ni8 O25.26 -","2","1","","Cindrić, Marina; Pavlović, Gordana; Pajić, Damir; Zadro, Krešo; Cinčić, Dominik; Hrenar, Tomica; Lekšić, Edislav; Belen Pinar Prieto, Ana; Lazić, Predrag; Šišak Jung, Dubravka","Correlation between structural, physical and chemical properties of three new tetranuclear NiIIclusters","New J. Chem.","2016","40","8","6604","","10.1039/C6NJ00287K","","","0.71073","MoKα","","0.0706","0.0348","","","0.0528","0.0563","","","","","","0.793","","","","has coordinates,has disorder","185610","2020-10-21","18:00:00",""
"7055592","18.898","0.0004","16.7388","0.0004","17.3542","0.0004","90","","90","","90","","5489.7","0.2","296","","296","","","","","","","","","3","C m c 21","C 2c -2","36","","","","- F70 Ti10 Xe5 -","- F69.994 Ti10 Xe5 -","- F279.976 Ti40 Xe20 -","4","0.5","","Mazej, Zoran; Goreshnik, Evgeny A.","Largest perfluorometallate [Ti10F45]5−oligomer and polymeric ([Ti3F13]−)∞and ([TiF5]−)∞anions prepared as [XeF5]+salts","New J. Chem.","2016","40","9","7320","","10.1039/C6NJ00955G","","x-ray","0.71073","MoKα","","0.038","0.035","","","0.0833","0.0857","","","","","","1.027","","","","has coordinates","186452","2020-10-21","18:00:00",""
"7055593","18.139","0.002","8.5173","0.0009","18.1876","0.0016","90","","90","","90","","2809.9","0.5","149.97","0.15","149.97","0.15","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- F10 Ti Xe -","- F10 Ti Xe -","- F160 Ti16 Xe16 -","16","2","","Mazej, Zoran; Goreshnik, Evgeny A.","Largest perfluorometallate [Ti10F45]5−oligomer and polymeric ([Ti3F13]−)∞and ([TiF5]−)∞anions prepared as [XeF5]+salts","New J. Chem.","2016","40","9","7320","","10.1039/C6NJ00955G","","x-ray","0.71073","MoKα","","0.1246","0.0867","","","0.2042","0.2289","","","","","","1.054","","","","has coordinates","186452","2020-10-21","18:00:00",""
"7055594","9.7699","0.0006","11.0276","0.0006","13.4581","0.0007","89.601","0.005","69.992","0.005","77.717","0.005","1327.83","0.14","150","0.1","150","0.1","","","","","","","","3","P -1","-P 1","2","","","","- F36 Ti6 Xe2 -","- F36 Ti6 Xe2 -","- F72 Ti12 Xe4 -","2","1","","Mazej, Zoran; Goreshnik, Evgeny A.","Largest perfluorometallate [Ti10F45]5−oligomer and polymeric ([Ti3F13]−)∞and ([TiF5]−)∞anions prepared as [XeF5]+salts","New J. Chem.","2016","40","9","7320","","10.1039/C6NJ00955G","","x-ray","0.71073","MoKα","","0.0826","0.0579","","","0.1438","0.154","","","","","","1.001","","","","has coordinates","186452","2020-10-21","18:00:00",""
"7055595","11.412","0.004","15.341","0.006","24.64","0.009","90","","102.498","0.006","90","","4212","3","296","2","296.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H37 N5 O2 Zn -","- C48 H37 N5 O2 Zn -","- C192 H148 N20 O8 Zn4 -","4","1","","Liu, Hui; Tu, Ji-Qiang; Zhang, Cheng-Hua; Xiao, Qiao-Ting; Wang, Tian-Hua; Ju, Xiu-Lian","Selective complexation of di-n-hexylammonium salts by tailed porphyrin host","New J. Chem.","2016","40","7","5679","","10.1039/C6NJ00045B","","","0.71073","MoKα","","0.095","0.0648","","","0.1752","0.1915","","","","","","1.037","","","","has coordinates,has disorder","185577","2020-10-21","18:00:00",""
"7055596","9.3672","0.0008","20.6388","0.0018","29.622","0.003","90","","94.688","0.001","90","","5707.6","0.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C66 H66 B F2 N3 O2 S2 -","- C66 H66 B F2 N3 O2 S2 -","- C264 H264 B4 F8 N12 O8 S8 -","4","1","","Wang, Jun; Li, Jin; Chen, Na; Wu, Yayang; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan","Synthesis, structure and properties of thiophene-fused BODIPYs and azaBODIPYs as near-infrared agents","New J. Chem.","2016","40","7","5966","","10.1039/C6NJ01011C","","","0.71073","MoKα","","0.1818","0.092","","","0.2565","0.3253","","","","","","1.038","","","","has coordinates","185580","2020-10-21","18:00:00",""
"7055597","12.5342","0.0013","36.614","0.004","11.8932","0.0013","90","","114.485","0.001","90","","4967.3","0.9","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C55 H43 B F2 N2 O6 S2 -","- C55 H43 B F2 N2 O6 S2 -","- C220 H172 B4 F8 N8 O24 S8 -","4","1","","Wang, Jun; Li, Jin; Chen, Na; Wu, Yayang; Hao, Erhong; Wei, Yun; Mu, Xiaolong; Jiao, Lijuan","Synthesis, structure and properties of thiophene-fused BODIPYs and azaBODIPYs as near-infrared agents","New J. Chem.","2016","40","7","5966","","10.1039/C6NJ01011C","","","0.71073","MoKα","","0.1111","0.0664","","","0.1978","0.2195","","","","","","1.092","","","","has coordinates","185580","2020-10-21","18:00:00",""
"7055598","7.495","0.001","8.509","0.001","16.398","0.003","91.72","0.02","101.45","0.01","116.12","0.01","912.1","0.3","250","2","250","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H5 F10 N O -","- C21 H5 F10 N O -","- C42 H10 F20 N2 O2 -","2","1","","Faurie, Alexandre; Mallet, Charlotte; Allain, Magali; Skene, W. G.; Frère, Pierre","Topological and packing mode modification for solid-state emission enhancement of bis(perfluorostyryl)furan derivatives","New J. Chem.","2016","40","8","6728","","10.1039/C5NJ03561A","","x-ray","0.71073","MoKα","","0.1915","0.0735","","","0.097","0.128","","","","","","1.04","","","","has coordinates","185607","2020-10-21","18:00:00",""
"7055599","7.414","0.002","12.582","0.001","13.338","0.002","90","","91","0.02","90","","1244","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H4 F5 N O2 -","- C14 H4 F5 N O2 -","- C56 H16 F20 N4 O8 -","4","2","","Faurie, Alexandre; Mallet, Charlotte; Allain, Magali; Skene, W. G.; Frère, Pierre","Topological and packing mode modification for solid-state emission enhancement of bis(perfluorostyryl)furan derivatives","New J. Chem.","2016","40","8","6728","","10.1039/C5NJ03561A","","x-ray","0.71073","MoKα","","0.1418","0.0734","","","0.1706","0.2047","","","","","","1.033","","","","has coordinates","185607","2020-10-21","18:00:00",""
"7055600","6.634","0.002","4.733","0.002","18.468","0.006","90","","92.01","0.03","90","","579.5","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H5 F5 O2 -","- C13 H5 F5 O2 -","- C26 H10 F10 O4 -","2","1","","Faurie, Alexandre; Mallet, Charlotte; Allain, Magali; Skene, W. G.; Frère, Pierre","Topological and packing mode modification for solid-state emission enhancement of bis(perfluorostyryl)furan derivatives","New J. Chem.","2016","40","8","6728","","10.1039/C5NJ03561A","","x-ray","0.71073","MoKα","","0.1208","0.0591","","","0.1111","0.1239","","","","","","1.084","","","","has coordinates","185607","2020-10-21","18:00:00",""
"7055601","19.404","0.005","9.092","0.002","12.045","0.006","90","","90","","90","","2125","1.3","173","2","173","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","3-(4-(Dimethylamino)phenyl)spiro[fluorene-4,2?-[2H]indene]-1?,3?,9(3H)- trione","","- C29 H21 N O3 -","- C29 H21 N O3 -","- C116 H84 N4 O12 -","4","1","","Bekere, Laura; Larina, Nina; Lokshin, Vladimir; Ellern, Arkady; Sigalov, Mark; Khodorkovsky, Vladimir","A new class of spirocyclic photochromes reacting with light of both UV and visible ranges","New J. Chem.","2016","40","8","6554","","10.1039/C6NJ00666C","","","0.71073","MoKα","","0.0838","0.0544","","","0.1109","0.1273","","","","","","1.323","","","","has coordinates","185616","2020-10-21","18:00:00",""
"7055602","11.6979","0.0004","12.3967","0.0004","16.6477","0.0006","90","","96.137","0.003","90","","2400.34","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-(4-(Diethylamino)phenyl)spiro[fluorene-4,2?-[2H]indene]-1?,3?,9(3H)- trione","","- C31 H25 N O3 -","- C31 H25 N O3 -","- C124 H100 N4 O12 -","4","1","","Bekere, Laura; Larina, Nina; Lokshin, Vladimir; Ellern, Arkady; Sigalov, Mark; Khodorkovsky, Vladimir","A new class of spirocyclic photochromes reacting with light of both UV and visible ranges","New J. Chem.","2016","40","8","6554","","10.1039/C6NJ00666C","","","1.54184","CuKα","","0.084","0.0619","","","0.1687","0.1909","","","","","","1.034","","","","has coordinates,has disorder","185616","2020-10-21","18:00:00",""
"7055603","17.42499","0.00014","13.44287","0.0001","18.57921","0.00014","90","","93.9206","0.0007","90","","4341.84","0.06","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-(4-Methoxyphenyl)spiro[fluorene-4,2?-[2H]indene]-1?,3?,9(3H)-trione","","- C28 H18 O4 -","- C28 H18 O4 -","- C224 H144 O32 -","8","2","","Bekere, Laura; Larina, Nina; Lokshin, Vladimir; Ellern, Arkady; Sigalov, Mark; Khodorkovsky, Vladimir","A new class of spirocyclic photochromes reacting with light of both UV and visible ranges","New J. Chem.","2016","40","8","6554","","10.1039/C6NJ00666C","","","1.54184","CuKα","","0.0492","0.043","","","0.1181","0.126","","","","","","1.033","","","","has coordinates","193656","2020-10-21","18:00:00",""
"7055604","48.58","0.02","19.477","0.009","18.724","0.008","90","","101.814","0.01","90","","17341","13","296","2","296","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C65 H65 B Cl Cu2 N14 O41.5 W12 -","- C65 H53 B Cl Cu2 N14 O41.5 W12 -","- C520 H424 B8 Cl8 Cu16 N112 O332 W96 -","8","1","","Wang, Shuo; Yu, Kai; Wang, Bo; Wang, Lu; Wang, Chun-Xiao; Zhang, He; Wang, Chun-Mei; Zhou, Baibin","Construction of two novel borotungstates modified by different ligands connected with single/double bridges","New J. Chem.","2016","40","8","7011","","10.1039/C6NJ00155F","","","0.71073","MoKα","","0.0764","0.068","","","0.0956","0.126","","","","","","1.139","","","","has coordinates","185605","2020-10-21","18:00:00",""
"7055605","18.1729","0.0006","21.8162","0.0007","16.4158","0.0005","90","","90","","90","","6508.3","0.4","296","2","296","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C38 H36 B Cu2 N12 O40 W12 -","- C38 H36 B Cu2 N12 O40 W12 -","- C152 H144 B4 Cu8 N48 O160 W48 -","4","1","","Wang, Shuo; Yu, Kai; Wang, Bo; Wang, Lu; Wang, Chun-Xiao; Zhang, He; Wang, Chun-Mei; Zhou, Baibin","Construction of two novel borotungstates modified by different ligands connected with single/double bridges","New J. Chem.","2016","40","8","7011","","10.1039/C6NJ00155F","","","0.71073","MoKα","","0.0382","0.0337","","","0.0814","0.0838","","","","","","1.011","","","","has coordinates","185605","2020-10-21","18:00:00",""
"7055606","16.7909","0.0008","11.3883","0.0006","15.3276","0.0008","90","","90.119","0.001","90","","2930.9","0.3","147","2","147","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H17 Eu2 N3 O22 -","- C24 H17 Eu2 N3 O22 -","- C96 H68 Eu8 N12 O88 -","4","0.5","","Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Lough, Alan J.; Knee, Christopher S.","Eight rare earth metal organic frameworks and coordination polymers from 2-nitroterephthlate: syntheses, structures, solid-state luminescence and an unprecedented topology","New J. Chem.","2016","40","9","7338","","10.1039/C6NJ00822D","","","0.71073","MoKα","","0.0167","0.0147","","","0.0354","0.0364","","","","","","1.131","","","","has coordinates,has disorder","186463","2020-10-21","18:00:00",""
"7055607","16.7322","0.0009","11.3501","0.0009","15.2871","0.0009","90","","90.04","0.002","90","","2903.2","0.3","147","2","147","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H17 N3 O22 Tb2 -","- C24 H17 N3 O22 Tb2 -","- C96 H68 N12 O88 Tb8 -","4","0.5","","Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Lough, Alan J.; Knee, Christopher S.","Eight rare earth metal organic frameworks and coordination polymers from 2-nitroterephthlate: syntheses, structures, solid-state luminescence and an unprecedented topology","New J. Chem.","2016","40","9","7338","","10.1039/C6NJ00822D","","","0.71073","MoKα","","0.0162","0.0136","","","0.0316","0.0328","","","","","","1.091","","","","has coordinates,has disorder","186463","2020-10-21","18:00:00",""
"7055608","16.6713","0.0007","11.2905","0.0005","15.2129","0.0007","90","","90.2242","0.0012","90","","2863.5","0.2","147","2","147","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H17 Er2 N3 O22 -","- C24 H17 Er2 N3 O22 -","- C96 H68 Er8 N12 O88 -","4","0.5","","Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Lough, Alan J.; Knee, Christopher S.","Eight rare earth metal organic frameworks and coordination polymers from 2-nitroterephthlate: syntheses, structures, solid-state luminescence and an unprecedented topology","New J. Chem.","2016","40","9","7338","","10.1039/C6NJ00822D","","","0.71073","MoKα","","0.0194","0.0147","","","0.032","0.0335","","","","","","1.08","","","","has coordinates,has disorder","186463","2020-10-21","18:00:00",""
"7055609","8.3712","0.0005","9.8819","0.0006","10.268","0.0006","105.245","0.002","105.311","0.002","93.668","0.002","782.26","0.08","147","2","147","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H20 La2 N3 O24 -","- C24 H20 La2 N3 O24 -","- C24 H20 La2 N3 O24 -","1","0.5","","Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Lough, Alan J.; Knee, Christopher S.","Eight rare earth metal organic frameworks and coordination polymers from 2-nitroterephthlate: syntheses, structures, solid-state luminescence and an unprecedented topology","New J. Chem.","2016","40","9","7338","","10.1039/C6NJ00822D","","","0.71073","MoKα","","0.0206","0.0183","","","0.0414","0.0421","","","","","","1.141","","","","has coordinates,has disorder","186463","2020-10-21","18:00:00",""
"7055610","8.724","0.0006","11.3159","0.0008","12.3944","0.0009","109.997","0.007","95.76","0.006","110.131","0.007","1046.07","0.16","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H10 N2 Nd O14 -","- C16 H6 N2 Nd O14 -","- C32 H12 N4 Nd2 O28 -","2","1","","Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Lough, Alan J.; Knee, Christopher S.","Eight rare earth metal organic frameworks and coordination polymers from 2-nitroterephthlate: syntheses, structures, solid-state luminescence and an unprecedented topology","New J. Chem.","2016","40","9","7338","","10.1039/C6NJ00822D","","x-ray","0.71073","MoKα","","0.0517","0.0492","","","0.1404","0.1426","","","","","","1.093","","","","has coordinates","186463","2020-10-21","18:00:00",""
"7055611","6.907","0.0007","21.897","0.002","23.151","0.002","90","","90","","90","","3501.4","0.6","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H8 N2 Nd2 O24 -","- C24 H6 N3 Nd2 O26 -","- C96 H24 N12 Nd8 O104 -","4","0.5","","Smith, Jermaine A.; Singh-Wilmot, Marvadeen A.; Carter, Korey P.; Cahill, Christopher L.; Lough, Alan J.; Knee, Christopher S.","Eight rare earth metal organic frameworks and coordination polymers from 2-nitroterephthlate: syntheses, structures, solid-state luminescence and an unprecedented topology","New J. Chem.","2016","40","9","7338","","10.1039/C6NJ00822D","","x-ray","0.71073","MoKα","","0.0523","0.0376","","","0.0871","0.0945","","","","","","1.126","","","","has coordinates,has disorder","186463","2020-10-21","18:00:00",""
"7055612","19.017","0.002","5.109","0.0005","17.805","0.002","90","","99.507","0.012","90","","1706.1","0.3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H18 N4 S2 -","- C16 H18 N4 S2 -","- C64 H72 N16 S8 -","4","0.5","","Phukan, Nithi; Baruah, Jubaraj B.","Solvent and anion facilitated conformational changes in benzylamine substituted thiazolamine","New J. Chem.","2016","40","8","6899","","10.1039/C6NJ00154H","","","0.71073","MoKα","","0.0765","0.0659","","","0.1502","0.1552","","","","","","1.062","","","","has coordinates","185613","2020-10-21","18:00:00",""
"7055613","13.4747","0.0014","9.6657","0.001","13.4889","0.0014","90","","105.678","0.008","90","","1691.5","0.3","296","2","296","2","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","","- C16 H18 N4 S2 -","- C16 H18 N4 S2 -","- C64 H72 N16 S8 -","4","0.5","","Phukan, Nithi; Baruah, Jubaraj B.","Solvent and anion facilitated conformational changes in benzylamine substituted thiazolamine","New J. Chem.","2016","40","8","6899","","10.1039/C6NJ00154H","","","0.71073","MoKα","","0.0446","0.0375","","","0.1242","0.1328","","","","","","1.017","","","","has coordinates","185613","2020-10-21","18:00:00",""
"7055614","7.5072","0.0006","8.4305","0.0007","9.1386","0.0007","73.216","0.004","85.375","0.005","74.943","0.005","534.72","0.08","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H24 Br2 N4 O2 S2 -","- C16 H24 Br2 N4 O2 S2 -","- C16 H24 Br2 N4 O2 S2 -","1","0.5","","Phukan, Nithi; Baruah, Jubaraj B.","Solvent and anion facilitated conformational changes in benzylamine substituted thiazolamine","New J. Chem.","2016","40","8","6899","","10.1039/C6NJ00154H","","","0.71073","MoKα","","0.0386","0.0303","","","0.0621","0.0648","","","","","","1.083","","","","has coordinates","185613","2020-10-21","18:00:00",""
"7055615","7.0178","0.0017","16.125","0.004","9.208","0.002","90","","104.814","0.015","90","","1007.4","0.4","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 N6 O6 S2 -","- C16 H20 N6 O6 S2 -","- C32 H40 N12 O12 S4 -","2","0.5","","Phukan, Nithi; Baruah, Jubaraj B.","Solvent and anion facilitated conformational changes in benzylamine substituted thiazolamine","New J. Chem.","2016","40","8","6899","","10.1039/C6NJ00154H","","","0.71073","MoKα","","0.0906","0.0678","","","0.1523","0.1616","","","","","","1.058","","","","has coordinates","185613","2020-10-21","18:00:00",""
"7055616","8.0722","0.0008","19.8911","0.0019","9.3871","0.0009","90","","98.293","0.004","90","","1491.5","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H30 N4 O16 P4 S2 -","- C16 H30 N4 O16 P4 S2 -","- C32 H60 N8 O32 P8 S4 -","2","0.5","","Phukan, Nithi; Baruah, Jubaraj B.","Solvent and anion facilitated conformational changes in benzylamine substituted thiazolamine","New J. Chem.","2016","40","8","6899","","10.1039/C6NJ00154H","","","0.71073","MoKα","","0.0331","0.0298","","","0.0681","0.0694","","","","","","1.024","","","","has coordinates","185613","2020-10-21","18:00:00",""
"7055617","9.3155","0.0014","17.453","0.003","21.676","0.003","90","","94.652","0.002","90","","3512.5","0.9","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H34 La N5 Ni O16 -","- C27 H34 La N5 Ni O16 -","- C108 H136 La4 N20 Ni4 O64 -","4","1","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)–lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","","0.71073","MoKα","","0.0476","0.0344","","","0.0921","0.1204","","","","","","1.091","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7055618","11.4571","0.0015","12.3081","0.0017","12.5899","0.0017","65.463","0.013","75.741","0.012","85.765","0.011","1564.5","0.4","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H26 Dy N5 Ni O14 -","- C25 H26 Dy N5 Ni O14 -","- C50 H52 Dy2 N10 Ni2 O28 -","2","1","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","x-ray","0.71073","MoKα","","0.0531","0.0418","","","0.0647","0.0714","","","","","","1","","","","has coordinates","185618","2020-10-21","18:00:00",""
"7055619","11.392","0.003","15.729","0.004","11.421","0.003","90","","115.83","0.003","90","","1842","0.8","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C29 H30 La N7 Ni O16 -","- C29 H30 La N7 Ni O16 -","- C58 H60 La2 N14 Ni2 O32 -","2","1","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","","0.71073","MoKα","","0.0638","0.0604","","","0.18","0.187","","","","","","1.135","","","","has coordinates","185618","2020-10-21","18:00:00",""
"7055620","10.2398","0.0004","20.6747","0.0007","15.2449","0.0005","90","","92.096","0.003","90","","3225.3","0.2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C28 H26 N7 Ni O15 Tb -","- C28 H26 N7 Ni O15 Tb -","- C112 H104 N28 Ni4 O60 Tb4 -","4","1","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","x-ray","1.54184","CuKα","","0.0419","0.041","","","0.1026","0.1038","","","","","","1.078","","","","has coordinates,has disorder","185618","2020-10-21","18:00:00",""
"7055621","11.8105","0.0007","12.7474","0.0007","12.9606","0.0007","115.947","0.006","98.65","0.005","94.593","0.005","1711.1","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H29 Dy N6 Ni O14 -","- C30 H29 Dy N6 Ni O14 -","- C60 H58 Dy2 N12 Ni2 O28 -","2","1","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","x-ray","1.54184","CuKα","","0.0577","0.0494","","","0.1271","0.1334","","","","","","1.032","","","","has coordinates","185618","2020-10-21","18:00:00",""
"7055622","15.3389","0.0003","13.0476","0.0004","17.2529","0.0004","90","","97.2166","0.0018","90","","3425.57","0.15","293.42","0.1","293.42","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 La2 N10 Ni2 O32 -","- C52 H62 La2 N10 Ni2 O32 -","- C104 H124 La4 N20 Ni4 O64 -","2","0.5","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","x-ray","0.71073","MoKα","","0.0599","0.0414","","","0.0781","0.0904","","","","","","1.061","","","","has coordinates","185618","2020-10-21","18:00:00",""
"7055623","15.1274","0.0007","12.9696","0.0007","17.1643","0.0008","90","","97.274","0.004","90","","3340.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H62 Gd2 N10 Ni2 O32 -","- C52 H62 Gd2 N10 Ni2 O32 -","- C104 H124 Gd4 N20 Ni4 O64 -","2","0.5","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","x-ray","1.54184","CuKα","","0.0534","0.0423","","","0.1059","0.1152","","","","","","1.022","","","","has coordinates","185618","2020-10-21","18:00:00",""
"7055624","10.5724","0.0008","12.5483","0.0012","13.8671","0.0007","99.027","0.006","95.068","0.005","101.985","0.007","1763.3","0.2","296.71","0.1","296.71","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C50 H54 N10 Ni2 O30 Tb2 -","- C50 H54 N10 Ni2 O30 Tb2 -","- C50 H54 N10 Ni2 O30 Tb2 -","1","0.5","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","x-ray","0.71073","MoKα","","0.0545","0.04","","","0.0781","0.0851","","","","","","0.996","","","","has coordinates","185618","2020-10-21","18:00:00",""
"7055625","10.6782","0.0012","12.6632","0.0011","14.0108","0.0012","98.892","0.007","94.93","0.008","101.762","0.008","1818.9","0.3","293.33","0.1","293.33","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C50 H54 Dy2 N10 Ni2 O30 -","- C50 H54 Dy2 N10 Ni2 O30 -","- C50 H54 Dy2 N10 Ni2 O30 -","1","0.5","","Dong, Wen-Kui; Ma, Jian-Chun; Zhu, Li-Chun; Zhang, Yang","Nine self-assembled nickel(ii)‒lanthanide(iii) heterometallic complexes constructed from a Salamo-type bisoxime and bearing a N- or O-donor auxiliary ligand: syntheses, structures and magnetic properties","New J. Chem.","2016","40","8","6998","","10.1039/C6NJ00855K","","x-ray","0.71073","MoKα","","0.0489","0.0383","","","0.0777","0.0839","","","","","","0.996","","","","has coordinates","185618","2020-10-21","18:00:00",""
"7055626","12.0095","0.0011","13.3991","0.0012","24.2381","0.0019","90","","91.893","0.001","90","","3898.2","0.6","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H44 F2 O8 Sn4 Te2 -","- C24 H44 F2 O8 Sn4 Te2 -","- C96 H176 F8 O32 Sn16 Te8 -","4","1","","Ma, Chunlin; Liu, Xinglong; Cheng, Shuang; Li, Qianli; Zhang, Rufen","A novel 4-fluorobenzenetelluronic trimethyltin ester: synthesis, characterization and in vitro cytotoxicity assessment","New J. Chem.","2016","40","8","6946","","10.1039/C6NJ00288A","","","0.71073","MoKα","","0.1085","0.0585","","","0.1383","0.176","","","","","","1.083","","","","has coordinates","185619","2020-10-21","18:00:00",""
"7055627","10.9312","0.0006","9.1547","0.0009","16.4772","0.0009","90","","93.129","0.005","90","","1646.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H17 N O2 -","- C21 H17 N O2 -","- C84 H68 N4 O8 -","4","1","","Trišović, Nemanja; Antanasijević, Jelena; Rogan, Jelena; Poleti, Dejan; Tóth-Katona, Tibor; Salamonczyk, Miroslaw; Jákli, Antal; Fodor-Csorba, Katalin","Investigation of supramolecular architectures of bent-shaped pyridine derivatives: from a three-ring crystalline compound towards five-ring mesogens","New J. Chem.","2016","40","8","6977","","10.1039/C6NJ01515H","","x-ray","0.71073","MoKα","","0.1946","0.0975","","","0.1125","0.1352","","","","","","1.098","","","","has coordinates","185620","2020-10-21","18:00:00",""
"7055628","7.6659","0.0013","15.982","0.003","9.5235","0.0015","90","","92.263","0.008","90","","1165.9","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 N4 -","- C28 H34 N4 -","- C56 H68 N8 -","2","0.5","","Zhang, Shaofei; Kim, Han-Je; Tang, Qun; Yang, Eunkyung; Bocian, David F.; Holten, Dewey; Lindsey, Jonathan S.","Synthesis and photophysical characteristics of 2,3,12,13-tetraalkylbacteriochlorins","New J. Chem.","2016","40","7","5942","","10.1039/C6NJ00517A","","","0.71073","MoKα","","0.0547","0.0436","","","0.1184","0.1251","","","","","","1.06","","","","has coordinates","185582","2020-10-21","18:00:00",""
"7055629","8.8305","0.0017","9.1614","0.0018","16.76","0.003","75.104","0.005","81.51","0.005","77.835","0.005","1274.6","0.4","101","2","101","2","","","","","","","","6","P 1","P 1","1","","","","- C45 H53 F12 N5 O12 S2 -","- C45 H53 F12 N5 O12 S2 -","- C45 H53 F12 N5 O12 S2 -","1","1","","Zdanowski, Szymon; Piątek, Piotr; Romański, Jan","An ion pair receptor facilitating the extraction of chloride salt from the aqueous to the organic phase","New J. Chem.","2016","40","8","7190","","10.1039/C6NJ01482H","","","0.71073","MoKα","","0.0248","0.0233","","","0.0552","0.0559","","","","","","1.039","","","","has coordinates","185612","2020-10-21","18:00:00",""
"7055630","8.8972","0.0005","11.12","0.0006","12.9995","0.0006","112.409","0.004","96.989","0.004","93.49","0.004","1172.08","0.11","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H18 Cl N4 O7 Re S -","- C19 H18 Cl N4 O7 Re S -","- C38 H36 Cl2 N8 O14 Re2 S2 -","2","1","","Garcia, Camila Vargas; Parrilha, Gabrieli Lessa; Rodrigues, Bernardo Lages; Teixeira, Sarah Fernandes; de Azevedo, Ricardo Alexandre; Ferreira, Adilson Kleber; Beraldo, Heloisa","Tricarbonylrhenium(i) complexes with 2-acetylpyridine-derived hydrazones are cytotoxic to NCI-H460 human large cell lung cancer","New J. Chem.","2016","40","9","7379","","10.1039/C6NJ00050A","","","0.71073","MoKα","","0.0395","0.03","","","0.0676","0.072","","","","","","1.089","","","","has coordinates","186460","2020-10-21","18:00:00",""
"7055631","12.6872","0.0002","9.572","0.0002","14.983","0.0002","90","","98.3","0.002","90","","1800.51","0.05","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H13 Cl N3 O4 Re -","- C17 H13 Cl N3 O4 Re -","- C68 H52 Cl4 N12 O16 Re4 -","4","1","","Garcia, Camila Vargas; Parrilha, Gabrieli Lessa; Rodrigues, Bernardo Lages; Teixeira, Sarah Fernandes; de Azevedo, Ricardo Alexandre; Ferreira, Adilson Kleber; Beraldo, Heloisa","Tricarbonylrhenium(i) complexes with 2-acetylpyridine-derived hydrazones are cytotoxic to NCI-H460 human large cell lung cancer","New J. Chem.","2016","40","9","7379","","10.1039/C6NJ00050A","","","0.71073","MoKα","","0.0343","0.0226","","","0.0615","0.0662","","","","","","1.211","","","","has coordinates","186460","2020-10-21","18:00:00",""
"7055632","8.7687","0.0004","11.1002","0.0005","12.9282","0.0005","113.002","0.004","97.163","0.004","93.603","0.004","1140.66","0.09","200","2","200","2","","","","","","","synthesis as described","7","P -1","-P 1","2","","","","- C19 H18 Cl2 N3 O5 Re S -","- C19 H18 Cl2 N3 O5 Re S -","- C38 H36 Cl4 N6 O10 Re2 S2 -","2","1","","Garcia, Camila Vargas; Parrilha, Gabrieli Lessa; Rodrigues, Bernardo Lages; Teixeira, Sarah Fernandes; de Azevedo, Ricardo Alexandre; Ferreira, Adilson Kleber; Beraldo, Heloisa","Tricarbonylrhenium(i) complexes with 2-acetylpyridine-derived hydrazones are cytotoxic to NCI-H460 human large cell lung cancer","New J. Chem.","2016","40","9","7379","","10.1039/C6NJ00050A","","x-ray","0.71073","MoKα","","0.0333","0.0255","","","0.0478","0.0508","","","","","","1.061","","","","has coordinates","186460","2020-10-21","18:00:00",""
"7055633","10.7683","0.0005","14.1119","0.0007","14.4106","0.0007","77.307","0.004","80.723","0.004","83.274","0.004","2100.79","0.18","295","","295","","","","","","","","","5","P -1","-P 1","2","","Complex 1","","- C50 H36 Cd2 N2 O10 -","- C50 H36 Cd2 N2 O10 -","- C100 H72 Cd4 N4 O20 -","2","1","","Liu, Xiaobin; Xiao, Zhenyu; Huang, Ao; Wang, Wen; Zhang, Liangliang; Wang, Rongming; Sun, Daofeng","Crystal structures, topological analysis and luminescence properties of three coordination polymers based on a semi-rigid ligand and N-donor ligand linkers","New J. Chem.","2016","40","7","5957","","10.1039/C6NJ00180G","","","0.71","MoKα","","0.1104","0.0801","","","0.1985","0.2137","","","","","","1.109","","","","has coordinates","185589","2020-10-21","18:00:00",""
"7055634","23.9468","0.001","9.1029","0.0003","26.8693","0.001","90","","116.161","0.005","90","","5257.1","0.4","295","","295","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H16 N O4 Zn -","- C25 H16 N O4 Zn -","- C200 H128 N8 O32 Zn8 -","8","1","","Liu, Xiaobin; Xiao, Zhenyu; Huang, Ao; Wang, Wen; Zhang, Liangliang; Wang, Rongming; Sun, Daofeng","Crystal structures, topological analysis and luminescence properties of three coordination polymers based on a semi-rigid ligand and N-donor ligand linkers","New J. Chem.","2016","40","7","5957","","10.1039/C6NJ00180G","","","0.71","MoKα","","0.0545","0.0498","","","0.1424","0.1516","","","","","","1.048","","","","has coordinates","185589","2020-10-21","18:00:00",""
"7055635","12.8278","0.0003","11.4187","0.0003","19.1951","0.0005","90","","95.151","0.002","90","","2800.28","0.12","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Complex 3","","- C32 H28 Co N4 O7 -","- C32 H28 Co N4 O7 -","- C128 H112 Co4 N16 O28 -","4","1","","Liu, Xiaobin; Xiao, Zhenyu; Huang, Ao; Wang, Wen; Zhang, Liangliang; Wang, Rongming; Sun, Daofeng","Crystal structures, topological analysis and luminescence properties of three coordination polymers based on a semi-rigid ligand and N-donor ligand linkers","New J. Chem.","2016","40","7","5957","","10.1039/C6NJ00180G","","x-ray","1.54184","CuKα","","0.0598","0.0499","","","0.1417","0.1488","","","","","","1.041","","","","has coordinates","185589","2020-10-21","18:00:00",""
"7055636","18.463","0.002","13.6212","0.0018","15.5388","0.0018","90","","92.291","0.013","90","","3904.7","0.8","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31.5 H34.5 Cl2 N5 Ni2 O7.25 S -","- C31.5 H32 Cl2 N5 Ni2 O7.25 S -","- C126 H128 Cl8 N20 Ni8 O29 S4 -","4","1","","Sanyal, Ria; Zhang, Xuepeng; Chakraborty, Prateeti; Giri, Sanjib; Chattopadhyay, Shyamal Kumar; Zhao, Cunyuan; Das, Debasis","Role of solvent in the phosphatase activity of a dinuclear nickel(ii) complex of a Schiff base ligand: mechanistic interpretation by DFT studies","New J. Chem.","2016","40","9","7388","","10.1039/C6NJ01043A","","","0.71073","MoKα","","0.1552","0.0767","","","0.1767","0.203","","","","","","0.92","","","","has coordinates,has disorder","288193","2023-12-08","17:12:24",""
"7055637","15.331","0.003","15.527","0.004","14.982","0.004","90","","118.319","0.002","90","","3139.6","1.3","173.15","","173.15","","","","","","","","no","6","P 1 21/c 1","-P 2ybc","14","no","Ni5","","- C28 H37 Br2 N3 Ni O5 -","- C28 H37 Br2 N3 Ni O5 -","- C112 H148 Br8 N12 Ni4 O20 -","4","1","","Zhang, Jie; Liu, Shaofeng; Li, Antai; Ye, Hongqi; Li, Zhibo","Nickel(ii) complexes chelated by 2,6-pyridinedicarboxamide: syntheses, characterization, and ethylene oligomerization","New J. Chem.","2016","40","8","7027","","10.1039/C6NJ00559D","","","0.71073","MoKα","","0.0909","0.0806","","","0.1632","0.1684","","","","","","1.235","","","","has coordinates,has disorder","185611","2020-10-21","18:00:00",""
"7055638","14.859","0.003","16.766","0.004","16.883","0.004","90","","90","","90","","4206","1.6","173.15","","173.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C37 H57 Br2 N3 Ni O5 -","- C37 H57 Br2 N3 Ni O5 -","- C148 H228 Br8 N12 Ni4 O20 -","4","1","","Zhang, Jie; Liu, Shaofeng; Li, Antai; Ye, Hongqi; Li, Zhibo","Nickel(ii) complexes chelated by 2,6-pyridinedicarboxamide: syntheses, characterization, and ethylene oligomerization","New J. Chem.","2016","40","8","7027","","10.1039/C6NJ00559D","","","0.71073","MoKα","","0.0551","0.0483","","","0.0909","0.0954","","","","","","1.118","","","","has coordinates,has disorder","185611","2020-10-21","18:00:00",""
"7055639","9.2602","0.0006","7.3075","0.0004","22.2069","0.0012","90","","93.583","0.005","90","","1499.78","0.15","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-Carboxy-10-methylacridinium chloride dihydrate","","- C15 H16 Cl N O4 -","- C15 H16 Cl N O4 -","- C60 H64 Cl4 N4 O16 -","4","1","","Trzybiński, Damian; Zadykowicz, Beata; Wera, Michał; Serdiuk, Illia E.; Sieradzan, Andrzej; Sikorski, Artur; Storoniak, Piotr; Krzymiński, Karol","Structure, formation, thermodynamics and interactions in 9-carboxy-10-methylacridinium-based molecular systems","New J. Chem.","2016","40","9","7359","","10.1039/C6NJ00725B","","","0.71073","MoKα","","0.1125","0.0538","","","0.1196","0.1512","","","","","","0.981","","","","has coordinates","186461","2020-10-21","18:00:00",""
"7055640","8.2989","0.0009","9.0995","0.001","9.8014","0.0009","72.396","0.009","77.357","0.008","78.795","0.009","681.83","0.13","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Hydrogen bis(9-carboxy-10-methylacridinium) trifluoromethanesulfonate","","- C31 H23 F3 N2 O7 S -","- C31 H23 F3 N2 O7 S -","- C31 H23 F3 N2 O7 S -","1","0.5","","Trzybiński, Damian; Zadykowicz, Beata; Wera, Michał; Serdiuk, Illia E.; Sieradzan, Andrzej; Sikorski, Artur; Storoniak, Piotr; Krzymiński, Karol","Structure, formation, thermodynamics and interactions in 9-carboxy-10-methylacridinium-based molecular systems","New J. Chem.","2016","40","9","7359","","10.1039/C6NJ00725B","","","0.71073","MoKα","","0.0827","0.0436","","","0.0909","0.1072","","","","","","0.996","","","","has coordinates","186461","2020-10-21","18:00:00",""
"7055641","9.4378","0.0004","7.0489","0.0003","21.1972","0.0008","90","","97.158","0.004","90","","1399.18","0.1","110","2","110","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Hydrogen bis(9-carboxy-10-methylacridinium) chloride dihydrate","","- C30 H31 Cl N2 O8 -","- C30 H31 Cl N2 O8 -","- C60 H62 Cl2 N4 O16 -","2","0.5","","Trzybiński, Damian; Zadykowicz, Beata; Wera, Michał; Serdiuk, Illia E.; Sieradzan, Andrzej; Sikorski, Artur; Storoniak, Piotr; Krzymiński, Karol","Structure, formation, thermodynamics and interactions in 9-carboxy-10-methylacridinium-based molecular systems","New J. Chem.","2016","40","9","7359","","10.1039/C6NJ00725B","","","0.71073","MoKα","","0.0773","0.0684","","","0.2128","0.2259","","","","","","1.107","","","","has coordinates","186461","2020-10-21","18:00:00",""
"7055642","9.9481","0.0001","10.8651","0.0001","13.2427","0.0002","70.643","0.001","68.039","0.001","87.764","0.001","1246.55","0.03","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H25 N3 O4 -","- C31 H25 N3 O4 -","- C62 H50 N6 O8 -","2","1","","Mathusalini, Sadasivam; Arasakumar, Thangaraj; Lakshmi, Krishnasamy; Lin, Chia-Her; Mohan, Palathurai Subramaniam; Ramnath, Madhusudhanan Gogul; Thirugnanasampandan, Ramaraj","Synthesis and biological evaluation of new spirooxindoles with embedded pharmacophores","New J. Chem.","2016","40","6","5164","","10.1039/C6NJ00534A","","","0.71073","MoKα","","0.0703","0.045","","","0.1054","0.12","","","","","","1.043","","","","has coordinates","183672","2020-10-21","18:00:00",""
"7055643","16.8955","0.0006","10.3515","0.0004","11.5475","0.0005","90","","90","","90","","2019.59","0.14","150","2","150","2","","","","","","","","6","C m c 21","C 2c -2","36","","dichlorido-bis[N-(4-methoxyphenyl)acetamide-O]-zinc(II)","","- C18 H22 Cl2 N2 O4 Zn -","- C18 H22 Cl2 N2 O4 Zn -","- C72 H88 Cl8 N8 O16 Zn4 -","4","0.5","","Sultana, Kishwar; Zaib, Sumera; Hassan Khan, Najm ul; Khan, Imtiaz; Shahid, Khadija; Simpson, Jim; Iqbal, Jamshed","Exploiting the potential of aryl acetamide derived Zn(ii) complexes in medicinal chemistry: synthesis, structural analysis, assessment of biological profile and molecular docking studies","New J. Chem.","2016","40","8","7084","","10.1039/C5NJ03531G","","","1.54178","CuKα","","0.0257","0.0256","","","0.0664","0.0665","","","","","","1.07","","","","has coordinates","185615","2020-10-21","18:00:00",""
"7055644","19.4113","0.0017","13.0587","0.0012","11.0459","0.001","90","","90","","90","","2800","0.4","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H33 Cl6 N6 Sc -","- C18 H33 Cl6 N6 Sc -","- C72 H132 Cl24 N24 Sc4 -","4","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71073","MoKα","","0.029","0.0257","","","0.0626","0.0642","","","","","","1.023","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055645","19.58","0.002","13.0359","0.0015","11.1656","0.0013","90","","90","","90","","2849.9","0.5","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H33 Cl6 N6 Y -","- C18 H33 Cl6 N6 Y -","- C72 H132 Cl24 N24 Y4 -","4","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71075","MoKα","","0.0429","0.0282","","","0.0454","0.0479","","","","","","0.797","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055646","15.492","0.003","12.549","0.002","14.708","0.003","90","","90.482","0.003","90","","2859.3","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 Ce Cl6 N6 -","- C18 H33 Ce Cl6 N6 -","- C72 H132 Ce4 Cl24 N24 -","4","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71073","MoKα","","0.0957","0.0644","","","0.1684","0.1867","","","","","","1.04","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055647","15.925","0.005","12.787","0.004","15.252","0.005","90","","90.588","0.005","90","","3105.6","1.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 Br6 La N6 -","- C18 H33 Br6 La N6 -","- C72 H132 Br24 La4 N24 -","4","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71073","MoKα","","0.1156","0.0818","","","0.1337","0.1475","","","","","","1.145","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055648","18.803","0.007","11.1325","0.0015","17.017","0.002","90","","102.162","0.007","90","","3482.1","1.4","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H33 I6 La N6 -","- C18 H33 I6 La N6 -","- C72 H132 I24 La4 N24 -","4","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71073","MoKα","","0.0357","0.0308","","","0.0752","0.0775","","","","","","1.073","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055649","9.917","0.0008","16.2743","0.0012","19.0282","0.0016","90","","99.973","0.001","90","","3024.6","0.4","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H39 Cl6 N6 Y -","- C21 H39 Cl6 N6 Y -","- C84 H156 Cl24 N24 Y4 -","4","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71073","MoKα","","0.0393","0.0278","","","0.064","0.0674","","","","","","1.028","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055650","10.0265","0.0017","16.306","0.002","19.133","0.003","90","","99.265","0.003","90","","3087.3","0.8","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H39 Cl6 La N6 -","- C21 H39 Cl6 La N6 -","- C84 H156 Cl24 La4 N24 -","4","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71073","MoKα","","0.0264","0.0229","","","0.0552","0.0566","","","","","","1.078","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055651","10.347","0.002","11.075","0.003","16.577","0.003","92.594","0.003","90.255","0.003","106.93","0.004","1815.1","0.7","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C21 H39 I6 La N6 -","- C21 H39 I6 La N6 -","- C42 H78 I12 La2 N12 -","2","1","","Champion, Martin J. D.; Levason, William; Pugh, David; Reid, Gillian","Hexahalometallate salts of trivalent scandium, yttrium and lanthanum: cation‒anion association in the solid state and in solution","New J. Chem.","2016","40","8","7181","","10.1039/C6NJ01068G","","","0.71073","MoKα","","0.0209","0.0189","","","0.0412","0.0421","","","","","","0.984","","","","has coordinates","185601","2020-10-21","18:00:00",""
"7055652","9.5496","0.0007","11.3126","0.0008","18.048","0.0013","80.204","0.005","86.141","0.005","89.079","0.005","1916.9","0.2","115","","115","","","","","","","","","4","P -1","-P 1","2","","","","- C25 H23 N O -","- C25 H23 N O -","- C100 H92 N4 O4 -","4","2","","Aich, Krishnendu; Das, Sangita; Goswami, Shyamaprosad; Quah, Ching Kheng; Sarkar, Deblina; Mondal, Tapan Kumar; Fun, Hoong-Kun","Carbazole‒benzimidazole based dyes for acid responsive ratiometric emissive switches","New J. Chem.","2016","40","8","6907","","10.1039/C6NJ00063K","","","0.71073","MoKα","","0.1995","0.0978","","","0.2593","0.3269","","","","","","1.052","","","","has coordinates,has disorder","185609","2020-10-21","18:00:00",""
"7055653","9.7031","0.0013","11.7775","0.0014","31.57","0.004","90","","95.921","0.002","90","","3588.5","0.8","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 N O -","- C23 H21 N O -","- C184 H168 N8 O8 -","8","2","","Aich, Krishnendu; Das, Sangita; Goswami, Shyamaprosad; Quah, Ching Kheng; Sarkar, Deblina; Mondal, Tapan Kumar; Fun, Hoong-Kun","Carbazole‒benzimidazole based dyes for acid responsive ratiometric emissive switches","New J. Chem.","2016","40","8","6907","","10.1039/C6NJ00063K","","","0.71073","MoKα","","0.1041","0.0609","","","0.1697","0.2021","","","","","","1.038","","","","has coordinates,has disorder","185609","2020-10-21","18:00:00",""
"7055654","13.244","0.005","13.546","0.005","14.691","0.005","74.1","0.005","69.748","0.005","65.588","0.005","2225","1.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H92 Mo12 N10 Ni O73 P8 -","- C30 H64 Mo12 N10 Ni O73 P8 -","- C30 H64 Mo12 N10 Ni O73 P8 -","1","0.5","","Paul, Luna; Dolai, Malay; Panja, Anangamohan; Ali, Mahammad","Hydrothermal synthesis of two supramolecular inorganic‒organic hybrid phosphomolybdates based on Ni(ii) and Co(ii) ions: structural diversity and heterogeneous catalytic activities","New J. Chem.","2016","40","8","6931","","10.1039/C6NJ00440G","","","0.71073","MoKα","","0.0341","0.0318","","","0.0896","0.0912","","","","","","1.049","","","","has coordinates,has disorder","185617","2020-10-21","18:00:00",""
"7055655","28.086","0.004","9.744","0.002","18.685","0.003","90","","126.78","0.005","90","","4095.6","1.2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C12 H52 Co Mo5 N4 O35 P2 -","- C12 H52 Co Mo5 N4 O35 P2 -","- C48 H208 Co4 Mo20 N16 O140 P8 -","4","0.5","","Paul, Luna; Dolai, Malay; Panja, Anangamohan; Ali, Mahammad","Hydrothermal synthesis of two supramolecular inorganic‒organic hybrid phosphomolybdates based on Ni(ii) and Co(ii) ions: structural diversity and heterogeneous catalytic activities","New J. Chem.","2016","40","8","6931","","10.1039/C6NJ00440G","","","0.71073","MoKα","","0.0998","0.0619","","","0.1285","0.1545","","","","","","1.079","","","","has coordinates","185617","2020-10-21","18:00:00",""
"7055656","8.3169","0.0004","10.5724","0.0004","29.2702","0.0011","90","","96.188","0.002","90","","2558.72","0.18","150","2","150","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C18 H24 Au O4 S8 -","- C18 H24 Au O4 S8 -","- C72 H96 Au4 O16 S32 -","4","2","","Le Pennec, Ronan; Jeannin, Olivier; Auban-Senzier, Pascale; Fourmigué, Marc","Chiral, radical, gold bis(dithiolene) complexes","New J. Chem.","2016","40","8","7113","","10.1039/C6NJ01177B","","x-ray","0.71073","MoKα","","0.0526","0.0373","","","0.0805","0.0883","","","","","","0.797","","","","has coordinates","185604","2020-10-21","18:00:00",""
"7055657","8.2523","0.0005","12.0142","0.0006","19.6329","0.0008","90","","99.125","0.004","90","","1921.87","0.17","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/m 1","-P 2yb","11","","","","- C12 H12 Au S10 -","- C12 H12 Au S10 -","- C48 H48 Au4 S40 -","4","1","","Le Pennec, Ronan; Jeannin, Olivier; Auban-Senzier, Pascale; Fourmigué, Marc","Chiral, radical, gold bis(dithiolene) complexes","New J. Chem.","2016","40","8","7113","","10.1039/C6NJ01177B","","x-ray","0.71073","MoKα","","0.0967","0.0555","","","0.1051","0.1198","","","","","","1.083","","","","has coordinates,has disorder","185604","2020-10-21","18:00:00",""
"7055658","13.6322","0.0006","13.9463","0.0004","20.562","0.0008","90","","101.23","0.002","90","","3834.4","0.3","150","2","150","2","","","","","","","synthesis as described","5","P 1 21 1","P 2yb","4","","","","- C30 H56 Au N S8 -","- C30 H56 Au N S8 -","- C120 H224 Au4 N4 S32 -","4","2","","Le Pennec, Ronan; Jeannin, Olivier; Auban-Senzier, Pascale; Fourmigué, Marc","Chiral, radical, gold bis(dithiolene) complexes","New J. Chem.","2016","40","8","7113","","10.1039/C6NJ01177B","","x-ray","0.71073","MoKα","","0.0473","0.0383","","","0.0815","0.0867","","","","","","0.743","","","","has coordinates","185604","2020-10-21","18:00:00",""
"7055659","11.0845","0.0003","29.8343","0.0007","17.4548","0.0004","90","","104.412","0.001","90","","5590.6","0.2","150","2","150","2","","","","","","","synthesis as described","7","P 1 21 1","P 2yb","4","","","","- C39 H69 Au Cl6 N O4 S8 -","- C39 H69 Au Cl6 N O4 S8 -","- C156 H276 Au4 Cl24 N4 O16 S32 -","4","2","","Le Pennec, Ronan; Jeannin, Olivier; Auban-Senzier, Pascale; Fourmigué, Marc","Chiral, radical, gold bis(dithiolene) complexes","New J. Chem.","2016","40","8","7113","","10.1039/C6NJ01177B","","x-ray","0.71073","MoKα","","0.0974","0.0774","","","0.1722","0.1803","","","","","","1.11","","","","has coordinates","185604","2020-10-21","18:00:00",""
"7055660","17.4652","0.0014","10.836","0.0009","17.7614","0.0013","90","","90.474","0.004","90","","3361.3","0.5","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H48 Au N S8 -","- C26 H48 Au N S8 -","- C104 H192 Au4 N4 S32 -","4","1","","Le Pennec, Ronan; Jeannin, Olivier; Auban-Senzier, Pascale; Fourmigué, Marc","Chiral, radical, gold bis(dithiolene) complexes","New J. Chem.","2016","40","8","7113","","10.1039/C6NJ01177B","","x-ray","0.71073","MoKα","","0.0248","0.0202","","","0.0448","0.0462","","","","","","1.016","","","","has coordinates","185604","2020-10-21","18:00:00",""
"7055661","8.8493","0.0013","13.631","0.002","40.617","0.006","90","","95.482","0.003","90","","4877","1.2","296","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Fe(ptpy)(Hptpy)](PF6)3","(4' - (4-pyridyl) - 22,';6',2""-terpyridine)(4' - (4-pyridinium) - 22,';6',2""-terpyridine)iron(II) hexaflurophosphate","","- C44 H35 F18 Fe N10 P3 -","- C44 H35 F18 Fe N10 P3 -","- C176 H140 F72 Fe4 N40 P12 -","4","1","","Jacob, Geevarghese Vadakken; Sutradhar, Sanjeeb; Patnaik, Archita","Proton switching as a driving force for the metal‒organic complex-mediated growth of gold colloids","New J. Chem.","2016","40","9","7431","","10.1039/C6NJ01380E","","","0.71073","MoKα","","0.15","0.082","","","0.1667","0.1925","","","","","","1.07","","","","has coordinates,has disorder","186458","2020-10-21","18:00:00",""
"7055662","16.3977","0.0005","8.3891","0.0003","29.1772","0.0009","90","","90","","90","","4013.7","0.2","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","1-(3-ammoniopropyl)-4-[(E)-2-(4-nitrophenyl)vinyl]pyridinium diperchlorate, hydrate","","- C16 H19.5 Cl2 N3 O10.25 -","- C16 H19 Cl2 N3 O10.25 -","- C128 H152 Cl16 N24 O82 -","8","1","","Gromov, Sergey P.; Vedernikov, Artem I.; Sazonov, Sergey K.; Kuz’mina, Lyudmila G.; Lobova, Natalia A.; Strelenko, Yuri A.; Howard, Judith A. K.","Synthesis, structure, and stereospecific cross-[2+2] photocycloaddition of pseudodimeric complexes based on ammonioalkyl derivatives of styryl dyes","New J. Chem.","2016","40","9","7542","","10.1039/C5NJ03500G","","","1.54178","CuKα","","0.0841","0.0588","","","0.1064","0.1179","","","","","","1.035","","","","has coordinates,has disorder","186459","2020-10-21","18:00:00",""
"7055663","7.9257","0.0005","11.427","0.0007","19.6257","0.001","100.1","0.002","100.108","0.002","93.581","0.002","1714.75","0.18","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","2-[(E)-2-(2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin-18-yl)vinyl]-3-ethyl-1,3-benzothiazol-3-ium perchlorate, dioxane and water solvate","","- C31 H48 Cl N O15 S -","- C31 H48 Cl N O15 S -","- C62 H96 Cl2 N2 O30 S2 -","2","1","","Gromov, Sergey P.; Vedernikov, Artem I.; Sazonov, Sergey K.; Kuz’mina, Lyudmila G.; Lobova, Natalia A.; Strelenko, Yuri A.; Howard, Judith A. K.","Synthesis, structure, and stereospecific cross-[2+2] photocycloaddition of pseudodimeric complexes based on ammonioalkyl derivatives of styryl dyes","New J. Chem.","2016","40","9","7542","","10.1039/C5NJ03500G","","","0.71073","MoKα","","0.1282","0.0578","","","0.116","0.1381","","","","","","0.875","","","","has coordinates","186459","2020-10-21","18:00:00",""
"7055664","37.878","0.008","16.492","0.003","35.71","0.007","90","","106.404","0.003","90","","21399","7","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","complex between 1-(3-ammoniopropyl)-4-{(E)-2-[4-(methylthio)-phenyl]vinyl}pyridinium diperchlorate and 4-[(E)-2-(2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin-18-yl)vinyl]-1-ethylpyridiniumperchlorate, benzene and water solvate","","- C46.2 H61.6 Cl3 N3 O18.7 S -","- C46.2 H60.2 Cl3 N3 O18.7 S -","- C739.2 H963.2 Cl48 N48 O299.2 S16 -","16","2","","Gromov, Sergey P.; Vedernikov, Artem I.; Sazonov, Sergey K.; Kuz’mina, Lyudmila G.; Lobova, Natalia A.; Strelenko, Yuri A.; Howard, Judith A. K.","Synthesis, structure, and stereospecific cross-[2+2] photocycloaddition of pseudodimeric complexes based on ammonioalkyl derivatives of styryl dyes","New J. Chem.","2016","40","9","7542","","10.1039/C5NJ03500G","","","0.71073","MoKα","","0.3957","0.1843","","","0.4584","0.5145","","","","","","1.18","","","","has coordinates,has disorder","186459","2020-10-21","18:00:00",""
"7055665","10.7742","0.0007","12.9619","0.0009","19.5026","0.0014","74.87","0.003","74.856","0.003","80.051","0.003","2521.9","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","complex between 1-(3-ammoniopropyl)-4-[(E)-2-(4-nitrophenyl)-vinyl]pyridinium diperchlorate and 4-[(E)-2-(2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin-18-yl)vinyl]-1-ethylpyridinium perchlorate, benzene and water solvate","","- C44 H60 Cl3 N4 O22 -","- C44 H56 Cl3 N4 O22 -","- C88 H112 Cl6 N8 O44 -","2","1","","Gromov, Sergey P.; Vedernikov, Artem I.; Sazonov, Sergey K.; Kuz’mina, Lyudmila G.; Lobova, Natalia A.; Strelenko, Yuri A.; Howard, Judith A. K.","Synthesis, structure, and stereospecific cross-[2+2] photocycloaddition of pseudodimeric complexes based on ammonioalkyl derivatives of styryl dyes","New J. Chem.","2016","40","9","7542","","10.1039/C5NJ03500G","","","0.71073","MoKα","","0.1943","0.0715","","","0.1605","0.1942","","","","","","0.873","","","","has coordinates,has disorder","186459","2020-10-21","18:00:00",""
"7055666","14.0228","0.0009","18.0075","0.0011","22.8626","0.0014","90","","90","","90","","5773.2","0.6","120","2","120","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","1-(3-ammoniopropyl)-4-r-[2-c-(2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecin-18-yl)-3-t-(1-ethylpyridinium-4-yl)-4-t-(4-methoxyphenyl)cyclobutyl]pyridinium triperchlorate, benzene and acetonitrile and water solvate","","- C55.5 H70.75 Cl3 N3.75 O19.25 -","- C55.5 H70.25 Cl3 N3.75 O19.25 -","- C222 H281 Cl12 N15 O77 -","4","1","","Gromov, Sergey P.; Vedernikov, Artem I.; Sazonov, Sergey K.; Kuz’mina, Lyudmila G.; Lobova, Natalia A.; Strelenko, Yuri A.; Howard, Judith A. K.","Synthesis, structure, and stereospecific cross-[2+2] photocycloaddition of pseudodimeric complexes based on ammonioalkyl derivatives of styryl dyes","New J. Chem.","2016","40","9","7542","","10.1039/C5NJ03500G","","","0.71073","MoKα","","0.2217","0.0818","","","0.1411","0.173","","","","","","0.898","","","","has coordinates,has disorder","186459","2020-10-21","18:00:00",""
"7055667","14.1703","0.0007","10.6446","0.0005","21.0933","0.001","90","","107.068","0.005","90","","3041.5","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C72 H54 Ag2 F4 P4 S2 -","- C72 H54 Ag2 F4 P4 S2 -","- C144 H108 Ag4 F8 P8 S4 -","2","0.5","","Moreno-Alcántar, Guillermo; Nácar-Anaya, Antonio; Flores-Álamo, Marcos; Torrens, Hugo","Luminescent diphosphine fluorophenylthiolate silver(i) compounds that exhibit argentophilic interactions","New J. Chem.","2016","40","8","6577","","10.1039/C6NJ00984K","","","0.71073","MoKα","","0.0842","0.0403","","","0.064","0.078","","","","","","1.017","","","","has coordinates,has disorder","185614","2020-10-21","18:00:00",""
"7055668","13.8314","0.0008","13.9584","0.0012","18.061","0.0011","73.771","0.006","78.567","0.005","63.638","0.007","2988.7","0.4","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H54 Ag2 F4 P4 S2 -","- C72 H54 Ag2 F4 P4 S2 -","- C144 H108 Ag4 F8 P8 S4 -","2","1","","Moreno-Alcántar, Guillermo; Nácar-Anaya, Antonio; Flores-Álamo, Marcos; Torrens, Hugo","Luminescent diphosphine fluorophenylthiolate silver(i) compounds that exhibit argentophilic interactions","New J. Chem.","2016","40","8","6577","","10.1039/C6NJ00984K","","","0.71073","MoKα","","0.0452","0.0319","","","0.065","0.0723","","","","","","1.052","","","","has coordinates","185614","2020-10-21","18:00:00",""
"7055669","11.7331","0.0004","11.9626","0.0004","21.2821","0.0006","92.527","0.002","92.533","0.002","102.148","0.003","2913.02","0.17","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H50 Ag2 F4 P4 S2 -","- C64 H50 Ag2 F4 P4 S2 -","- C128 H100 Ag4 F8 P8 S4 -","2","1","","Moreno-Alcántar, Guillermo; Nácar-Anaya, Antonio; Flores-Álamo, Marcos; Torrens, Hugo","Luminescent diphosphine fluorophenylthiolate silver(i) compounds that exhibit argentophilic interactions","New J. Chem.","2016","40","8","6577","","10.1039/C6NJ00984K","","","0.71073","MoKα","","0.0643","0.0371","","","0.0696","0.0814","","","","","","1.031","","","","has coordinates","185614","2020-10-21","18:00:00",""
"7055670","11.8531","0.0007","11.9647","0.0007","12.1327","0.0007","64.18","0.005","65.204","0.006","81.877","0.005","1404.27","0.17","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H50 Ag2 F4 P4 S2 -","- C64 H50 Ag2 F4 P4 S2 -","- C64 H50 Ag2 F4 P4 S2 -","1","0.5","","Moreno-Alcántar, Guillermo; Nácar-Anaya, Antonio; Flores-Álamo, Marcos; Torrens, Hugo","Luminescent diphosphine fluorophenylthiolate silver(i) compounds that exhibit argentophilic interactions","New J. Chem.","2016","40","8","6577","","10.1039/C6NJ00984K","","","0.71073","MoKα","","0.0262","0.0226","","","0.0566","0.0587","","","","","","1.096","","","","has coordinates","185614","2020-10-21","18:00:00",""
"7055671","8.779","0.0018","13.826","0.003","17.18","0.003","83.27","0.03","83.26","0.03","88.18","0.03","2056.3","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C19.5 H21 Br2 N3 O0.5 Zn -","- C19.5 H21 Br2 N3 O0.5 Zn -","- C78 H84 Br8 N12 O2 Zn4 -","4","2","","Zhang, Yong-Po; Ma, Zhong-Ying; Gao, Chun-Yan; Qiao, Xin; Tian, Jin-Lei; Gu, Wen; Liu, Xin; Xu, Jing-Yuan; Zhao, Jin-Zhong; Yan, Shi-Ping","Two dpa-based zinc(ii) complexes as potential anticancer agents: nuclease activity, cytotoxicity and apoptosis studies","New J. Chem.","2016","40","9","7513","","10.1039/C6NJ00346J","","","0.71073","MoKα","","0.1318","0.0685","","","0.1283","0.1547","","","","","","0.986","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7055672","8.58","0.0017","13.601","0.003","16.75","0.003","84.1","0.03","84.02","0.03","89.49","0.03","1933.7","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C19.5 H21 Cl2 N3 O0.5 Zn -","- C19.5 H21 Cl2 N3 O0.5 Zn -","- C78 H84 Cl8 N12 O2 Zn4 -","4","2","","Zhang, Yong-Po; Ma, Zhong-Ying; Gao, Chun-Yan; Qiao, Xin; Tian, Jin-Lei; Gu, Wen; Liu, Xin; Xu, Jing-Yuan; Zhao, Jin-Zhong; Yan, Shi-Ping","Two dpa-based zinc(ii) complexes as potential anticancer agents: nuclease activity, cytotoxicity and apoptosis studies","New J. Chem.","2016","40","9","7513","","10.1039/C6NJ00346J","","","0.71073","MoKα","","0.1127","0.0755","","","0.1653","0.1876","","","","","","1.06","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7055673","11.813","0.002","12.191","0.002","13.301","0.003","89.36","0.03","87.62","0.03","78.82","0.03","1877.5","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H19 Cl N3 O1.5 -","- C19 H19 Cl N3 O1.5 -","- C76 H76 Cl4 N12 O6 -","4","2","","Zhang, Yong-Po; Ma, Zhong-Ying; Gao, Chun-Yan; Qiao, Xin; Tian, Jin-Lei; Gu, Wen; Liu, Xin; Xu, Jing-Yuan; Zhao, Jin-Zhong; Yan, Shi-Ping","Two dpa-based zinc(ii) complexes as potential anticancer agents: nuclease activity, cytotoxicity and apoptosis studies","New J. Chem.","2016","40","9","7513","","10.1039/C6NJ00346J","","","0.71073","MoKα","","0.1165","0.0805","","","0.1949","0.2168","","","","","","1.124","","","","has coordinates","194155","2020-10-21","18:00:00",""
"7055674","12.925","0.013","7.971","0.008","9.546","0.01","90","","90","","90","","983.5","1.7","296","2","296","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- F6 H6 N Na3 O5 S Ti -","- F6 H6 N Na3 O5 S Ti -","- F24 H24 N4 Na12 O20 S4 Ti4 -","4","0.5","","Xu, Dongdong; Zhang, Fangfang; Sun, Yanzhou; Yang, Zhihua; Dong, Xiaoyu; Pan, Shilie","Hydrogen bond-assisted crystallization: structure, growth and characterization of a new mixed-anion transition metal fluoride Na3NH4(TiF6)(SO4)·H2O","New J. Chem.","2016","40","9","7407","","10.1039/C6NJ01358A","","","0.71073","MoKα","","0.039","0.0315","","","0.0798","0.0843","","","","","","1.078","","","","has coordinates","186470","2020-10-21","18:00:00",""
"7055675","14.057","0.007","14.017","0.007","16.702","0.009","90","","100.938","0.009","90","","3231","3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[Zn2(oPDA)2]","","- C14 H6 N2 O8 Zn2 -","- C14 H6 N2 O8 Zn2 -","- C112 H48 N16 O64 Zn16 -","8","1","","Huang, Yong-Qing; Wan, Yi; Chen, Huai-Ying; Wang, Yang; Zhao, Yue; Xiao, Xin-Feng","Construction of metal‒organic coordination networks with various metal-linker secondary building units: structures and properties","New J. Chem.","2016","40","9","7587","","10.1039/C6NJ01231K","","","0.71073","MoKα","","0.0777","0.0401","","","0.0924","0.1083","","","","","","1.002","","","","has coordinates","186471","2020-10-21","18:00:00",""
"7055676","12.9099","0.0017","12.9099","0.0017","25.375","0.004","90","","90","","120","","3662.5","0.9","296","2","296","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C42 H18 Ca Cl2 N6 O24 Pb6 -","- C42 H18 Ca Cl2 N6 O24 Pb6 -","- C126 H54 Ca3 Cl6 N18 O72 Pb18 -","3","0.166667","","Huang, Yong-Qing; Wan, Yi; Chen, Huai-Ying; Wang, Yang; Zhao, Yue; Xiao, Xin-Feng","Construction of metal‒organic coordination networks with various metal-linker secondary building units: structures and properties","New J. Chem.","2016","40","9","7587","","10.1039/C6NJ01231K","","","0.71073","MoKα","","0.0521","0.0487","","","0.0971","0.0984","","","","","","1.08","","","","has coordinates","186471","2020-10-21","18:00:00",""
"7055677","15.6115","0.0009","15.6115","0.0009","15.1842","0.0012","90","","90","","120","","3204.9","0.4","296","2","296","2","","","","","","","","6","P 6/m c c","-P 6 2c","192","","[CeMg1.5(oPDA)3(H2O)3]-3.5H2O","","- C21 H22 Ce Mg1.5 N3 O18.5 -","- C21 H18 Ce Mg1.5 N3 O18.5 -","- C84 H72 Ce4 Mg6 N12 O74 -","4","0.166667","","Huang, Yong-Qing; Wan, Yi; Chen, Huai-Ying; Wang, Yang; Zhao, Yue; Xiao, Xin-Feng","Construction of metal‒organic coordination networks with various metal-linker secondary building units: structures and properties","New J. Chem.","2016","40","9","7587","","10.1039/C6NJ01231K","","","0.71073","MoKα","","0.0282","0.025","","","0.0921","0.0947","","","","","","1.243","","","","has coordinates","186471","2020-10-21","18:00:00",""
"7055678","8.2782","0.0002","7.7779","0.0002","23.1597","0.0006","90","","99.957","0.002","90","","1468.72","0.06","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 N2 -","- C17 H18 N2 -","- C68 H72 N8 -","4","1","","Peddarao, Thota; Baishya, Ashim; Barman, Milan Kr.; Kumar, Ajay; Nembenna, Sharanappa","Metal-free access of bulky N,N′-diarylcarbodiimides and their reduction: bulky N,N′-diarylformamidines","New J. Chem.","2016","40","9","7627","","10.1039/C6NJ00907G","","","0.71073","MoKα","","0.0814","0.0534","","","0.1783","0.2029","","","","","","1.199","","","","has coordinates","186473","2020-10-21","18:00:00",""
"7055679","16.202","0.002","7.6187","0.0011","20.676","0.003","90","","90","","90","","2552.2","0.6","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","1,3-dibromo-2-phenyl-1H-indene","","- C15 H10 Br2 -","- C15 H10 Br2 -","- C120 H80 Br16 -","8","1","","Singha, Raju; Ghosh, Munmun; Das, Saikat; Das, Dhiraj; Ray, Jayanta K.","Synthesis of 1,3-dibromo-2-aryl-1H-indenes via NBS mediated unusual bromination of 2-alkynylbenzaldoximes","New J. Chem.","2016","40","9","7269","","10.1039/C6NJ01201A","","","0.71073","MoKα","","0.0543","0.0292","","","0.0623","0.0733","","","","","","1.001","","","","has coordinates","186457","2020-10-21","18:00:00",""
"7055680","11.2417","0.0007","18.3142","0.0011","22.6389","0.0013","90","","101.822","0.006","90","","4562.1","0.5","120","2","120","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","1- Ni-tpmc_binuclear complex","[Ni2(tpmc)(?-NO3)](NO3)3 (H2O)2","","- C34 H54 Li N13 Ni2 O20 -","- C34 H54 Li N13 Ni2 O20 -","- C136 H216 Li4 N52 Ni8 O80 -","4","1","","Ruiz-Herrera, Brenda Lizette; Flores-Álamo, Marcos; Toscano, Rubén Alfredo; Escudero, Roberto; Sosa-Torres, Martha Elena","Adsorption of water induces a reversible structural phase transition and colour change in new nickel(ii) macrocyclic complexes forming flexible supramolecular networks","New J. Chem.","2016","40","9","7465","","10.1039/C6NJ01621A","","","0.71073","MoKα","","0.0825","0.0586","","","0.147","0.1661","","","","","","1.04","","","","has coordinates","186466","2020-10-21","18:00:00",""
"7055681","11.2964","0.0008","18.8819","0.0014","20.7624","0.0013","87.453","0.005","89.238","0.004","83.96","0.005","4399.5","0.5","298","2","298","2","","","","","","","","6","P 1","P 1","1","2- Ni-tpmc-binuclear complex","[Ni2(tpmc)(?-NO3)](NO3)3 (H2O)2.3H2O","","- C68 H108 Li2 N24 Ni4 O35.5 -","- C68 H108 Li2 N24 Ni4 O35.5 -","- C136 H216 Li4 N48 Ni8 O71 -","2","2","","Ruiz-Herrera, Brenda Lizette; Flores-Álamo, Marcos; Toscano, Rubén Alfredo; Escudero, Roberto; Sosa-Torres, Martha Elena","Adsorption of water induces a reversible structural phase transition and colour change in new nickel(ii) macrocyclic complexes forming flexible supramolecular networks","New J. Chem.","2016","40","9","7465","","10.1039/C6NJ01621A","","","0.71073","MoKα","","0.0846","0.0626","","","0.1556","0.1705","","","","","","1.017","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7055682","6.4175","0.0007","9.9444","0.0011","21.244","0.002","90","","91.437","0.002","90","","1355.3","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 Co N10 O16 -","- C18 H16 Co N10 O16 -","- C36 H32 Co2 N20 O32 -","2","0.5","","Yang, Qi; Ge, Jing; Gong, Qibing; Song, Xiaxia; Zhao, Jinwen; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli","Two energetic complexes incorporating 3,5-dinitrobenzoic acid and azole ligands: microwave-assisted synthesis, favorable detonation properties, insensitivity and effects on the thermal decomposition of RDX","New J. Chem.","2016","40","9","7779","","10.1039/C6NJ00197A","","","0.71073","MoKα","","0.0507","0.0386","","","0.0934","0.0997","","","","","","1.011","","","","has coordinates","186451","2020-10-21","18:00:00",""
"7055683","7.9317","0.001","8.7062","0.001","11.2388","0.0015","100.563","0.002","107.502","0.002","104.506","0.002","687.88","0.15","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H6 Cu N6 O8 -","- C10 H6 Cu N6 O8 -","- C20 H12 Cu2 N12 O16 -","2","1","","Yang, Qi; Ge, Jing; Gong, Qibing; Song, Xiaxia; Zhao, Jinwen; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Shengli","Two energetic complexes incorporating 3,5-dinitrobenzoic acid and azole ligands: microwave-assisted synthesis, favorable detonation properties, insensitivity and effects on the thermal decomposition of RDX","New J. Chem.","2016","40","9","7779","","10.1039/C6NJ00197A","","","0.71073","MoKα","","0.0699","0.0516","","","0.1046","0.1134","","","","","","1.001","","","","has coordinates","186451","2020-10-21","18:00:00",""
"7055684","11.6738","0.0005","13.8873","0.001","16.3146","0.0013","112.477","0.005","101.227","0.005","103.666","0.005","2251.9","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H42 Mo3 N O9 P3 S10 -","- C25 H42 Mo3 N O9 P3 S10 -","- C50 H84 Mo6 N2 O18 P6 S20 -","2","1","","Gushchin, Artem L.; Hernandez-Molina, Rita; Anyushin, Alexander V.; Gallyamov, Marsel R.; Gonzalez-Platas, Javier; Moroz, Nikolay K.; Sokolov, Maxim N.","Synthesis, structure and NMR studies of trinuclear Mo3S4clusters coordinated with dithiophosphate and chiral carboxylate ligands","New J. Chem.","2016","40","9","7612","","10.1039/C6NJ01303A","","","0.71073","MoKα","","0.0743","0.049","","","0.0903","0.0968","","","","","","1.183","","","","has coordinates,has disorder","186455","2020-10-21","18:00:00",""
"7055685","12.615","0.00014","15.8462","0.0002","22.5039","0.0003","90","","90","","90","","4498.53","0.1","100","1","100","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C26 H44 Mo3 N O9 P3 S10 -","- C26 H44 Mo3 N O9 P3 S10 -","- C104 H176 Mo12 N4 O36 P12 S40 -","4","1","","Gushchin, Artem L.; Hernandez-Molina, Rita; Anyushin, Alexander V.; Gallyamov, Marsel R.; Gonzalez-Platas, Javier; Moroz, Nikolay K.; Sokolov, Maxim N.","Synthesis, structure and NMR studies of trinuclear Mo3S4clusters coordinated with dithiophosphate and chiral carboxylate ligands","New J. Chem.","2016","40","9","7612","","10.1039/C6NJ01303A","","x-ray","1.54184","CuKα","","0.0298","0.0273","","","0.0651","0.0667","","","","","","1.023","","","","has coordinates","186455","2020-10-21","18:00:00",""
"7055686","10.6089","0.0008","11.667","0.0008","13.3789","0.001","77.684","0.005","78.335","0.005","76.227","0.005","1551.2","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H38 N2 O2 -","- C36 H38 N2 O2 -","- C72 H76 N4 O4 -","2","1","","Khan, Md. Musawwer; Khan, Sarfaraz; Iqbal, Safia; Saigal, Saigal; Yousuf, Raveed","Synthesis of functionalized dihydro-2-oxypyrroles and tetrahydropyridines using 2,6-pyridinedicarboxylic acid as an efficient and mild organocatalyst","New J. Chem.","2016","40","9","7504","","10.1039/C6NJ01170E","","","0.71073","MoKα","","0.1108","0.052","","","0.1262","0.1512","","","","","","1.006","","","","has coordinates","186462","2020-10-21","18:00:00",""
"7055687","8.6748","0.0007","12.1683","0.0011","12.928","0.0012","116.966","0.003","101.242","0.002","90.567","0.001","1185.37","0.18","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H22 N2 O4 Sn -","- C27 H22 N2 O4 Sn -","- C54 H44 N4 O8 Sn2 -","2","1","","Hong, Min; Chang, Guoliang; Li, Rui; Niu, Meiju","Anti-proliferative activity and DNA/BSA interactions of five mono- or di-organotin(iv) compounds derived from 2-hydroxy-N′-[(2-hydroxy-3-methoxyphenyl)methylidene]-benzohydrazone","New J. Chem.","2016","40","9","7889","","10.1039/C6NJ00525J","","","0.71073","MoKα","","0.0451","0.0348","","","0.0815","0.087","","","","","","0.963","","","","has coordinates","186467","2020-10-21","18:00:00",""
"7055688","10.878","0.0008","10.9209","0.0009","13.8141","0.0011","97.532","0.001","95.081","0.001","100.369","0.002","1589.7","0.2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H46 N2 O4 Sn -","- C31 H46 N2 O4 Sn -","- C62 H92 N4 O8 Sn2 -","2","1","","Hong, Min; Chang, Guoliang; Li, Rui; Niu, Meiju","Anti-proliferative activity and DNA/BSA interactions of five mono- or di-organotin(iv) compounds derived from 2-hydroxy-N′-[(2-hydroxy-3-methoxyphenyl)methylidene]-benzohydrazone","New J. Chem.","2016","40","9","7889","","10.1039/C6NJ00525J","","","0.71073","MoKα","","0.069","0.0507","","","0.125","0.1351","","","","","","0.982","","","","has coordinates,has disorder","186467","2020-10-21","18:00:00",""
"7055689","9.8785","0.0008","10.6535","0.0009","10.9811","0.0009","101.831","0.002","92.732","0.001","91.731","0.001","1128.88","0.16","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H30 N2 O4 Sn -","- C23 H30 N2 O4 Sn -","- C46 H60 N4 O8 Sn2 -","2","1","","Hong, Min; Chang, Guoliang; Li, Rui; Niu, Meiju","Anti-proliferative activity and DNA/BSA interactions of five mono- or di-organotin(iv) compounds derived from 2-hydroxy-N′-[(2-hydroxy-3-methoxyphenyl)methylidene]-benzohydrazone","New J. Chem.","2016","40","9","7889","","10.1039/C6NJ00525J","","","0.71073","MoKα","","0.041","0.0344","","","0.0912","0.0964","","","","","","1.046","","","","has coordinates","186467","2020-10-21","18:00:00",""
"7055690","24.8432","0.0019","10.1733","0.0009","13.1461","0.0011","90","","90","","90","","3322.5","0.5","298","2","298","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C34 H36 N4 O8 Sn2 -","- C34 H36 N4 O8 Sn2 -","- C136 H144 N16 O32 Sn8 -","4","0.5","","Hong, Min; Chang, Guoliang; Li, Rui; Niu, Meiju","Anti-proliferative activity and DNA/BSA interactions of five mono- or di-organotin(iv) compounds derived from 2-hydroxy-N′-[(2-hydroxy-3-methoxyphenyl)methylidene]-benzohydrazone","New J. Chem.","2016","40","9","7889","","10.1039/C6NJ00525J","","","0.71073","MoKα","","0.0712","0.0362","","","0.0746","0.0896","","","","","","1.038","","","","has coordinates","186467","2020-10-21","18:00:00",""
"7055691","8.6712","0.0009","11.7022","0.0011","12.4241","0.0013","106.805","0.002","94.688","0.001","109.026","0.002","1119.2","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H52 Cl2 N4 O11 Sn2 -","- C40 H52 Cl2 N4 O11 Sn2 -","- C40 H52 Cl2 N4 O11 Sn2 -","1","0.5","","Hong, Min; Chang, Guoliang; Li, Rui; Niu, Meiju","Anti-proliferative activity and DNA/BSA interactions of five mono- or di-organotin(iv) compounds derived from 2-hydroxy-N′-[(2-hydroxy-3-methoxyphenyl)methylidene]-benzohydrazone","New J. Chem.","2016","40","9","7889","","10.1039/C6NJ00525J","","","0.71073","MoKα","","0.0518","0.0459","","","0.12","0.1248","","","","","","1.018","","","","has coordinates","186467","2020-10-21","18:00:00",""
"7055692","8.567","0.0004","14.0926","0.0007","25.1175","0.0009","88.524","0.003","81.396","0.003","87.366","0.004","2994.6","0.2","180","0.1","180","0.1","","","","","","","","6","P -1","-P 1","2","[minSstearyl][NTf2]","2-(hexadecylthio)-1-methyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide","","- C22 H39 F6 N3 O4 S3 -","- C22 H39 F6 N3 O4 S3 -","- C88 H156 F24 N12 O16 S12 -","4","2","","O'Brien, Richard A.; Zayas, Manuel Sanchez; Nestor, Stephen T.; Gaitor, Jamie C.; Paul, Lauran M.; Edhegard, Forrest A.; Minkowicz, Samuel; Sykora, Richard E.; Sheng, Yinghong; Michael, Scott F.; Isern, Sharon; Mirjafari, Arsalan","Biomimetic design of protic lipidic ionic liquids with enhanced fluidity","New J. Chem.","2016","40","9","7795","","10.1039/C6NJ00657D","","","0.71073","MoKα","","0.0979","0.0524","","","0.1035","0.1237","","","","","","1.029","","","","has coordinates","186453","2020-10-21","18:00:00",""
"7055693","17.7839","0.0006","7.6076","0.0003","17.9304","0.0012","90","","90","","90","","2425.9","0.2","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H10 Cl2 Se -","- C12 H10 Cl2 Se -","- C96 H80 Cl16 Se8 -","8","1","","Zeng, Xianghua; Gong, Chunhua; Zhang, Junyong; Xie, Jingli","Organoselenium-catalyzed vicinal dichlorination of unsaturated phosphonates","New J. Chem.","2016","40","9","7866","","10.1039/C6NJ00658B","","","1.54184","CuKα","","0.0564","0.0526","","","0.1395","0.1452","","","","","","1.072","","","","has coordinates","186454","2020-10-21","18:00:00",""
"7055694","5.65192","0.00016","18.5698","0.0006","19.0554","0.0005","90","","95.338","0.003","90","","1991.29","0.1","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 Cl2 O P -","- C20 H17 Cl2 O P -","- C80 H68 Cl8 O4 P4 -","4","1","","Zeng, Xianghua; Gong, Chunhua; Zhang, Junyong; Xie, Jingli","Organoselenium-catalyzed vicinal dichlorination of unsaturated phosphonates","New J. Chem.","2016","40","9","7866","","10.1039/C6NJ00658B","","","1.54184","CuKα","","0.0751","0.0673","","","0.2532","0.2604","","","","","","1.026","","","","has coordinates","186454","2020-10-21","18:00:00",""
"7055695","24.7459","0.0002","24.7459","0.0002","24.7459","0.0002","90","","90","","90","","15153.4","0.2","200","0.14","200","0.14","","","","","","","","7","P a -3","-P 2ac 2ab 3","205","","","","- C54 H72 Cl4 Mo3 N6 O3 S4 -","- C54 H72 Cl4 Mo3 N6 O3 S4 -","- C432 H576 Cl32 Mo24 N48 O24 S32 -","8","0.333333","","Pino-Chamorro, Jose A.; Laricheva, Yuliya A.; Guillamón, Eva; Fernández-Trujillo, M. Jesús; Bustelo, Emilio; Gushchin, Artem L.; Shmelev, Nikita Y.; Abramov, Pavel A.; Sokolov, Maxim N.; Llusar, Rosa; Basallote, Manuel G.; Algarra, Andrés G.","Cycloaddition of alkynes to diimino Mo3S4cubane-type clusters: a combined experimental and theoretical approach","New J. Chem.","2016","40","9","7872","","10.1039/C6NJ01787H","","","1.5418","CuKα","","0.1003","0.0625","","","0.1487","0.1741","","","","","","1.016","","","","has coordinates","186465","2020-10-21","18:00:00",""
"7055696","16.0589","0.0003","15.5077","0.0003","18.1719","0.0007","90","","95.27","0.002","90","","4506.3","0.2","130","1","130","1","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C46 H36 Ag2 F6 N8 O6 S2 -","- C46 H36 Ag2 F6 N8 O6 S2 -","- C184 H144 Ag8 F24 N32 O24 S8 -","4","0.5","","Adamski, Ariel; Fik, Marta A.; Kubicki, Maciej; Hnatejko, Zbigniew; Gurda, Dorota; Fedoruk-Wyszomirska, Agnieszka; Wyszko, Eliza; Kruszka, Dariusz; Dutkiewicz, Zbigniew; Patroniak, Violetta","Full characterization and cytotoxic activity of new silver(i) and copper(i) helicates with quaterpyridine","New J. Chem.","2016","40","9","7943","","10.1039/C5NJ03601A","","","1.54184","CuKα","","0.0543","0.0531","","","0.1469","0.1481","","","","","","1.277","","","","has coordinates,has disorder","186468","2020-10-21","18:00:00",""
"7055697","12.5733","0.0004","23.2638","0.0006","16.2128","0.0005","90","","96.624","0.003","90","","4710.6","0.2","100","1","100","1","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C44 H36 Ag2 F12 N8 P2 -","- C44 H36 Ag2 F12 N8 P2 -","- C176 H144 Ag8 F48 N32 P8 -","4","0.5","","Adamski, Ariel; Fik, Marta A.; Kubicki, Maciej; Hnatejko, Zbigniew; Gurda, Dorota; Fedoruk-Wyszomirska, Agnieszka; Wyszko, Eliza; Kruszka, Dariusz; Dutkiewicz, Zbigniew; Patroniak, Violetta","Full characterization and cytotoxic activity of new silver(i) and copper(i) helicates with quaterpyridine","New J. Chem.","2016","40","9","7943","","10.1039/C5NJ03601A","","x-ray","0.71073","MoKα","","0.0372","0.0319","","","0.0895","0.0927","","","","","","1.095","","","","has coordinates,has disorder","186468","2020-10-21","18:00:00",""
"7055698","23.7716","0.0018","13.2745","0.0008","31.455","0.003","90","","117.247","0.011","90","","8824.5","1.5","100","1","100","1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H36 Cu2 F6 N8 O6 S2 -","- C46 H36 Cu2 F6 N8 O6 S2 -","- C368 H288 Cu16 F48 N64 O48 S16 -","8","1","","Adamski, Ariel; Fik, Marta A.; Kubicki, Maciej; Hnatejko, Zbigniew; Gurda, Dorota; Fedoruk-Wyszomirska, Agnieszka; Wyszko, Eliza; Kruszka, Dariusz; Dutkiewicz, Zbigniew; Patroniak, Violetta","Full characterization and cytotoxic activity of new silver(i) and copper(i) helicates with quaterpyridine","New J. Chem.","2016","40","9","7943","","10.1039/C5NJ03601A","","x-ray","0.71073","MoKα","","0.0865","0.0516","","","0.1039","0.1171","","","","","","0.985","","","","has coordinates,has disorder","186468","2020-10-21","18:00:00",""
"7055699","14.1499","0.001","16.6539","0.001","22.4487","0.0013","90","","90","","90","","5290.1","0.6","100","1","100","1","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C59 H56 B2 Cu2 F8 N8 O -","- C59 H56 B2 Cu2 F8 N8 O -","- C236 H224 B8 Cu8 F32 N32 O4 -","4","0.5","","Adamski, Ariel; Fik, Marta A.; Kubicki, Maciej; Hnatejko, Zbigniew; Gurda, Dorota; Fedoruk-Wyszomirska, Agnieszka; Wyszko, Eliza; Kruszka, Dariusz; Dutkiewicz, Zbigniew; Patroniak, Violetta","Full characterization and cytotoxic activity of new silver(i) and copper(i) helicates with quaterpyridine","New J. Chem.","2016","40","9","7943","","10.1039/C5NJ03601A","","x-ray","0.71073","MoKα","","0.0755","0.0535","","","0.1569","0.1722","","","","","","1.271","","","","has coordinates,has disorder","186468","2020-10-21","18:00:00",""
"7055700","21.5008","0.001","12.8677","0.0006","16.1684","0.0007","90","","91.2161","0.0019","90","","4472.2","0.4","180","","180","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H51 N3 O9 S -","- C50 H51 N3 O9 S -","- C200 H204 N12 O36 S4 -","4","1","","Klejch, Tomáš; Slavíček, Jan; Hudeček, Oldřich; Eigner, Václav; Gutierrez, Natalia Andrea; Cuřínová, Petra; Lhoták, Pavel","Calix[4]arenes containing a ureido functionality on the lower rim as highly efficient receptors for anion recognition","New J. Chem.","2016","40","9","7935","","10.1039/C6NJ01271J","","","1.5418","CuKα","","0.0946","0.0854","","0.1934","0.1863","0.1934","","","","","","0.8115","","","","has coordinates,has disorder","186474","2020-10-21","18:00:00",""
"7055701","9.1533","0.0018","23.791","0.005","18.215","0.004","90","","97.18","0.03","90","","3935.5","1.4","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C41 H49 Cl2 Co N3 -","- C40.994 H49 Cl2 Co N3 -","- C163.976 H196 Cl8 Co4 N12 -","4","1","","Huang, Fang; Zhang, Wenjuan; Sun, Yang; Hu, Xinquan; Solan, Gregory A.; Sun, Wen-Hua","Thermally stable and highly active cobalt precatalysts for vinyl-polyethylenes with narrow polydispersities: integrating fused-ring and imino-carbon protection into ligand design","New J. Chem.","2016","40","9","8012","","10.1039/C6NJ01867J","","","0.71073","MoKα","","","0.0555","","","0.1271","0.1362","","","","","","1.096","","","","has coordinates,has disorder","186469","2020-10-21","18:00:00",""
"7055702","16.066","0.002","19.561","0.002","15.994","0.002","90","","99.274","0.002","90","","4960.7","1","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","03115","","","- C36 H80 Ca I2 N8 O4 -","- C36 H80 Ca I2 N8 O4 -","- C144 H320 Ca4 I8 N32 O16 -","4","0.5","","Fitts, Lacey S.; Bierschenk, Eric J.; Hanusa, Timothy P.; Rheingold, Arnold L.; Pink, Maren; Young, Victor G.","Selective modification of the metal coordination environment in heavy alkaline‒earth iodide complexes","New J. Chem.","2016","40","10","8229","","10.1039/C6NJ01713D","","","0.71073","MoKα","","0.0331","0.0254","","","0.0629","0.0681","","","","","","1.017","","","","has coordinates,has disorder","187172","2020-10-21","18:00:00",""
"7055703","14.34","0.002","15.857","0.002","14.444","0.002","90","","105.616","0.003","90","","3163.2","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","02250a","","","- C24 H38 Ca I2 N2 O7 -","- C24 H38 Ca I2 N2 O7 -","- C96 H152 Ca4 I8 N8 O28 -","4","0.5","","Fitts, Lacey S.; Bierschenk, Eric J.; Hanusa, Timothy P.; Rheingold, Arnold L.; Pink, Maren; Young, Victor G.","Selective modification of the metal coordination environment in heavy alkaline‒earth iodide complexes","New J. Chem.","2016","40","10","8229","","10.1039/C6NJ01713D","","","0.71073","MoKα","","0.0522","0.0355","","","0.0861","0.0936","","","","","","1.101","","","","has coordinates","187172","2020-10-21","18:00:00",""
"7055704","13.0031","0.0008","17.628","0.001","28.16","0.002","90","","90","","90","","6454.8","0.7","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","99290","","","- C45 H105 Ca I2 O5 P5 -","- C45 H105 Ca I2 O5 P5 -","- C180 H420 Ca4 I8 O20 P20 -","4","1","","Fitts, Lacey S.; Bierschenk, Eric J.; Hanusa, Timothy P.; Rheingold, Arnold L.; Pink, Maren; Young, Victor G.","Selective modification of the metal coordination environment in heavy alkaline‒earth iodide complexes","New J. Chem.","2016","40","10","8229","","10.1039/C6NJ01713D","","","0.71073","MoKα","","0.0823","0.0447","","","0.101","0.1148","","","","","","0.925","","","","has coordinates","187172","2020-10-21","18:00:00",""
"7055705","12.1294","0.0003","14.6056","0.0003","22.7585","0.0005","90","","102.536","0.001","90","","3935.71","0.15","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C90 H75 Ba I2 O5 P5 -","- C90 H75 Ba I2 O5 P5 -","- C180 H150 Ba2 I4 O10 P10 -","2","1","","Fitts, Lacey S.; Bierschenk, Eric J.; Hanusa, Timothy P.; Rheingold, Arnold L.; Pink, Maren; Young, Victor G.","Selective modification of the metal coordination environment in heavy alkaline‒earth iodide complexes","New J. Chem.","2016","40","10","8229","","10.1039/C6NJ01713D","","","0.71073","MoKα","","0.0248","0.0229","","","0.0444","0.0451","","","","","","0.991","","","","has coordinates","187172","2020-10-21","18:00:00",""
"7055706","9.18","0.0006","9.4741","0.0006","14.4358","0.001","90.556","0.006","107.977","0.005","97.243","0.005","1183.12","0.14","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","1,2-Di(1-naphthyl)-1,2-ethanediaminogold(III)chloride.dihydrate","","- C22 H24 Au Cl3 N2 O2 -","- C22 H24 Au Cl3 N2 O2 -","- C44 H48 Au2 Cl6 N4 O4 -","2","1","","Altaf, Muhammad; Ahmad, Saeed; Kawde, Abdel-Nasser; Baig, Nadeem; Alawad, Abdullah; Altuwaijri, Saleh; Stoeckli-Evans, Helen; Isab, Anvarhusein A.","Synthesis, structural characterization, electrochemical behavior and anticancer activity of gold(iii) complexes of meso-1,2-di(1-naphthyl)-1,2-diaminoethane and tetraphenylporphyrin","New J. Chem.","2016","40","10","8288","","10.1039/C6NJ00692B","","","0.71073","MoKα","","0.0483","0.039","","","0.0885","0.091","","","","","","0.99","","","","has coordinates","187169","2020-10-21","18:00:00",""
"7055707","25.2276","0.0015","9.4361","0.0006","13.6952","0.0008","90","","94.658","0.001","90","","3249.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H36 N6 O19 Zn2 -","- C22 H36 N6 O19 Zn2 -","- C88 H144 N24 O76 Zn8 -","4","0.5","","Shang, Di; Ni, Jue chen; Gao, Xin Yu; Li, Cheng Ren; Lin, Xiao Meng; Wang, Zhi Nan; Du, Ning; Li, Shuang; Xing, Yong Heng","The various structures of complexes fabricated with transition metal and triazole ligands and inhibiting effect on luminescent xanthine","New J. Chem.","2016","","","","","10.1039/C6NJ01503D","","","0.71073","MoKα","","0.0564","0.0353","","","0.0831","0.0915","","","","","","1.019","","","","has coordinates","184813","2020-10-21","18:00:00",""
"7055708","7.788","0.0005","8.7135","0.0006","24.6516","0.0018","90","","90","","90","","1672.9","0.2","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H19 Cd N3 O10 -","- C11 H19 Cd N3 O10 -","- C44 H76 Cd4 N12 O40 -","4","1","","Shang, Di; Ni, Jue chen; Gao, Xin Yu; Li, Cheng Ren; Lin, Xiao Meng; Wang, Zhi Nan; Du, Ning; Li, Shuang; Xing, Yong Heng","The various structures of complexes fabricated with transition metal and triazole ligands and inhibiting effect on luminescent xanthine","New J. Chem.","2016","","","","","10.1039/C6NJ01503D","","","0.71073","MoKα","","0.0473","0.0333","","","0.0588","0.0627","","","","","","1.044","","","","has coordinates","184813","2020-10-21","18:00:00",""
"7055709","25.74","0.02","9.689","0.009","13.887","0.013","90","","95.083","0.015","90","","3450","5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H36 Co2 N6 O19 -","- C22 H36 Co2 N6 O19 -","- C88 H144 Co8 N24 O76 -","4","0.5","","Shang, Di; Ni, Jue chen; Gao, Xin Yu; Li, Cheng Ren; Lin, Xiao Meng; Wang, Zhi Nan; Du, Ning; Li, Shuang; Xing, Yong Heng","The various structures of complexes fabricated with transition metal and triazole ligands and inhibiting effect on luminescent xanthine","New J. Chem.","2016","","","","","10.1039/C6NJ01503D","","","0.71073","MoKα","","0.0454","0.0304","","","0.0677","0.0732","","","","","","1.028","","","","has coordinates,has disorder","184813","2020-10-21","18:00:00",""
"7055710","25.1466","0.0017","9.4725","0.0006","13.6233","0.0009","90","","94.532","0.001","90","","3234.9","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H36 N6 Ni2 O19 -","- C22 H36 N6 Ni2 O19 -","- C88 H144 N24 Ni8 O76 -","4","0.5","","Shang, Di; Ni, Jue chen; Gao, Xin Yu; Li, Cheng Ren; Lin, Xiao Meng; Wang, Zhi Nan; Du, Ning; Li, Shuang; Xing, Yong Heng","The various structures of complexes fabricated with transition metal and triazole ligands and inhibiting effect on luminescent xanthine","New J. Chem.","2016","","","","","10.1039/C6NJ01503D","","","0.71073","MoKα","","0.0337","0.0263","","","0.0648","0.0684","","","","","","1.031","","","","has coordinates,has disorder","184813","2020-10-21","18:00:00",""
"7055711","6.539","0.004","8.752","0.005","12.35","0.007","97.275","0.009","101.14","0.009","110.523","0.009","634.8","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 Cu3 N6 O12 -","- C22 H20 Cu3 N6 O12 -","- C22 H20 Cu3 N6 O12 -","1","0.5","","Shang, Di; Ni, Jue chen; Gao, Xin Yu; Li, Cheng Ren; Lin, Xiao Meng; Wang, Zhi Nan; Du, Ning; Li, Shuang; Xing, Yong Heng","The various structures of complexes fabricated with transition metal and triazole ligands and inhibiting effect on luminescent xanthine","New J. Chem.","2016","","","","","10.1039/C6NJ01503D","","","0.71073","MoKα","","0.0394","0.0285","","","0.0617","0.0643","","","","","","1.039","","","","has coordinates","184813","2020-10-21","18:00:00",""
"7055712","16.7455","0.0006","13.1161","0.0004","16.7312","0.0006","90","","110.758","0.002","90","","3436.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Hexa(2,4-nonanedionate)(2,2'-bipyrimidine)di-erbium(III)","","- C31 H48 Er N2 O6 -","- C31 H48 Er N2 O6 -","- C124 H192 Er4 N8 O24 -","4","1","","Martín-Ramos, P.; Pereira, L. C. J.; Coutinho, J. T.; Koprowiak, F.; Bolvin, H.; Lavín, V.; Martín, I. R.; Martín-Gil, J.; Silva, M. Ramos","Structure, luminescence and magnetic properties of an erbium(iii) β-diketonate homodinuclear complex","New J. Chem.","2016","40","10","8251","","10.1039/C6NJ01598K","","","0.71073","MoKα","","0.1204","0.054","","","0.1085","0.146","","","","","","1.107","","","","has coordinates,has disorder","187170","2020-10-21","18:00:00",""
"7055713","3.9725","0.0005","7.5945","0.0008","11.1824","0.0014","91.402","0.007","91.093","0.007","90.206","0.007","337.2","0.07","293","","293","","","","","","","","","4","P -1","-P 1","2","Gd3S3BO3","","","- B Gd3 O3 S3 -","- B Gd3 O3 S3 -","- B2 Gd6 O6 S6 -","2","1","","Chi, Yang; Guo, Sheng-Ping; Kong, Hong-Jian; Xue, Huai-Guo","Crystal and electronic structures, and optical and magnetic properties of novel rare-earth sulfide borates RE3S3BO3(RE = Sm, Gd)","New J. Chem.","2016","40","8","6720","","10.1039/C6NJ00549G","","","0.71073","MoKα","","0.0523","0.0379","","","0.084","0.0897","","","","","","1.04","","","","has coordinates","185075","2020-10-21","18:00:00",""
"7055714","15.389","0.001","11.081","0.001","18.832","0.001","90","","105.234","0.001","90","","3098.5","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Compound 1","","","- C34 H46 P2 Sm -","- C34 H46 P2 Sm -","- C136 H184 P8 Sm4 -","4","1","","Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory","Electron transfer in tetramethylbiphosphinine complexes of Cp*2Yb and Cp*2Sm","New J. Chem.","2016","40","8","6643","","10.1039/C6NJ00527F","","","0.71069","MoKα","","0.0904","0.0618","","","0.1152","0.1297","","","","","","1.058","","","","has coordinates","185076","2020-10-21","18:00:00",""
"7055715","9.821","0.001","10.697","0.001","15.776","0.001","77.407","0.001","74.304","0.001","75.918","0.001","1526.9","0.2","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","Compound 2","","","- C34 H46 P2 Yb -","- C34 H46 P2 Yb -","- C68 H92 P4 Yb2 -","2","1","","Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory","Electron transfer in tetramethylbiphosphinine complexes of Cp*2Yb and Cp*2Sm","New J. Chem.","2016","40","8","6643","","10.1039/C6NJ00527F","","","0.71069","MoKα","","0.059","0.049","","","0.1101","0.1175","","","","","","1.084","","","","has coordinates","185076","2020-10-21","18:00:00",""
"7055716","9.505","0.003","5.3533","0.0016","19.925","0.006","90","","93.847","0.009","90","","1011.6","0.5","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 N4 Pt S6 -","- C14 H20 N4 Pt S6 -","- C28 H40 N8 Pt2 S12 -","2","0.5","","Deiana, Carlo; Carla Aragoni, M.; Isaia, Francesco; Lippolis, Vito; Pintus, Anna; Slawin, Alexandra M. Z.; Derek Woollins, J.; Arca, Massimiliano","Structural tailoring of the NIR-absorption of bis(1,2-dichalcogenolene) Ni/Pt electrochromophores deriving from 1,3-dimethyl-2-chalcogenoxo-imidazoline-4,5-dichalcogenolates","New J. Chem.","2016","40","10","8206","","10.1039/C6NJ01854H","","","0.71073","MoKα","","0.0366","0.0308","","","0.059","0.0625","","","","","","1.062","","","","has coordinates","187160","2020-10-21","18:00:00",""
"7055717","15.22","0.03","27.66","0.05","14.27","0.03","90","","90","","90","","6007","2","293","2","293","2","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C40 H60 B2 Fe2 Mn N18 O6 -","- C40 H50 B2 Fe2 Mn N18 O2 -","- C160 H200 B8 Fe8 Mn4 N72 O8 -","4","0.25","","Dong, Dapeng; Zhang, Yanjuan; Jiao, Chengqi; Zhao, Liang; Liu, Tao; Liu, Dedi; Li, Zhenghua; Liu, Jia; Liu, Dongping","Syntheses, structures, and magnetic properties of three new cyano-bridged heterobimetallic chains based on [Fe(Tp*)(CN)3]−","New J. Chem.","2016","40","10","8451","","10.1039/C6NJ01015F","","","0.71073","MoKα","","0.1238","0.0629","","","0.1644","0.1855","","","","","","1.004","","","","has coordinates","187162","2020-10-21","18:00:00",""
"7055718","15.022","0.009","26.818","0.017","13.992","0.009","90","","90","","90","","5637","6","273","2","273","2","","","","","","","","7","I b a m","-I 2 2c","72","","","","- C40 H60 B2 Co Fe2 N18 O6 -","- C40 H48 B2 Co Fe2 N18 O2 -","- C160 H192 B8 Co4 Fe8 N72 O8 -","4","0.25","","Dong, Dapeng; Zhang, Yanjuan; Jiao, Chengqi; Zhao, Liang; Liu, Tao; Liu, Dedi; Li, Zhenghua; Liu, Jia; Liu, Dongping","Syntheses, structures, and magnetic properties of three new cyano-bridged heterobimetallic chains based on [Fe(Tp*)(CN)3]−","New J. Chem.","2016","40","10","8451","","10.1039/C6NJ01015F","","","0.71073","MoKα","","0.0875","0.0582","","","0.1642","0.1757","","","","","","1.041","","","","has coordinates","187162","2020-10-21","18:00:00",""
"7055719","14.97","0.02","27.32","0.04","14.14","0.02","90","","90","","90","","5783","14","273","2","273","2","","","","","","","","6","I b a m","-I 2 2c","72","","","","- C40 H60 B2 Fe3 N18 O6 -","- C40 H50 B2 Fe3 N18 O2 -","- C160 H200 B8 Fe12 N72 O8 -","4","0.25","","Dong, Dapeng; Zhang, Yanjuan; Jiao, Chengqi; Zhao, Liang; Liu, Tao; Liu, Dedi; Li, Zhenghua; Liu, Jia; Liu, Dongping","Syntheses, structures, and magnetic properties of three new cyano-bridged heterobimetallic chains based on [Fe(Tp*)(CN)3]−","New J. Chem.","2016","40","10","8451","","10.1039/C6NJ01015F","","","0.71073","MoKα","","0.104","0.0579","","","0.1421","0.1618","","","","","","1.039","","","","has coordinates","187162","2020-10-21","18:00:00",""
"7055720","14.4151","0.0008","7.5086","0.0004","31.8698","0.0018","90","","99.194","0.002","90","","3405.2","0.3","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(E)-3-(3-bromo-4-(dimethylamino)phenyl)-1-(3-chloro-4-methoxyphenyl)prop-2-en-1-one","(E)-3-(3-bromo-4-(dimethylamino)phenyl)-1-(3-chloro-4-methoxyphenyl)prop-2-en-1-one","","- C18 H17 Br Cl N O2 -","- C18 H17 Br Cl N O2 -","- C144 H136 Br8 Cl8 N8 O16 -","8","2","","Vaz, Patricia A. A. M.; Rocha, João; Silva, Artur M. S.; Guieu, Samuel","Aggregation-induced emission enhancement in halochalcones","New J. Chem.","2016","40","10","8198","","10.1039/C6NJ01387B","","","0.71073","MoKα","","0.0545","0.0347","","","0.0726","0.0793","","","","","","1.041","","","","has coordinates","187167","2020-10-21","18:00:00",""
"7055721","14.4606","0.0006","7.4161","0.0003","31.678","0.0013","90","","97.798","0.002","90","","3365.8","0.2","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(E)-3-(3-chloro-4-(dimethylamino)phenyl)-1-(3-chloro-4-methoxyphenyl)prop-2-en-1-one","(E)-3-(3-chloro-4-(dimethylamino)phenyl)-1-(3-chloro-4-methoxyphenyl)prop-2-en-1-one","","- C18 H17 Cl2 N O2 -","- C18 H17 Cl2 N O2 -","- C144 H136 Cl16 N8 O16 -","8","2","","Vaz, Patricia A. A. M.; Rocha, João; Silva, Artur M. S.; Guieu, Samuel","Aggregation-induced emission enhancement in halochalcones","New J. Chem.","2016","40","10","8198","","10.1039/C6NJ01387B","","","0.71073","MoKα","","0.0672","0.0397","","","0.0802","0.0895","","","","","","1.012","","","","has coordinates","187167","2020-10-21","18:00:00",""
"7055722","8.8051","0.0016","13.364","0.002","9.6474","0.0017","90","","107.1","0.002","90","","1085","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H25 Cl6 N4 O2 W -","- C10 H25 Cl6 N4 O2 W -","- C20 H50 Cl12 N8 O4 W2 -","2","0.5","","Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","The chemistry of high valent tungsten chlorides with N-substituted ureas, including urea self-protonation reactions triggered by WCl6","New J. Chem.","2016","40","10","8271","","10.1039/C6NJ01822J","","","0.71073","MoKα","","0.0417","0.0339","","","0.0813","0.0891","","","","","","1.097","","","","has coordinates,has disorder","187171","2020-10-21","18:00:00",""
"7055723","10.165","0.004","11.202","0.004","15.614","0.008","97.21","0.006","105.984","0.006","114.048","0.004","1502.5","1.1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H25 Cl6 N4 O2 W -","- C26 H25 Cl6 N4 O2 W -","- C52 H50 Cl12 N8 O4 W2 -","2","1","","Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","The chemistry of high valent tungsten chlorides with N-substituted ureas, including urea self-protonation reactions triggered by WCl6","New J. Chem.","2016","40","10","8271","","10.1039/C6NJ01822J","","","0.71073","MoKα","","0.0614","0.0372","","","0.0799","0.0888","","","","","","0.979","","","","has coordinates","187171","2020-10-21","18:00:00",""
"7055724","10.18","0.003","15.365","0.004","22.009","0.006","90","","90","","90","","3442.6","1.6","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C3 H8 Cl5 N2 O W -","- C3 H8 Cl5 N2 O W -","- C36 H96 Cl60 N24 O12 W12 -","12","3","","Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","The chemistry of high valent tungsten chlorides with N-substituted ureas, including urea self-protonation reactions triggered by WCl6","New J. Chem.","2016","40","10","8271","","10.1039/C6NJ01822J","","","0.71073","MoKα","","0.0712","0.0458","","","0.0898","0.0997","","","","","","1.018","","","","has coordinates","187171","2020-10-21","18:00:00",""
"7055725","9.1938","0.0018","14.574","0.003","9.857","0.002","90","","96.519","0.002","90","","1312.2","0.5","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H12 Cl5 N2 O W -","- C5 H12 Cl5 N2 O W -","- C20 H48 Cl20 N8 O4 W4 -","4","1","","Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","The chemistry of high valent tungsten chlorides with N-substituted ureas, including urea self-protonation reactions triggered by WCl6","New J. Chem.","2016","40","10","8271","","10.1039/C6NJ01822J","","","0.71073","MoKα","","0.0371","0.0295","","","0.063","0.0653","","","","","","1.019","","","","has coordinates","187171","2020-10-21","18:00:00",""
"7055726","9.7817","0.0006","12.5746","0.0007","13.7251","0.0008","90","","91.979","0.001","90","","1687.19","0.17","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H21 Cl4 N2 O2 W -","- C9 H21 Cl4 N2 O2 W -","- C36 H84 Cl16 N8 O8 W4 -","4","1","","Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","The chemistry of high valent tungsten chlorides with N-substituted ureas, including urea self-protonation reactions triggered by WCl6","New J. Chem.","2016","40","10","8271","","10.1039/C6NJ01822J","","","0.71073","MoKα","","0.0262","0.0203","","","0.0413","0.0433","","","","","","1.038","","","","has coordinates","187171","2020-10-21","18:00:00",""
"7055727","9.483","0.002","10.127","0.002","11.202","0.002","90","","89.971","0.002","90","","1075.8","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C3 H8 Cl4 N2 O2 W -","- C3 H8 Cl4 N2 O2 W -","- C12 H32 Cl16 N8 O8 W4 -","4","1","","Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Zacchini, Stefano","The chemistry of high valent tungsten chlorides with N-substituted ureas, including urea self-protonation reactions triggered by WCl6","New J. Chem.","2016","40","10","8271","","10.1039/C6NJ01822J","","","0.71073","MoKα","","0.0646","0.0604","","","0.1436","0.147","","","","","","1.225","","","","has coordinates","187171","2020-10-21","18:00:00",""
"7055728","11.0742","0.0016","11.0742","0.0016","6.4127","0.0009","90","","90","","90","","786.44","0.19","100","2","100","2","","","","","","","no","5","P -4","P -4","81","bis(TMS)selenophenedioxide","bis(TMS)selenophenedioxide","","- C10 H20 O2 Se Si2 -","- C10 H20 O2 Se Si2 -","- C20 H40 O4 Se2 Si4 -","2","0.5","","Masuda, Toshiyuki; Inagaki, Yusuke; Momma, Hiroyuki; Kwon, Eunsang; Setaka, Wataru","Facile synthesis of 2,5-bis(silyl)selenophene-1,1-dioxide and its photophysical properties","New J. Chem.","2016","40","10","8593","","10.1039/C6NJ01886F","","","0.71073","MoKα","","0.024","0.0238","","","0.0709","0.0709","","","","","","0.945","","","","has coordinates,has disorder","187173","2020-10-21","18:00:00",""
"7055729","14.666","0.004","14.776","0.004","6.4741","0.0016","90","","90","","90","","1403","0.6","100","2","100","2","","","","","","","","4","P m m n :2","-P 2ab 2a","59","1,4-bisTMSselenophene","1,4-bisTMSselenophene","","- C10 H20 Se Si2 -","- C10 H22 Se Si2 -","- C40 H88 Se4 Si8 -","4","0.5","","Masuda, Toshiyuki; Inagaki, Yusuke; Momma, Hiroyuki; Kwon, Eunsang; Setaka, Wataru","Facile synthesis of 2,5-bis(silyl)selenophene-1,1-dioxide and its photophysical properties","New J. Chem.","2016","40","10","8593","","10.1039/C6NJ01886F","","","0.71073","MoKα","","0.027","0.0238","","","0.0587","0.06","","","","","","1.033","","","","has coordinates","187173","2020-10-21","18:00:00",""
"7055730","12.923","0.003","12.032","0.002","22.59","0.008","90","","108.13","0.03","90","","3338.1","1.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H34 Cu Fe Gd N8 O11 -","- C25 H20 Cu Fe Gd N8 O11 -","- C100 H80 Cu4 Fe4 Gd4 N32 O44 -","4","1","","Liu, Mei-Jiao; Hu, Kong-Qiu; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong","Ligand-directed assembly of trinuclear and one-dimensional heterotrimetallic CuIILnIIIFeIIIcomplexes: unusual antiferromagnetic CuIIFeIIIcoupling via cyano bridges","New J. Chem.","2016","40","10","8643","","10.1039/C6NJ01887D","","","0.71073","MoKα","","0.0485","0.0352","","","0.0831","0.0912","","","","","","1.038","","","","has coordinates,has disorder","187159","2020-10-21","18:00:00",""
"7055731","12.889","0.003","12.035","0.002","22.242","0.008","90","","105.12","0.03","90","","3330.7","1.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H34 Cu Fe N8 O11 Tb -","- C25 H30 Cu Fe N8 O11 Tb -","- C100 H120 Cu4 Fe4 N32 O44 Tb4 -","4","1","","Liu, Mei-Jiao; Hu, Kong-Qiu; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong","Ligand-directed assembly of trinuclear and one-dimensional heterotrimetallic CuIILnIIIFeIIIcomplexes: unusual antiferromagnetic CuIIFeIIIcoupling via cyano bridges","New J. Chem.","2016","40","10","8643","","10.1039/C6NJ01887D","","","0.71073","MoKα","","0.0506","0.0383","","","0.095","0.1037","","","","","","1.035","","","","has coordinates,has disorder","187159","2020-10-21","18:00:00",""
"7055732","8.5391","0.0002","24.9879","0.0008","15.7226","0.0005","90","","92.0769","0.0012","90","","3352.59","0.17","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H31.5 Cu Dy Fe N8 O9.75 -","- C25 H24 Cu Dy Fe N8 O9.75 -","- C100 H96 Cu4 Dy4 Fe4 N32 O39 -","4","1","","Liu, Mei-Jiao; Hu, Kong-Qiu; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong","Ligand-directed assembly of trinuclear and one-dimensional heterotrimetallic CuIILnIIIFeIIIcomplexes: unusual antiferromagnetic CuIIFeIIIcoupling via cyano bridges","New J. Chem.","2016","40","10","8643","","10.1039/C6NJ01887D","","","0.71073","MoKα","","0.0449","0.0346","","","0.0837","0.0883","","","","","","1.021","","","","has coordinates,has disorder","187159","2020-10-21","18:00:00",""
"7055733","21.1918","0.0009","23.32","0.0008","26.6459","0.0012","90","","90","","90","","13168.2","0.9","173","2","173","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C53 H67.5 Cu2 Fe Gd N12.5 O14 -","- C53 H55.5 Cu2 Fe Gd N12.5 O14 -","- C424 H444 Cu16 Fe8 Gd8 N100 O112 -","8","1","","Liu, Mei-Jiao; Hu, Kong-Qiu; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong","Ligand-directed assembly of trinuclear and one-dimensional heterotrimetallic CuIILnIIIFeIIIcomplexes: unusual antiferromagnetic CuIIFeIIIcoupling via cyano bridges","New J. Chem.","2016","40","10","8643","","10.1039/C6NJ01887D","","","0.71073","MoKα","","0.1608","0.0922","","","0.212","0.2434","","","","","","1.102","","","","has coordinates","187159","2020-10-21","18:00:00",""
"7055734","21.0615","0.0009","23.2526","0.0009","26.6468","0.0009","90","","90","","90","","13049.9","0.9","100","1","100","1","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C56 H74 Cu2 Fe N14 O15 Y -","- C56 H70 Cu2 Fe N14 O15 Y -","- C448 H560 Cu16 Fe8 N112 O120 Y8 -","8","1","","Liu, Mei-Jiao; Hu, Kong-Qiu; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong","Ligand-directed assembly of trinuclear and one-dimensional heterotrimetallic CuIILnIIIFeIIIcomplexes: unusual antiferromagnetic CuIIFeIIIcoupling via cyano bridges","New J. Chem.","2016","40","10","8643","","10.1039/C6NJ01887D","","","0.71073","MoKα","","0.1097","0.0596","","","0.1127","0.1302","","","","","","1.052","","","","has coordinates,has disorder","187159","2020-10-21","18:00:00",""
"7055735","21.085","0.004","23.379","0.005","26.922","0.005","90","","90","","90","","13271","5","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C53 H65.5 Cu2 Dy Fe N12.5 O12.5 -","- C51 H52.5 Cu2 Dy Fe N11.5 O14 -","- C408 H420 Cu16 Dy8 Fe8 N92 O112 -","8","1","","Liu, Mei-Jiao; Hu, Kong-Qiu; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong","Ligand-directed assembly of trinuclear and one-dimensional heterotrimetallic CuIILnIIIFeIIIcomplexes: unusual antiferromagnetic CuIIFeIIIcoupling via cyano bridges","New J. Chem.","2016","40","10","8643","","10.1039/C6NJ01887D","","","0.71073","MoKα","","0.142","0.0758","","","0.1561","0.1842","","","","","","1.039","","","","has coordinates","187159","2020-10-21","18:00:00",""
"7055736","21.134","0.011","23.479","0.012","26.843","0.014","90","","90","","90","","13320","12","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C51 H63.5 Cu2 Fe N11.5 O13.5 Tb -","- C51 H52.5 Cu2 Fe N11.5 O13.5 Tb -","- C408 H420 Cu16 Fe8 N92 O108 Tb8 -","8","1","","Liu, Mei-Jiao; Hu, Kong-Qiu; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong","Ligand-directed assembly of trinuclear and one-dimensional heterotrimetallic CuIILnIIIFeIIIcomplexes: unusual antiferromagnetic CuIIFeIIIcoupling via cyano bridges","New J. Chem.","2016","40","10","8643","","10.1039/C6NJ01887D","","","0.71073","MoKα","","0.1439","0.0683","","","0.1819","0.2171","","","","","","1.022","","","","has coordinates,has disorder","187159","2020-10-21","18:00:00",""
"7055737","9.4696","0.0006","7.9769","0.0005","23.0327","0.0012","90","","109.25","0.003","90","","1642.57","0.17","283","2","283","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 Br3 N2 Pb -","- C10 H19 Br3 N2 Pb -","- C40 H76 Br12 N8 Pb4 -","4","1","","Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing","Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3]","New J. Chem.","2016","","","","","10.1039/C6NJ01508E","","","0.71073","MoKα","","0.0754","0.0541","","","0.1126","0.1247","","","","","","1.112","","","","has coordinates","185950","2020-10-21","18:00:00",""
"7055738","9.4917","0.0006","7.9842","0.0005","23.0848","0.0012","90","","109.062","0.003","90","","1653.52","0.17","313","2","313","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 Br3 N2 Pb -","- C10 H19 Br3 N2 Pb -","- C40 H76 Br12 N8 Pb4 -","4","1","","Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing","Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3]","New J. Chem.","2016","","","","","10.1039/C6NJ01508E","","","0.71073","MoKα","","0.113","0.0893","","","0.2622","0.2773","","","","","","1.109","","","","has coordinates","185950","2020-10-21","18:00:00",""
"7055739","9.389","0.004","7.955","0.003","22.888","0.008","90","","109.638","0.015","90","","1610.1","1.1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 Br3 N2 Pb -","- C10 H19 Br3 N2 Pb -","- C40 H76 Br12 N8 Pb4 -","4","1","","Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing","Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3]","New J. Chem.","2016","","","","","10.1039/C6NJ01508E","","","0.71073","MoKα","","0.0463","0.0382","","","0.092","0.0987","","","","","","1.118","","","","has coordinates","185950","2020-10-21","18:00:00",""
"7055740","9.4198","0.0013","7.9592","0.0011","22.961","0.003","90","","109.524","0.006","90","","1622.5","0.4","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 Br3 N2 Pb -","- C10 H19 Br3 N2 Pb -","- C40 H76 Br12 N8 Pb4 -","4","1","","Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing","Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3]","New J. Chem.","2016","","","","","10.1039/C6NJ01508E","","","0.71073","MoKα","","0.0691","0.0566","","","0.1467","0.1569","","","","","","1.128","","","","has coordinates","185950","2020-10-21","18:00:00",""
"7055741","9.4442","0.0006","7.9704","0.0005","22.9992","0.0014","90","","109.466","0.003","90","","1632.28","0.18","243","2","243","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 Br3 N2 Pb -","- C10 H19 Br3 N2 Pb -","- C40 H76 Br12 N8 Pb4 -","4","1","","Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing","Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3]","New J. Chem.","2016","","","","","10.1039/C6NJ01508E","","","0.71073","MoKα","","0.0736","0.0597","","","0.1527","0.1631","","","","","","1.109","","","","has coordinates","185950","2020-10-21","18:00:00",""
"7055742","9.4561","0.0006","7.972","0.0005","23.0041","0.0012","90","","109.354","0.003","90","","1636.14","0.17","263","2","263","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 Br3 N2 Pb -","- C10 H19 Br3 N2 Pb -","- C40 H76 Br12 N8 Pb4 -","4","1","","Wan, Kun-Ming; Tong, Yuan-Bo; Li, Li; Zou, Yang; Duan, Hai-Bao; Liu, Jian-Lan; Ren, XiaoMing","Investigation of thermochromic photoluminescent, dielectric and crystal structural properties for an inorganic-organic hybrid solid of [1-hexyl-3-methylimidazolium][PbBr3]","New J. Chem.","2016","","","","","10.1039/C6NJ01508E","","","0.71073","MoKα","","0.0682","0.0508","","","0.1095","0.1196","","","","","","1.072","","","","has coordinates","185950","2020-10-21","18:00:00",""
"7055743","4.791","0.001","16.125","0.004","20.85","0.005","90","","90","","90","","1610.8","0.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H15 N3 O -","- C21 H15 N3 O -","- C84 H60 N12 O4 -","4","1","","Darabi, Farivash; Hadadzadeh, Hassan; Simpson, Jim; Shahpiri, Azar","A water-soluble Pd(ii) complex with a terpyridine ligand: experimental and molecular modeling studies of the interaction with DNA and BSA; and in vitro cytotoxicity investigations against five human cancer cell lines","New J. Chem.","2016","40","11","9081","","10.1039/C6NJ01880G","","","0.71073","MoKα","","0.2174","0.0329","","","0.0278","0.0458","","","","","","0.827","","","","has coordinates","188262","2020-10-21","18:00:00",""
"7055744","29.3162","0.0006","29.3162","0.0006","5.0991","0.0002","90","","90","","90","","4382.4","0.2","100","2","100","2","","","","","","","","6","P 4/n","-P 4a","85","","(4'-(4-Hydroxyphenyl)-2,2':6',2''-terpyridine-κ^3^N)chloridopalladium(II)","","- C21 H17 Cl2 N3 O2.8 Pd -","- C21 H17 Cl2 N3 O2.8 Pd -","- C168 H136 Cl16 N24 O22.4 Pd8 -","8","","","Darabi, Farivash; Hadadzadeh, Hassan; Simpson, Jim; Shahpiri, Azar","A water-soluble Pd(ii) complex with a terpyridine ligand: experimental and molecular modeling studies of the interaction with DNA and BSA; and in vitro cytotoxicity investigations against five human cancer cell lines","New J. Chem.","2016","40","11","9081","","10.1039/C6NJ01880G","","","1.54184","CuKα","","0.1118","0.1059","","","0.2899","0.2936","","","","","","1.188","","","","has coordinates","188262","2020-10-21","18:00:00",""
"7055745","20.923","0.005","21.41","0.005","8.2496","0.0019","90","","104.003","0.003","90","","3585.7","1.5","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H12 Eu O7 -","- C21 H12 Eu O7 -","- C168 H96 Eu8 O56 -","8","1","","Wang, Jian; Wang, Jingru; Li, Yang; Jiang, Min; Zhang, Lingwen; Wu, Pengyan","A europium(iii)-based metal‒organic framework as a naked-eye and fast response luminescence sensor for acetone and ferric iron","New J. Chem.","2016","40","10","8600","","10.1039/C6NJ02163H","","","0.71073","MoKα","","0.0293","0.0236","","","0.0584","0.0616","","","","","","1.011","","","","has coordinates","187161","2020-10-21","18:00:00",""
"7055746","7.137","0.0004","12.7274","0.0007","14.9056","0.0009","68.085","0.004","79.864","0.004","88.108","0.004","1235.72","0.13","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H21 Cl N5 O9 V -","- C21 H21 Cl N5 O9 V -","- C42 H42 Cl2 N10 O18 V2 -","2","1","","Palmajumder, Eshita; Patra, Swarup; Drew, Michael G. B.; Mukherjea, Kalyan K.","Vanadium bromoperoxidase (VBrPO) mimics: synthesis, structure and a comparative account of the catalytic activity of newly synthesized oxidovanadium and oxido-peroxidovanadium complexes","New J. Chem.","2016","40","10","8696","","10.1039/C6NJ00767H","","","0.71073","MoKα","","0.0753","0.0536","","","0.1419","0.1556","","","","","","1.033","","","","has coordinates,has disorder","187164","2020-10-21","18:00:00",""
"7055747","9.3945","0.0002","9.773","0.0003","11.4652","0.0003","95.855","0.002","92.247","0.002","98.309","0.002","1034.61","0.05","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 N6 O3 V -","- C22 H20 N6 O3 V -","- C44 H40 N12 O6 V2 -","2","1","","Palmajumder, Eshita; Patra, Swarup; Drew, Michael G. B.; Mukherjea, Kalyan K.","Vanadium bromoperoxidase (VBrPO) mimics: synthesis, structure and a comparative account of the catalytic activity of newly synthesized oxidovanadium and oxido-peroxidovanadium complexes","New J. Chem.","2016","40","10","8696","","10.1039/C6NJ00767H","","","0.71073","MoKα","","0.0677","0.0455","","","0.1054","0.1154","","","","","","1.033","","","","has coordinates","187164","2020-10-21","18:00:00",""
"7055748","11.3846","0.0004","11.2191","0.0004","13.1581","0.0005","90","","91.2636","0.0005","90","","1680.21","0.11","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 B F4 N3 O Rh -","- C16 H19 B F4 N3 O Rh -","- C64 H76 B4 F16 N12 O4 Rh4 -","4","1","","Yao, Zi-Jian; Li, Kuan; Zhang, Jian-Yong; Deng, Wei","[NO]- and [NN]-coordination mode rhodium complexes based on a flexible ligand: synthesis, reactivity and catalytic activity","New J. Chem.","2016","40","10","8753","","10.1039/C6NJ02416E","","","0.71073","MoKα","","0.0237","0.0204","","","0.0482","0.0502","","","","","","1.071","","","","has coordinates,has disorder","187166","2020-10-21","18:00:00",""
"7055749","10.9656","0.0005","10.4739","0.0005","13.1256","0.0006","90","","113.987","0.0006","90","","1377.32","0.11","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 N3 O Rh -","- C16 H18 N3 O Rh -","- C64 H72 N12 O4 Rh4 -","4","1","","Yao, Zi-Jian; Li, Kuan; Zhang, Jian-Yong; Deng, Wei","[NO]- and [NN]-coordination mode rhodium complexes based on a flexible ligand: synthesis, reactivity and catalytic activity","New J. Chem.","2016","40","10","8753","","10.1039/C6NJ02416E","","","0.71073","MoKα","","0.0172","0.0167","","","0.0412","0.0415","","","","","","1.06","","","","has coordinates","187166","2020-10-21","18:00:00",""
"7055750","15.423","0.005","41.104","0.005","9.126","0.005","90","0.005","120.433","0.005","90","0.005","4988","3","327","2","327","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H23 N3 S -","- C32 H23 N3 S -","- C256 H184 N24 S8 -","8","2","","Xu, Shasha; Zhu, Yingzhong; Li, Rui; Su, Jian; Li, Shengli; Zhou, Hongping; Wu, Jieying; Tian, Yupeng","Thiophene-based pyridine derivatives: synthesis, crystal structures, two-photon absorption properties and bio-imaging applications in the near-IR region","New J. Chem.","2016","40","10","8809","","10.1039/C6NJ00845C","","","0.71069","MoKα","","0.1083","0.0549","","","0.1573","0.2163","","","","","","0.78","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7055751","13.288","0.005","40.706","0.005","9.1","0.005","90","0.005","95.255","0.005","90","0.005","4902","3","327","2","327","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H22 N4 S -","- C31 H22 N4 S -","- C248 H176 N32 S8 -","8","2","","Xu, Shasha; Zhu, Yingzhong; Li, Rui; Su, Jian; Li, Shengli; Zhou, Hongping; Wu, Jieying; Tian, Yupeng","Thiophene-based pyridine derivatives: synthesis, crystal structures, two-photon absorption properties and bio-imaging applications in the near-IR region","New J. Chem.","2016","40","10","8809","","10.1039/C6NJ00845C","","","0.71069","MoKα","","0.1353","0.0561","","","0.1389","0.191","","","","","","0.923","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7055752","15.6424","0.001","9.5888","0.0008","20.3871","0.0011","90","","108.266","0.006","90","","2903.8","0.4","297.56","0.19","297.56","0.19","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C36 H35 N5 -","- C36 H35 N5 -","- C144 H140 N20 -","4","0.5","","Li, Chunchun; Yang, Wen; Zhou, Weiqun; Zhang, Mengmeng; Xue, Renyu; Li, Mengying; Cheng, Zhongqin","Branching effect for aggregation-induced emission in fluorophores containing imine and triphenylamine structures","New J. Chem.","2016","40","10","8837","","10.1039/C6NJ01558A","","x-ray","0.71073","MoKα","","0.0829","0.0487","","","0.1427","0.1711","","","","","","0.982","","","","has coordinates","187165","2020-10-21","18:00:00",""
"7055753","7.6197","0.0018","18.829","0.005","15.36","0.004","90","","90.93","0.02","90","","2203.4","1","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H25 N3 -","- C27 H25 N3 -","- C108 H100 N12 -","4","1","","Li, Chunchun; Yang, Wen; Zhou, Weiqun; Zhang, Mengmeng; Xue, Renyu; Li, Mengying; Cheng, Zhongqin","Branching effect for aggregation-induced emission in fluorophores containing imine and triphenylamine structures","New J. Chem.","2016","40","10","8837","","10.1039/C6NJ01558A","","","0.71073","MoKα","","0.1489","0.0589","","","0.1081","0.1453","","","","","","0.941","","","","has coordinates","187165","2020-10-21","18:00:00",""
"7055754","5.46953","0.00004","25.01189","0.00017","10.72878","0.00009","90","","113.059","0.0007","90","","1350.47","0.019","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1'-[4-hydroxy-2-(hydroxymethyl)-1,3-dioxolane-2,4-diyl]di(butan-1-one)","","- C12 H20 O6 -","- C12 H18 O6 -","- C48 H72 O24 -","4","1","","Trzewik, Bartosz; Chruszcz-Lipska, Katarzyna; Miłaczewska, Anna; Opalińska-Piskorz, Joanna; Karcz, Robert; Gryboś, Robert; Oszajca, Marcin; Luberda-Durnaś, Katarzyna; Łasocha, Wiesław; Fitch, Andy; Sulikowski, Bogdan; Borowski, Tomasz","Synthesis and the crystal structure of dimeric 1-hydroxyhexane-2,3-dione and the spectral characteristics of a model acireductone","New J. Chem.","2016","40","11","9291","","10.1039/C6NJ00562D","powder diffraction","x-ray","0.40087","synchrotron","","0.1309","0.1033","","0.0873","0.0834","","","","1.97","","","","","","","has coordinates","188256","2020-10-21","18:00:00",""
"7055755","5.4695","","25.0119","","10.7288","","90","","113.059","","90","","1350.46","","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1'-[4-hydroxy-2-(hydroxymethyl)-1,3-dioxolane-2,4-diyl]di(butan-1-one)","","- C12 H20 O6 -","- C12 H20 O6 -","- C48 H80 O24 -","4","1","","Trzewik, Bartosz; Chruszcz-Lipska, Katarzyna; Miłaczewska, Anna; Opalińska-Piskorz, Joanna; Karcz, Robert; Gryboś, Robert; Oszajca, Marcin; Luberda-Durnaś, Katarzyna; Łasocha, Wiesław; Fitch, Andy; Sulikowski, Bogdan; Borowski, Tomasz","Synthesis and the crystal structure of dimeric 1-hydroxyhexane-2,3-dione and the spectral characteristics of a model acireductone","New J. Chem.","2016","40","11","9291","","10.1039/C6NJ00562D","powder diffraction","x-ray","0.40087","synchrotron","","0.123","0.1149","","0.1279","0.1265","","","","2.59","","","","","","","has coordinates","188256","2020-10-21","18:00:00",""
"7055756","8.66567","0.00019","9.3865","0.0003","10.4897","0.0003","84.169","0.002","87.2611","0.0019","64.997","0.002","769.26","0.04","100","","100","","","","","","","","","4","P -1","-P 1","2","","4-ethenylbenzyl N'-[(E)-phenylmethylidene]carbamohydrazonothioate","","- C17 H17 N3 S -","- C17 H17 N3 S -","- C34 H34 N6 S2 -","2","1","","Markiewicz, Karolina H.; Zembko, Paula; Półtorak, Katarzyna; Misztalewska, Iwona; Wojtulewski, Sławomir; Majcher, Anna M.; Fornal, Emilia; Wilczewska, Agnieszka Z.","Magnetic nanoparticles with chelating shells prepared by RAFT/MADIX polymerization","New J. Chem.","2016","40","11","9223","","10.1039/C6NJ01938B","","x-ray","0.71073","MoKα","","0.0519","0.0404","","","0.1062","0.1179","","","","","","1.0978","","","","has coordinates","188259","2020-10-21","18:00:00",""
"7055757","9.4176","0.0002","10.2256","0.0002","11.864","0.0003","67.799","0.002","68.787","0.002","66.31","0.002","938.48","0.04","100.1","0.6","100.1","0.6","","","","","","","","6","P -1","-P 1","2","","(1E,2E)-1-{amino[(4-ethenylbenzyl)sulfanyl]methylidene}-2-benzylidenehydrazinium chloride - methanol (1:1:1)","","- C18 H22 Cl N3 O S -","- C18 H22 Cl N3 O S -","- C36 H44 Cl2 N6 O2 S2 -","2","1","","Markiewicz, Karolina H.; Zembko, Paula; Półtorak, Katarzyna; Misztalewska, Iwona; Wojtulewski, Sławomir; Majcher, Anna M.; Fornal, Emilia; Wilczewska, Agnieszka Z.","Magnetic nanoparticles with chelating shells prepared by RAFT/MADIX polymerization","New J. Chem.","2016","40","11","9223","","10.1039/C6NJ01938B","","x-ray","0.71073","MoKα","","0.0656","0.0446","","","0.1116","0.1258","","","","","","1.034","","","","has coordinates","188259","2020-10-21","18:00:00",""
"7055758","8.8665","0.0003","12.6487","0.0005","21.9234","0.0009","90","","90","","90","","2458.7","0.16","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H29 N3 O6 S -","- C24 H29 N3 O6 S -","- C96 H116 N12 O24 S4 -","4","1","","Ingole, Tukaram S.; Kotmale, Amol S.; Gawade, Rupesh L.; Gonnade, Rajesh G.; Rajamohanan, Pattuparambil R.; Sanjayan, Gangadhar J.","3-Aminothiophenecarboxylic acid (3-Atc)-induced folding in peptides","New J. Chem.","2016","40","11","9205","","10.1039/C6NJ01667G","","","0.71073","MoKα","","0.033","0.0315","","","0.0793","0.0801","","","","","","1.067","","","","has coordinates","188268","2020-10-21","18:00:00",""
"7055759","16.6624","0.0017","15.2623","0.0014","19.0219","0.0016","90","","104.39","0.01","90","","4685.6","0.8","150","0.1","150","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H58 Br Cu N2 O4 -","- C47 H58 Br Cu N2 O4 -","- C188 H232 Br4 Cu4 N8 O16 -","4","1","","Ourri, Benjamin; Tillement, Olivier; Tu, Tao; Jeanneau, Erwann; Darbost, Ulrich; Bonnamour, Isabelle","Copper complexes bearing an NHC–calixarene unit: synthesis and application in click chemistry","New J. Chem.","2016","40","11","9477","","10.1039/C6NJ02089E","","x-ray","1.54184","CuKα","","0.0905","0.074","","0.1745","0.1491","0.174","","","","","","1.0181","","","","has coordinates","288640","2024-01-03","12:53:03",""
"7055760","15.1315","0.0005","28.8618","0.0011","35.9491","0.0013","104.778","0.002","94.065","0.002","92.353","0.002","15113.8","1","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C162.5 H199.5 Cl2.5 N10 O12 S8 -","- C162.5 H199.5 Cl2.5 N10 O12 S8 -","- C650 H798 Cl10 N40 O48 S32 -","4","2","","Rahman, Shofiur; Tomiyasu, Hirotsugu; Kawazoe, Hiroto; Zhao, Jiang-Lin; Cong, Hang; Ni, Xin-Long; Zeng, Xi; Elsegood, Mark R. J.; Warwick, Thomas G.; Teat, Simon J.; Redshaw, Carl; Georghiou, Paris E.; Yamato, Takehiko","A study of anion binding behaviour of 1,3-alternate thiacalix[4]arene-based receptors bearing urea moieties","New J. Chem.","2016","40","11","9245","","10.1039/C6NJ00923A","","","0.7749","synchrotron","","0.11","0.0675","","","0.1629","0.1848","","","","","","1.007","","","","has coordinates,has disorder","188271","2020-10-21","18:00:00",""
"7055761","9.4119","0.0004","33.4898","0.0013","10.459","0.0004","90","","97.316","0.001","90","","3269.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Cl8 N10 P6 -","- C14 H22 Cl8 N10 P6 -","- C56 H88 Cl32 N40 P24 -","4","1","","Asmafiliz, Nuran; Kılıç, Zeynel; Civan, Mehmet; Avcı, Orhan; Yasemin Gönder (née Koç), L.; Açık, Leyla; Aydın, Betül; Türk, Mustafa; Hökelek, Tuncer","Phosphorus‒nitrogen compounds. Part 36. Syntheses, Langmuir‒Blodgett thin films and biological activities of spiro-bino-spiro trimeric phosphazenes","New J. Chem.","2016","40","11","9609","","10.1039/C6NJ02052F","","","0.71073","MoKα","","0.0783","0.0543","","","0.1293","0.1405","","","","","","1.035","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7055762","12.5574","0.0006","17.0478","0.0008","16.6323","0.0008","90","","108.227","0.002","90","","3381.9","0.3","99","2","99","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 Cl8 N10 P6 -","- C16 H26 Cl8 N10 P6 -","- C64 H104 Cl32 N40 P24 -","4","1","","Asmafiliz, Nuran; Kılıç, Zeynel; Civan, Mehmet; Avcı, Orhan; Yasemin Gönder (née Koç), L.; Açık, Leyla; Aydın, Betül; Türk, Mustafa; Hökelek, Tuncer","Phosphorus‒nitrogen compounds. Part 36. Syntheses, Langmuir‒Blodgett thin films and biological activities of spiro-bino-spiro trimeric phosphazenes","New J. Chem.","2016","40","11","9609","","10.1039/C6NJ02052F","","","0.71073","MoKα","","0.0869","0.0551","","","0.105","0.1259","","","","","","1.088","","","","has coordinates","188263","2020-10-21","18:00:00",""
"7055763","38.868","0.002","9.1882","0.0006","16.6047","0.001","90","","104.465","0.003","90","","5742","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H42 N8 O P3 -","- C23 H42 N8 O P3 -","- C184 H336 N64 O8 P24 -","8","1","","Asmafiliz, Nuran; Kılıç, Zeynel; Civan, Mehmet; Avcı, Orhan; Yasemin Gönder (née Koç), L.; Açık, Leyla; Aydın, Betül; Türk, Mustafa; Hökelek, Tuncer","Phosphorus‒nitrogen compounds. Part 36. Syntheses, Langmuir‒Blodgett thin films and biological activities of spiro-bino-spiro trimeric phosphazenes","New J. Chem.","2016","40","11","9609","","10.1039/C6NJ02052F","","","0.71073","MoKα","","0.0999","0.0608","","","0.1683","0.1955","","","","","","1.027","","","","has coordinates","188263","2020-10-21","18:00:00",""
"7055764","13.0886","0.0003","18.8973","0.0005","15.2742","0.0004","90","","90","","90","","3777.91","0.17","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","HbimcaIPr2HBr","3,6-Di-tert-butyl-1,8-bis(3-isopropylimidazolium)carbazole dibromide","","- C35 H51 Br2 N5 O -","- C35 H51 Br2 N5 O -","- C140 H204 Br8 N20 O4 -","4","1","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","","0.71073","MoKα","","0.0495","0.0334","","","0.0655","0.0699","","","","","","1.027","","","","has coordinates","188258","2020-10-21","18:00:00",""
"7055765","13.3028","0.0015","17.311","0.002","16.0809","0.0018","90","","90","","90","","3703.2","0.7","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","H(bimcaAllyl)2HBr","3,6-Di-tert-butyl-1,8-bis(3-(1-allyl)imidazolium)carbazole dibromide","","- C35 H49 Br2 N5 O2 -","- C35 H49 Br2 N5 O2 -","- C140 H196 Br8 N20 O8 -","4","1","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","","0.71073","MoKα","","0.0785","0.0466","","","0.1023","0.1155","","","","","","1.035","","","","has coordinates,has disorder","188258","2020-10-21","18:00:00",""
"7055766","20.2134","0.0017","14.5713","0.0012","25.883","0.003","90","","111.234","0.002","90","","7105.9","1.2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","H(bimcaC5)2HBr","","","- C33 H42 Br2 N6 -","- C33 H42 Br2 N6 -","- C264 H336 Br16 N48 -","8","1","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","","0.71073","MoKα","","0.0725","0.0446","","","0.1107","0.1224","","","","","","1.041","","","","has coordinates,has disorder","188258","2020-10-21","18:00:00",""
"7055767","14.5894","0.0007","25.35","0.0011","10.6923","0.0005","90","","94.759","0.001","90","","3940.8","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","H(bimcaBn)2HBr","3,6-Di-tert-butyl-1,8-bis(3-benzylimidazolium)carbazole dibromide","","- C41 H45 Br2 Cl2 N5 -","- C41 H45 Br2 Cl2 N5 -","- C164 H180 Br8 Cl8 N20 -","4","1","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","","0.71073","MoKα","","0.0518","0.0398","","","0.0992","0.1047","","","","","","1.058","","","","has coordinates,has disorder","188258","2020-10-21","18:00:00",""
"7055768","15.331","0.002","10.6223","0.0014","25.494","0.003","90","","90","","90","","4151.7","0.9","100","2","100","2","","","","","","","","5","P b c m","-P 2c 2b","57","HbimcaPh2HBF4","3,6-Di-tert-butyl-1,8-bis(3-phenylimidazolium)carbazole bis(tetrafluoroborate)","","- C38 H39 B2 F8 N5 -","- C38 H39 B2 F8 N5 -","- C152 H156 B8 F32 N20 -","4","0.5","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","","0.71073","MoKα","","0.1015","0.0636","","","0.1224","0.1379","","","","","","1.078","","","","has coordinates","188258","2020-10-21","18:00:00",""
"7055769","29.213","0.009","13.853","0.004","22.665","0.007","90","","103.529","0.014","90","","8918","5","150","","150","","","","","","","","deprotonation of parent carbazole","6","C 1 2/c 1","-C 2yc","15","Li(bimcaiPr)LiI(DME)","","","- C36 H47 I Li2 N5 O2 -","- C36 H47 I Li2 N5 O2 -","- C288 H376 I8 Li16 N40 O16 -","8","1","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","x-ray","0.71073","MoKα","","0.1762","0.0662","","","0.1943","0.2578","","","","","","0.9636","","","","has coordinates,has disorder","188258","2020-10-21","18:00:00",""
"7055770","13.948","0.002","11.4011","0.0019","43.494","0.007","90","","90","","90","","6916.5","1.9","200","2","200","2","","","","","","","","6","P b c n","-P 2n 2ab","60","HbimcaEt2HBF4","3,6-Di-tert-butyl-1,8-bis(3-ethylimidazolium)carbazole bis(tetrafluoroborate)","","- C32 H43 B2 F8 N5 O0.74 -","- C32 H43 B2 F8 N5 O0.743 -","- C256 H344 B16 F64 N40 O5.944 -","8","1","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","","0.71073","MoKα","","0.1001","0.0666","","","0.1577","0.1797","","","","","","1.082","","","","has coordinates,has disorder","188258","2020-10-21","18:00:00",""
"7055771","11.373","0.006","18.404","0.01","23.13","0.012","69.64","0.02","80.26","0.02","76.44","0.02","4392","4","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H43 I2 N5 -","- C32 H43 I2 N5 -","- C128 H172 I8 N20 -","4","2","","Jürgens, Eva; Buys, Kai N.; Schmidt, Anna-Theresa; Furfari, Samantha K.; Cole, Marcus L.; Moser, Michael; Rominger, Frank; Kunz, Doris","Optimised synthesis of monoanionic bis(NHC)-pincer ligand precursors and their Li-complexes","New J. Chem.","2016","40","11","9160","","10.1039/C6NJ01941B","","x-ray","0.71073","MoKα","","0.1517","0.0692","","","0.2023","0.2583","","","","","","0.952","","","","has coordinates,has disorder","213925","2020-10-21","18:00:00",""
"7055772","15.772","0.004","26.504","0.006","17.489","0.004","90","","90.083","0.003","90","","7311","3","173.15","","173.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H48 Br2 N4 Ni O -","- C39 H48 Br2 N4 Ni O -","- C312 H384 Br16 N32 Ni8 O8 -","8","2","","Huang, Chuanbing; Zhang, Youfu; Liang, Tongling; Zhao, Zhijuan; Hu, Xinquan; Sun, Wen-Hua","Rigid geometry 8-arylimino-7,7-dimethyl-5,6-dihydroquinolyl nickel bromides: single-site active species towards ethylene polymerization","New J. Chem.","2016","40","11","9329","","10.1039/C6NJ02464E","","","0.71073","MoKα","","0.0929","0.0746","","","0.111","0.1173","","","","","","1.169","","","","has coordinates,has disorder","188260","2020-10-21","18:00:00",""
"7055773","25.088","0.004","25.088","0.004","13.251","0.003","90","","90","","90","","8340","3","173.15","","173.15","","","","","","","","","5","P 4/n","-P 4a","85","","","","- C40 H48 Br2 N4 Ni -","- C40 H48 Br2 N4 Ni -","- C320 H384 Br16 N32 Ni8 -","8","","","Huang, Chuanbing; Zhang, Youfu; Liang, Tongling; Zhao, Zhijuan; Hu, Xinquan; Sun, Wen-Hua","Rigid geometry 8-arylimino-7,7-dimethyl-5,6-dihydroquinolyl nickel bromides: single-site active species towards ethylene polymerization","New J. Chem.","2016","40","11","9329","","10.1039/C6NJ02464E","","","0.71073","MoKα","","0.0842","0.0757","","","0.1536","0.1576","","","","","","1.213","","","","has coordinates","188260","2020-10-21","18:00:00",""
"7055774","35.144","0.007","10.1699","0.0017","33.644","0.006","90","","148.402","0.008","90","","6300","2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H27 N7 O10 S Zn -","- C27 H27 N7 O10 S Zn -","- C216 H216 N56 O80 S8 Zn8 -","8","1","","Li, Xiang; Dong, Xiongwei; Liu, Yaojing; Meng, Yan; Zhang, Yong; Zhang, Dan; Liu, Changlin","Ultraviolet irradiation-mediated formation of Aβ42 oligomers and reactive oxygen species in Zn2±bound Aβ42 aggregates irrespective of the removal of Zn2+","New J. Chem.","2016","40","11","9385","","10.1039/C6NJ02004F","","","0.71073","MoKα","","0.094","0.0838","","","0.2188","0.2262","","","","","","1.118","","","","has coordinates,has disorder","194616","2020-10-21","18:00:00",""
"7055775","12.8554","0.0006","13.0685","0.0006","13.4125","0.0006","85.321","0.004","83.005","0.004","82.019","0.004","2210.08","0.18","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C53 H50 Cl2 O8 -","- C53 H50 Cl2 O8 -","- C106 H100 Cl4 O16 -","2","1","","Boinski, T.; Cieszkowski, A.; Rosa, B.; Leśniewska, B.; Szumna, A.","Calixarenes with naphthalene units: calix[4]naphthalenes and hybrid[4]arenes","New J. Chem.","2016","40","10","8892","","10.1039/C6NJ01736C","","x-ray","1.54184","CuKα","","0.0939","0.0616","","","0.1655","0.1908","","","","","","1.033","","","","has coordinates","187174","2020-10-21","18:00:00",""
"7055776","6.66","0.003","17.17","0.006","10.738","0.003","90","","94.13","0.03","90","","1224.7","0.8","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Cu2 N4 O6 -","- C28 H20 Cu2 N4 O6 -","- C56 H40 Cu4 N8 O12 -","2","0.5","","Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina","Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects","New J. Chem.","2016","40","11","9263","","10.1039/C6NJ01036A","","","0.71073","MoKα","","0.043","0.0308","","","0.0696","0.0735","","","","","","1.031","","","","has coordinates","188273","2020-10-21","18:00:00",""
"7055777","38.0051","0.0015","12.0227","0.0003","7.3639","0.0018","90","","90","","90","","3364.7","0.8","296","2","296","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C19 H15 Cu N3 O3 -","- C19 H15 Cu N3 O3 -","- C152 H120 Cu8 N24 O24 -","8","1","","Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina","Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects","New J. Chem.","2016","40","11","9263","","10.1039/C6NJ01036A","","","1.5418","CuKα","","0.0346","0.0335","","","0.0963","0.0974","","","","","","1.044","","","","has coordinates","188273","2020-10-21","18:00:00",""
"7055778","25.8273","0.0011","21.2967","0.0016","23.5033","0.0015","90","","94.619","0.005","90","","12885.7","1.4","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C60.5 H53.5 Cu4 N8 O21.5 -","- C60.5 H53.5 Cu4 N8 O21.5 -","- C484 H428 Cu32 N64 O172 -","8","2","","Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina","Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects","New J. Chem.","2016","40","11","9263","","10.1039/C6NJ01036A","","","0.71073","MoKα","","0.1545","0.0894","","","0.181","0.2066","","","","","","1.055","","","","has coordinates","192220","2020-10-21","18:00:00",""
"7055779","29.0398","0.0018","25.7429","0.0009","24.4687","0.0015","90","","129.863","0.01","90","","14041","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C65.6 H56 Cu4 N8 O19 -","- C65.6 H56 Cu4 N8 O19 -","- C524.8 H448 Cu32 N64 O152 -","8","1","","Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina","Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects","New J. Chem.","2016","40","11","9263","","10.1039/C6NJ01036A","","","0.71073","MoKα","","0.0744","0.0567","","","0.1609","0.1721","","","","","","1.022","","","","has coordinates","188273","2020-10-21","18:00:00",""
"7055780","13.7365","0.0009","8.0055","0.0007","16.5631","0.0012","90","","94.824","0.007","90","","1815","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H17 Cu N3 O4 -","- C20 H17 Cu N3 O4 -","- C80 H68 Cu4 N12 O16 -","4","1","","Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina","Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects","New J. Chem.","2016","40","11","9263","","10.1039/C6NJ01036A","","","0.71073","MoKα","","0.1348","0.0613","","","0.1009","0.1253","","","","","","0.944","","","","has coordinates","188273","2020-10-21","18:00:00",""
"7055781","12.474","0.0004","25.8954","0.0008","8.5646","0.0002","90","","90","","90","","2766.53","0.14","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C30 H24 Cu2 N4 O8 -","- C30 H24 Cu2 N4 O8 -","- C120 H96 Cu8 N16 O32 -","4","0.5","","Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina","Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects","New J. Chem.","2016","40","11","9263","","10.1039/C6NJ01036A","","","1.5418","CuKα","","0.0473","0.04","","","0.1122","0.1177","","","","","","1.043","","","","has coordinates","188273","2020-10-21","18:00:00",""
"7055782","7.1772","0.0005","26.5801","0.0015","8.2529","0.0006","90","","97.208","0.006","90","","1561.97","0.18","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H32 Cu2 N4 O10 -","- C32 H32 Cu2 N4 O10 -","- C64 H64 Cu4 N8 O20 -","2","0.5","","Vrdoljak, Višnja; Pavlović, Gordana; Maltar-Strmečki, Nadica; Cindrić, Marina","Copper(ii) hydrazone complexes with different nuclearities and geometries: synthetic methods and ligand substituent effects","New J. Chem.","2016","40","11","9263","","10.1039/C6NJ01036A","","","0.71073","MoKα","","0.0367","0.0298","","","0.0709","0.0734","","","","","","1.088","","","","has coordinates","188273","2020-10-21","18:00:00",""
"7055783","15.3005","0.0005","16.0897","0.0006","12.2535","0.0004","90","","93.027","0.001","90","","3012.36","0.18","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H38 Cl2 N6 Pd -","- C28 H38 Cl2 N6 Pd -","- C112 H152 Cl8 N24 Pd4 -","4","1","","Yang, Jin","Mono- and dinuclear palladium(ii) complexes containing both N-heterocyclic carbenes and tetrazole ligands as catalysts for Hiyama coupling","New J. Chem.","2016","40","11","9739","","10.1039/C6NJ02320G","","","0.71073","MoKα","","0.0312","0.0267","","","0.0706","0.0761","","","","","","0.96","","","","has coordinates","188255","2020-10-21","18:00:00",""
"7055784","15.464","0.011","16.201","0.012","12.484","0.009","90","","92.812","0.013","90","","3124","4","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H40 Cl2 N6 Pd -","- C28 H40 Cl2 N6 Pd -","- C112 H160 Cl8 N24 Pd4 -","4","1","","Yang, Jin","Mono- and dinuclear palladium(ii) complexes containing both N-heterocyclic carbenes and tetrazole ligands as catalysts for Hiyama coupling","New J. Chem.","2016","40","11","9739","","10.1039/C6NJ02320G","","","0.71073","MoKα","","0.0446","0.035","","","0.1107","0.1316","","","","","","1.06","","","","has coordinates","188255","2020-10-21","18:00:00",""
"7055785","14.712","0.004","15.207","0.004","20.231","0.005","68.845","0.004","72.185","0.004","63.367","0.003","3716.4","1.7","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C137 H170 Cl10 N24 Pd4 -","- C137 H170 Cl10 N24 Pd4 -","- C137 H170 Cl10 N24 Pd4 -","1","0.5","","Yang, Jin","Mono- and dinuclear palladium(ii) complexes containing both N-heterocyclic carbenes and tetrazole ligands as catalysts for Hiyama coupling","New J. Chem.","2016","40","11","9739","","10.1039/C6NJ02320G","","","0.71073","MoKα","","0.0424","0.0317","","","0.0803","0.0886","","","","","","1.044","","","","has coordinates","188255","2020-10-21","18:00:00",""
"7055786","12.022","0.009","20.9","0.016","16.374","0.012","90","","103.443","0.011","90","","4001","5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H46 Cl4 N6 Pd -","- C35 H46 Cl4 N6 Pd -","- C140 H184 Cl16 N24 Pd4 -","4","1","","Yang, Jin","Mono- and dinuclear palladium(ii) complexes containing both N-heterocyclic carbenes and tetrazole ligands as catalysts for Hiyama coupling","New J. Chem.","2016","40","11","9739","","10.1039/C6NJ02320G","","","0.71073","MoKα","","0.2582","0.0571","","","0.1631","0.2103","","","","","","1.052","","","","has coordinates","188255","2020-10-21","18:00:00",""
"7055787","12.632","0.016","15.5","0.02","19.61","0.03","79.27","0.02","85.87","0.02","81.4","0.02","3726","9","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H77 Cl3 N8 Pd2 -","- C61 H77 Cl3 N8 Pd2 -","- C122 H154 Cl6 N16 Pd4 -","2","1","","Yang, Jin","Mono- and dinuclear palladium(ii) complexes containing both N-heterocyclic carbenes and tetrazole ligands as catalysts for Hiyama coupling","New J. Chem.","2016","40","11","9739","","10.1039/C6NJ02320G","","","0.71073","MoKα","","0.1633","0.0734","","","0.1225","0.1359","","","","","","1.021","","","","has coordinates,has disorder","188255","2020-10-21","18:00:00",""
"7055788","12.7041","0.0018","15.216","0.002","19.059","0.003","80.336","0.002","84.728","0.002","81.324","0.002","3582","0.9","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C125 H168 Cl12 N16 Pd4 -","- C125 H168 Cl12 N16 Pd4 -","- C125 H168 Cl12 N16 Pd4 -","1","0.5","","Yang, Jin","Mono- and dinuclear palladium(ii) complexes containing both N-heterocyclic carbenes and tetrazole ligands as catalysts for Hiyama coupling","New J. Chem.","2016","40","11","9739","","10.1039/C6NJ02320G","","","0.71073","MoKα","","0.0469","0.0365","","","0.096","0.1062","","","","","","1.036","","","","has coordinates,has disorder","188255","2020-10-21","18:00:00",""
"7055789","9.025","0.004","9.025","0.004","10.2","0.004","90","","90","","90","","830.8","0.6","293","2","293","2","","","","","","","","4","P 41","P 4w","76","","","","- C6 H9 N3 O2 -","- C6 H9 N3 O2 -","- C24 H36 N12 O8 -","4","1","","Dîrtu, Marinela M.; Adarsh, N. N.; Naik, Anil D.; Robeyns, Koen; Garcia, Yann","Supramolecular homochiral helicity and zigzag hydrogen bonded chains in 1,2,4-triazole derived aminoester and aminoacid","New J. Chem.","2016","40","11","9025","","10.1039/C6NJ01687A","","","0.71069","MoKα","","0.0357","0.0317","","","0.082","0.0854","","","","","","1.096","","","","has coordinates,has disorder","188257","2020-10-21","18:00:00",""
"7055790","9.7498","0.0005","10.711","0.0004","12.7361","0.0006","90","","90","","90","","1330.03","0.11","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C5 H7 N3 O2 -","- C5 H7 N3 O2 -","- C40 H56 N24 O16 -","8","2","","Dîrtu, Marinela M.; Adarsh, N. N.; Naik, Anil D.; Robeyns, Koen; Garcia, Yann","Supramolecular homochiral helicity and zigzag hydrogen bonded chains in 1,2,4-triazole derived aminoester and aminoacid","New J. Chem.","2016","40","11","9025","","10.1039/C6NJ01687A","","","0.71073","MoKα","","0.0529","0.0438","","","0.0981","0.1038","","","","","","1.089","","","","has coordinates,has disorder","188257","2020-10-21","18:00:00",""
"7055791","14.9452","0.0005","18.7424","0.0006","18.6507","0.0005","90","","107.16","0.001","90","","4991.7","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ti3","","- C42 H64 N2 O7 Ti2 -","- C42 H64 N2 O7 Ti2 -","- C168 H256 N8 O28 Ti8 -","4","1","","Mandal, Mrinmay; Monkowius, Uwe; Chakraborty, Debashis","Synthesis and structural characterization of titanium and zirconium complexes containing half-salen ligands as catalysts for polymerization reactions","New J. Chem.","2016","","","","","10.1039/C6NJ02148D","","","0.71073","MoKα","","0.0705","0.0459","","","0.1243","0.1347","","","","","","1.029","","","","has coordinates","186873","2020-10-21","18:00:00",""
"7055792","10.3126","0.0003","12.8248","0.0005","12.9776","0.0004","63.2283","0.0019","68.1217","0.0013","66.2981","0.0014","1364.07","0.08","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Ti2","","- C26 H26 Cl4 N2 O4 Ti -","- C26 H26 Cl4 N2 O4 Ti -","- C52 H52 Cl8 N4 O8 Ti2 -","2","1","","Mandal, Mrinmay; Monkowius, Uwe; Chakraborty, Debashis","Synthesis and structural characterization of titanium and zirconium complexes containing half-salen ligands as catalysts for polymerization reactions","New J. Chem.","2016","","","","","10.1039/C6NJ02148D","","","0.71073","MoKα","","0.0439","0.0336","","","0.0776","0.0831","","","","","","1.032","","","","has coordinates","186873","2020-10-21","18:00:00",""
"7055793","14.4864","0.0009","17.4311","0.0013","16.5711","0.0016","90","","104.72","0.003","90","","4047.1","0.6","296","2","296","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Ti1","","- C36 H50 N2 O4 Ti -","- C36 H50 N2 O4 Ti -","- C144 H200 N8 O16 Ti4 -","4","0.5","","Mandal, Mrinmay; Monkowius, Uwe; Chakraborty, Debashis","Synthesis and structural characterization of titanium and zirconium complexes containing half-salen ligands as catalysts for polymerization reactions","New J. Chem.","2016","","","","","10.1039/C6NJ02148D","","","0.71073","MoKα","","0.0626","0.0451","","","0.1357","0.1426","","","","","","1.103","","","","has coordinates","186873","2020-10-21","18:00:00",""
"7055794","20.5673","0.0008","13.9216","0.0005","29.0288","0.001","90","","108.378","0.001","90","","7887.9","0.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Zr1","","- C72 H100 N4 O8 Zr2 -","- C72 H100 N4 O8 Zr2 -","- C288 H400 N16 O32 Zr8 -","4","1","","Mandal, Mrinmay; Monkowius, Uwe; Chakraborty, Debashis","Synthesis and structural characterization of titanium and zirconium complexes containing half-salen ligands as catalysts for polymerization reactions","New J. Chem.","2016","","","","","10.1039/C6NJ02148D","","","0.71073","MoKα","","0.0542","0.0402","","","0.1089","0.1153","","","","","","1.016","","","","has coordinates","186873","2020-10-21","18:00:00",""
"7055795","6.4177","0.0002","12.5899","0.0005","16.6644","0.0007","90","","90","","90","","1346.45","0.09","150","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H9 N O S4 -","- C12 H9 N O S4 -","- C48 H36 N4 O4 S16 -","4","1","","Le Gal, Yann; Ameline, Dorine; Vacher, Antoine; Roisnel, Thierry; Dorcet, Vincent; Lorcy, Dominique","Chiral 1,2-dithiine as a sulfur rich electron acceptor","New J. Chem.","2016","40","12","9930","","10.1039/C6NJ02292H","","x-ray","0.71073","MoKα","","0.0226","0.0214","","","0.0521","0.0527","","","","","","1.061","","","","has coordinates","190228","2020-10-21","18:00:00",""
"7055796","6.3994","0.0014","12.57","0.003","16.622","0.004","90","","90","","90","","1337.1","0.5","150","2","150","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H9 N O S4 -","- C12 H9 N O S4 -","- C48 H36 N4 O4 S16 -","4","1","","Le Gal, Yann; Ameline, Dorine; Vacher, Antoine; Roisnel, Thierry; Dorcet, Vincent; Lorcy, Dominique","Chiral 1,2-dithiine as a sulfur rich electron acceptor","New J. Chem.","2016","40","12","9930","","10.1039/C6NJ02292H","","x-ray","0.71073","MoKα","","0.032","0.0302","","","0.0714","0.0726","","","","","","1.045","","","","has coordinates","190228","2020-10-21","18:00:00",""
"7055797","8.4457","0.0006","15.309","0.0012","23.682","0.002","90","","90","","90","","3062","0.4","150","2","150","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H18 N2 S14 -","- C22 H18 N2 S14 -","- C88 H72 N8 S56 -","4","1","","Le Gal, Yann; Ameline, Dorine; Vacher, Antoine; Roisnel, Thierry; Dorcet, Vincent; Lorcy, Dominique","Chiral 1,2-dithiine as a sulfur rich electron acceptor","New J. Chem.","2016","40","12","9930","","10.1039/C6NJ02292H","","x-ray","0.71073","MoKα","","0.0581","0.0454","","","0.0892","0.0944","","","","","","1.077","","","","has coordinates","190228","2020-10-21","18:00:00",""
"7055798","8.4463","0.0002","15.31","0.0004","23.6692","0.0007","90","","90","","90","","3060.73","0.14","150","2","150","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H18 N2 S14 -","- C22 H18 N2 S14 -","- C88 H72 N8 S56 -","4","1","","Le Gal, Yann; Ameline, Dorine; Vacher, Antoine; Roisnel, Thierry; Dorcet, Vincent; Lorcy, Dominique","Chiral 1,2-dithiine as a sulfur rich electron acceptor","New J. Chem.","2016","40","12","9930","","10.1039/C6NJ02292H","","x-ray","0.71073","MoKα","","0.0358","0.0302","","","0.0631","0.0651","","","","","","1.025","","","","has coordinates","190228","2020-10-21","18:00:00",""
"7055799","7.5555","0.0002","9.9153","0.0003","11.7151","0.0003","102.312","0.002","108.492","0.003","102.9","0.003","772.07","0.04","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H26 Cu2 N6 O12 -","- C26 H26 Cu2 N6 O12 -","- C26 H26 Cu2 N6 O12 -","1","0.5","","Martins, Nuno M. R.; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.","Copper(ii) and iron(iii) complexes with arylhydrazone of ethyl 2-cyanoacetate or formazan ligands as catalysts for oxidation of alcohols","New J. Chem.","2016","40","12","10071","","10.1039/C6NJ02161A","","","0.71073","MoKα","","0.0453","0.0349","","","0.0883","0.0936","","","","","","1.122","","","","has coordinates","190231","2020-10-21","18:00:00",""
"7055800","8.3116","0.0005","10.4327","0.0008","10.7676","0.0008","105.623","0.004","92.203","0.004","109.315","0.003","840.18","0.11","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H16 Cu N4 O6 -","- C15 H16 Cu N4 O6 -","- C30 H32 Cu2 N8 O12 -","2","1","","Martins, Nuno M. R.; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.","Copper(ii) and iron(iii) complexes with arylhydrazone of ethyl 2-cyanoacetate or formazan ligands as catalysts for oxidation of alcohols","New J. Chem.","2016","40","12","10071","","10.1039/C6NJ02161A","","","0.71073","MoKα","","0.0831","0.0494","","","0.1026","0.1194","","","","","","1.148","","","","has coordinates","190231","2020-10-21","18:00:00",""
"7055801","30.61","0.003","6.93","0.0006","23.4642","0.0019","90","","103.391","0.003","90","","4842.1","0.7","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H31 Cu N7 O7 -","- C17 H31 Cu N7 O7 -","- C136 H248 Cu8 N56 O56 -","8","1","","Martins, Nuno M. R.; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.","Copper(ii) and iron(iii) complexes with arylhydrazone of ethyl 2-cyanoacetate or formazan ligands as catalysts for oxidation of alcohols","New J. Chem.","2016","40","12","10071","","10.1039/C6NJ02161A","","","0.71069","MoKα","","0.0643","0.0412","","","0.0866","0.0931","","","","","","0.996","","","","has coordinates","190231","2020-10-21","18:00:00",""
"7055802","13.9488","0.0013","9.8504","0.001","15.1432","0.0015","90","","112.754","0.003","90","","1918.8","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 Fe N22 -","- C12 H7 Fe N22 -","- C48 H28 Fe4 N88 -","4","1","","Martins, Nuno M. R.; Mahmudov, Kamran T.; Guedes da Silva, M. Fátima C.; Martins, Luísa M. D. R. S.; Pombeiro, Armando J. L.","Copper(ii) and iron(iii) complexes with arylhydrazone of ethyl 2-cyanoacetate or formazan ligands as catalysts for oxidation of alcohols","New J. Chem.","2016","40","12","10071","","10.1039/C6NJ02161A","","","0.71069","MoKα","","0.1112","0.0592","","","0.1359","0.1555","","","","","","1.011","","","","has coordinates","190231","2020-10-21","18:00:00",""
"7055803","8.1872","0.0006","16.9482","0.0013","11.7093","0.0009","90","","101.284","0.004","90","","1593.4","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H38 Cu3 N4 O16 -","- C26 H38 Cu3 N4 O16 -","- C52 H76 Cu6 N8 O32 -","2","0.5","","Ansari, Istikhar A.; Sama, Farasha; Raizada, Mukul; Shahid, M.; Ahmad, Musheer; Siddiqi, Zafar A.","Structurally well-characterized new multinuclear Cu(II) and Zn(II) clusters: X-ray crystallography, theoretical studies, and applications in catalysis","New J. Chem.","2016","","","","","10.1039/C6NJ02150F","","","0.71073","MoKα","","0.0417","0.031","","","0.0791","0.0843","","","","","","1.035","","","","has coordinates","186924","2020-10-21","18:00:00",""
"7055804","14.49","0.04","11.44","0.03","18.17","0.05","90","","109.49","0.05","90","","2839","13","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H31 N O10 Zn2 -","- C27 H31 N O10 Zn2 -","- C108 H124 N4 O40 Zn8 -","4","1","","Ansari, Istikhar A.; Sama, Farasha; Raizada, Mukul; Shahid, M.; Ahmad, Musheer; Siddiqi, Zafar A.","Structurally well-characterized new multinuclear Cu(II) and Zn(II) clusters: X-ray crystallography, theoretical studies, and applications in catalysis","New J. Chem.","2016","","","","","10.1039/C6NJ02150F","","","0.71073","MoKα","","0.0791","0.0407","","","0.0785","0.0898","","","","","","1.039","","","","has coordinates","186924","2020-10-21","18:00:00",""
"7055805","8.9621","0.0012","10.9006","0.0015","17.225","0.002","90","","97.285","0.002","90","","1669.2","0.4","293","2","293","2","","","","","","","","8","P 1 2/c 1","-P 2yc","13","","dichloro(1,5-bis(p-tolyl)-3,7-bis(pyridine-2-yl)-1,5-diaza-3,7-diphosphacyclooctane)gold(I) dimethylsulfoxyde solvate","","- C60 H72 Au4 Cl4 N8 O2 P4 S2 -","- C60 H72 Au4 Cl4 N8 O2 P4 S2 -","- C60 H72 Au4 Cl4 N8 O2 P4 S2 -","1","0.25","","Shamsutdinova, Nataliya; Strelnik, Igor D.; Musina, Elvira I.; Gerasimova, Tatiana; Katsyuba, Sergey; Babaev, Vasily; Krivolapov, Dmitry; Litvinov, Igor; Mustafina, Asiya; Karasik, Andrey A.; Sinyashin, Oleg Geroldovich","“Host-guest” binding of luminescent dinuclear Au(I) complex based on cyclic diphosphine with organic substrates as a reason for luminescence tuneability","New J. Chem.","2016","","","","","10.1039/C6NJ02277D","","","0.71073","MoKα","","0.0461","0.0353","","","0.0867","0.0918","","","","","","1.076","","","","has coordinates,has disorder","186925","2020-10-21","18:00:00",""
"7055806","20.27","0.012","18.845","0.011","20.136","0.012","90","","119.588","0.006","90","","6689","7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","dichloro(1,5-bis(p-tolyl)-3,7-bis(pyridine-2-yl)-1,5-diaza-3,7- diphosphacyclooctane)gold(I) acetonitrile solvate","","- C30 H33 Au2 Cl2 N5 P2 -","- C30 H33 Au2 Cl2 N5 P2 -","- C240 H264 Au16 Cl16 N40 P16 -","8","1","","Shamsutdinova, Nataliya; Strelnik, Igor D.; Musina, Elvira I.; Gerasimova, Tatiana; Katsyuba, Sergey; Babaev, Vasily; Krivolapov, Dmitry; Litvinov, Igor; Mustafina, Asiya; Karasik, Andrey A.; Sinyashin, Oleg Geroldovich","“Host-guest” binding of luminescent dinuclear Au(I) complex based on cyclic diphosphine with organic substrates as a reason for luminescence tuneability","New J. Chem.","2016","","","","","10.1039/C6NJ02277D","","","0.71073","MoKα","","0.105","0.065","","","0.1623","0.2032","","","","","","1.039","","","","has coordinates","186925","2020-10-21","18:00:00",""
"7055807","20.506","0.003","12.2936","0.0017","16.937","0.002","90","","105.973","0.004","90","","4104.8","1","296","2","296","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","copper(I) thiocyanate complex of tris(2pyridyl)phosphine oxide","","- C17 H14 Cl2 Cu N4 O P S -","- C17 H14 Cl2 Cu N4 O P S -","- C136 H112 Cl16 Cu8 N32 O8 P8 S8 -","8","1","","Artem’ev, Alexander V.; Doronina, Evgeniya P.; Rakhmanova, Marianna I.; Sutyrina, Anastasiya O.; Bagryanskaya, Irina Yu.; Tolstoy, Peter M.; Gushchin, Artem L.; Mazur, Anton S.; Gusarova, Nina K.; Trofimov, Boris A.","Luminescent CuI thiocyanate complexes based on tris(2-pyridyl)phosphine and its oxide: from mono-, di- and trinuclear species to coordination polymers","New J. Chem.","2016","40","12","10028","","10.1039/C6NJ02087A","","","0.71073","MoKα","","0.064","0.0408","","","0.1003","0.1143","","","","","","1.023","","","","has coordinates","190238","2020-10-21","18:00:00",""
"7055808","8.3784","0.0008","9.0242","0.0008","13.1937","0.0011","71.147","0.003","78.454","0.003","65.128","0.003","854.08","0.13","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","copper(I) thiocyanate complex of tris(2pyridyl)phosphine oxide","","- C32 H24 Cu2 N8 O2 P2 S2 -","- C32 H24 Cu2 N8 O2 P2 S2 -","- C32 H24 Cu2 N8 O2 P2 S2 -","1","0.5","","Artem’ev, Alexander V.; Doronina, Evgeniya P.; Rakhmanova, Marianna I.; Sutyrina, Anastasiya O.; Bagryanskaya, Irina Yu.; Tolstoy, Peter M.; Gushchin, Artem L.; Mazur, Anton S.; Gusarova, Nina K.; Trofimov, Boris A.","Luminescent CuI thiocyanate complexes based on tris(2-pyridyl)phosphine and its oxide: from mono-, di- and trinuclear species to coordination polymers","New J. Chem.","2016","40","12","10028","","10.1039/C6NJ02087A","","","0.71073","MoKα","","0.1003","0.0921","","","0.3304","0.334","","","","","","1.21","","","","has coordinates","190238","2020-10-21","18:00:00",""
"7055809","25.1513","0.0011","8.2531","0.0004","33.3853","0.0015","90","","109.333","0.001","90","","6539.2","0.5","296","2","296","2","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","copper(I) thiocyanate complex of tris(2pyridyl)phosphine oxide","","- C64 H48 Cu4 N16 O4 P4 S4 -","- C64 H48 Cu4 N16 O4 P4 S4 -","- C256 H192 Cu16 N64 O16 P16 S16 -","4","1","","Artem’ev, Alexander V.; Doronina, Evgeniya P.; Rakhmanova, Marianna I.; Sutyrina, Anastasiya O.; Bagryanskaya, Irina Yu.; Tolstoy, Peter M.; Gushchin, Artem L.; Mazur, Anton S.; Gusarova, Nina K.; Trofimov, Boris A.","Luminescent CuI thiocyanate complexes based on tris(2-pyridyl)phosphine and its oxide: from mono-, di- and trinuclear species to coordination polymers","New J. Chem.","2016","40","12","10028","","10.1039/C6NJ02087A","","","0.71073","MoKα","","0.0548","0.0375","","","0.0751","0.0806","","","","","","1.061","","","","has coordinates","190238","2020-10-21","18:00:00",""
"7055810","11.9247","0.0006","10.7519","0.0004","18.7122","0.0007","90","","97.86","0.002","90","","2376.61","0.17","296","2","296","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","Complex of copper(II) thiocyanate with tris(2-pyridyl)phosphine oxide","","- C18 H13 Cl3 Cu N5 O P S2 -","- C18 H13 Cl3 Cu N5 O P S2 -","- C72 H52 Cl12 Cu4 N20 O4 P4 S8 -","4","1","","Artem’ev, Alexander V.; Doronina, Evgeniya P.; Rakhmanova, Marianna I.; Sutyrina, Anastasiya O.; Bagryanskaya, Irina Yu.; Tolstoy, Peter M.; Gushchin, Artem L.; Mazur, Anton S.; Gusarova, Nina K.; Trofimov, Boris A.","Luminescent CuI thiocyanate complexes based on tris(2-pyridyl)phosphine and its oxide: from mono-, di- and trinuclear species to coordination polymers","New J. Chem.","2016","40","12","10028","","10.1039/C6NJ02087A","","","0.71073","MoKα","","0.0583","0.0505","","","0.1383","0.1474","","","","","","1.058","","","","has coordinates","190238","2020-10-21","18:00:00",""
"7055811","11.8672","0.0007","12.4871","0.0007","18.232","0.0011","84.626","0.002","89.461","0.002","62.746","0.002","2389.5","0.2","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","Solvate complex of copper(I) thiocyanate with tris(2-pyridyl)phosphine oxide with chloroform","","- C34 H25 Cl3 Cu3 N9 O2 P2 S3 -","- C34 H25 Cl3 Cu3 N9 O2 P2 S3 -","- C68 H50 Cl6 Cu6 N18 O4 P4 S6 -","2","1","","Artem’ev, Alexander V.; Doronina, Evgeniya P.; Rakhmanova, Marianna I.; Sutyrina, Anastasiya O.; Bagryanskaya, Irina Yu.; Tolstoy, Peter M.; Gushchin, Artem L.; Mazur, Anton S.; Gusarova, Nina K.; Trofimov, Boris A.","Luminescent CuI thiocyanate complexes based on tris(2-pyridyl)phosphine and its oxide: from mono-, di- and trinuclear species to coordination polymers","New J. Chem.","2016","40","12","10028","","10.1039/C6NJ02087A","","","0.71073","MoKα","","0.0515","0.0389","","","0.0933","0.1053","","","","","","1.032","","","","has coordinates","190238","2020-10-21","18:00:00",""
"7055812","12.9246","0.0018","10.0302","0.0015","8.6402","0.0012","90","","106.913","0.003","90","","1071.6","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 N8 O20 -","- C12 H6 N8 O20 -","- C24 H12 N16 O40 -","2","0.5","","Xu, Zhen; Yang, Hongwei; Cheng, Guangbin","Studies on the synthesis and properties of polynitro compounds based on esteryl backbones","New J. Chem.","2016","40","12","9936","","10.1039/C6NJ02198K","","","0.71073","MoKα","","0.0619","0.0426","","","0.0872","0.0955","","","","","","1.043","","","","has coordinates","190232","2020-10-21","18:00:00",""
"7055813","14.3744","0.0016","8.2651","0.001","19.305","0.002","90","","111.692","0.003","90","","2131.1","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H6 N8 O20 -","- C12 H6 N8 O20 -","- C48 H24 N32 O80 -","4","1","","Xu, Zhen; Yang, Hongwei; Cheng, Guangbin","Studies on the synthesis and properties of polynitro compounds based on esteryl backbones","New J. Chem.","2016","40","12","9936","","10.1039/C6NJ02198K","","","0.71073","MoKα","","0.0799","0.038","","","0.0657","0.0759","","","","","","1.027","","","","has coordinates,has disorder","190232","2020-10-21","18:00:00",""
"7055814","13.8583","0.001","16.6279","0.0013","10.0771","0.0006","90","","103.879","0.002","90","","2254.3","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H5 N9 O22 -","- C12 H5 N9 O22 -","- C48 H20 N36 O88 -","4","1","","Xu, Zhen; Yang, Hongwei; Cheng, Guangbin","Studies on the synthesis and properties of polynitro compounds based on esteryl backbones","New J. Chem.","2016","40","12","9936","","10.1039/C6NJ02198K","","","0.71073","MoKα","","0.0816","0.0398","","","0.0724","0.0847","","","","","","1.041","","","","has coordinates","190232","2020-10-21","18:00:00",""
"7055815","5.8335","0.0004","10.1818","0.0008","25.563","0.002","90","","96.54","0.003","90","","1508.4","0.2","172","2","172","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H4 N6 O14 -","- C9 H4 N6 O14 -","- C36 H16 N24 O56 -","4","1","","Xu, Zhen; Yang, Hongwei; Cheng, Guangbin","Studies on the synthesis and properties of polynitro compounds based on esteryl backbones","New J. Chem.","2016","40","12","9936","","10.1039/C6NJ02198K","","","0.71073","MoKα","","0.068","0.0362","","","0.0752","0.0866","","","","","","1.026","","","","has coordinates","190232","2020-10-21","18:00:00",""
"7055816","13.0771","0.0007","14.1413","0.0007","22.4997","0.0009","94.2851","0.0011","103.247","0.001","102.563","0.0012","3919","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H77 N11 O51 Pb2 Si W12 -","- C33 H77 N11 O51 Pb2 Si W12 -","- C66 H154 N22 O102 Pb4 Si2 W24 -","2","1","","Udalova, Liubov I.; Adonin, Sergey A.; Abramov, Pavel A.; Korolkov, Ilya V.; Yunoshev, Alexander S.; Plyusnin, Pavel E.; Sokolov, Maxim N.","Complexes of non-lacunary Keggin- and Dawson-type polyoxometalates with Pb(ii): formation of 1D coordination polymers with different bonding modes","New J. Chem.","2016","40","12","9981","","10.1039/C6NJ02155G","","x-ray","0.71073","MoKα","","0.0684","0.043","","","0.0777","0.0861","","","","","","0.994","","","","has coordinates","190240","2020-10-21","18:00:00",""
"7055817","27.4927","0.0006","17.8801","0.0006","25.0895","0.0006","90","","90","","90","","12333.3","0.6","130","2","130","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C43.5 H104.1 N14.5 O77.8 P2 Pb3 W18 -","- C43.5 H72.5 N14.5 O77.8 P2 Pb3 W18 -","- C174 H290 N58 O311.2 P8 Pb12 W72 -","4","0.5","","Udalova, Liubov I.; Adonin, Sergey A.; Abramov, Pavel A.; Korolkov, Ilya V.; Yunoshev, Alexander S.; Plyusnin, Pavel E.; Sokolov, Maxim N.","Complexes of non-lacunary Keggin- and Dawson-type polyoxometalates with Pb(ii): formation of 1D coordination polymers with different bonding modes","New J. Chem.","2016","40","12","9981","","10.1039/C6NJ02155G","","x-ray","0.71073","MoKα","","0.068","0.0475","","","0.0999","0.1102","","","","","","1.102","","","","has coordinates,has disorder","190240","2020-10-21","18:00:00",""
"7055818","11.4597","0.0002","29.072","0.0005","16.6209","0.0003","90","","93.7884","0.0007","90","","5525.26","0.17","123","","123","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2,3-bis(5-methyl-2-phenylthiazol-4-yl)-1-phenylphosphindole 1-oxide","","- C34 H25 N2 O P S2 -","- C34 H25 N2 O P S2 -","- C272 H200 N16 O8 P8 S16 -","8","2","","Iijima, Shunsuke; Nakashima, Takuya; Kawai, Tsuyoshi","Stereoselective photoreaction in P-stereogenic dithiazolylbenzo[b]phosphole chalcogenides","New J. Chem.","2016","40","12","10048","","10.1039/C6NJ02446G","","","0.71075","MoKα","","0.0528","0.0395","","","0.0942","0.0997","","","","","","1.047","","","","has coordinates","190241","2020-10-21","18:00:00",""
"7055819","10.0101","0.0002","11.0471","0.0002","14.5019","0.0003","86.1262","0.0007","83.4645","0.0007","81.545","0.0007","1573.81","0.05","123","","123","","","","","","","","","5","P -1","-P 1","2","","2,3-bis(5-methyl-2-phenylthiazol-4-yl)-1-phenylphosphindole 1-sulfide","","- C36 H28 N3 P S3 -","- C36 H28 N3 P S3 -","- C72 H56 N6 P2 S6 -","2","1","","Iijima, Shunsuke; Nakashima, Takuya; Kawai, Tsuyoshi","Stereoselective photoreaction in P-stereogenic dithiazolylbenzo[b]phosphole chalcogenides","New J. Chem.","2016","40","12","10048","","10.1039/C6NJ02446G","","","0.71075","MoKα","","0.0456","0.0374","","","0.0959","0.1026","","","","","","1.09","","","","has coordinates","190241","2020-10-21","18:00:00",""
"7055820","7.6364","0.0004","11.093","0.0006","12.7629","0.0006","95.949","0.003","91","0.003","99.504","0.003","1059.91","0.09","100","2","100","2","","","","","","","","6","P -1","-P 1","2","DDJS-43","","","- C20 H16 Cl2 Cu N4 O -","- C20 H16 Cl2 Cu N4 O -","- C40 H32 Cl4 Cu2 N8 O2 -","2","1","","Adhikari, Sangita; Lohar, Sisir; Kumari, Babli; Banerjee, Aparna; Bandopadhyay, Rajib; Matalobos, Jesús Sanmartín; Das, Debasis","Cu(ii) complex of a new isoindole derivative: structure, catecholase like activity, antimicrobial properties and bio-molecular interactions","New J. Chem.","2016","40","12","10094","","10.1039/C6NJ02193J","","x-ray","0.71073","MoKα","","0.0465","0.0393","","","0.0969","0.0997","","","","","","1.06","","","","has coordinates","211179","2020-10-21","18:00:00",""
"7055821","11.4372","0.0006","19.3","0.001","20.3261","0.0011","90","","90","","90","","4486.7","0.4","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C15 H16 Bi Br5 N4 O -","- C15 H16 Bi Br5 N4 O -","- C120 H128 Bi8 Br40 N32 O8 -","8","1","","Kotov, Vitalii Yu.; Ilyukhin, Andrey B.; Birin, Kirill P.; Laurinavichyute, Veronika K.; Sadovnikov, Alexey A.; Dobrokhotova, Zhanna V.; Kozyukhin, Sergey A.","A hybrid halobismuthate light-harvesting material with an optical band gap of 1.70 eV","New J. Chem.","2016","40","12","10041","","10.1039/C6NJ02333A","","","0.71073","MoKα","","0.0635","0.0371","","","0.0803","0.0895","","","","","","1.044","","","","has coordinates","190234","2020-10-21","18:00:00",""
"7055822","12.754","0.005","12.754","0.005","13.787","0.006","90","","90","","90","","2242.7","1.6","293","2","293","2","","","","","","","","3","P 4/n","-P 4a","85","","p-t-butylcalix[4]arene","","- C51 H64 O4 -","- C51 H64 O4 -","- C102 H128 O8 -","2","","","Senthan, Selvam Amudhan; Alexander, Vedamanickam","Synthesis, luminescence, and electrochemical studies of tetra- and octanuclear ruthenium(ii) complexes of tolylterpyridine appended calixarenes","New J. Chem.","2016","40","12","10064","","10.1039/C6NJ02564A","","","0.71073","MoKα","","0.0755","0.05","","","0.1381","0.1722","","","","","","1.103","","","","has coordinates,has disorder","190242","2020-10-21","18:00:00",""
"7055823","7.817","0.00019","13.0929","0.0004","30.6293","0.0009","90","","90","","90","","3134.82","0.15","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C28 H30 I2 N6 O6 Zn -","- C28 H30 I2 N6 O6 Zn -","- C112 H120 I8 N24 O24 Zn4 -","4","0.5","","Mahmoudi, Ghodrat; Afkhami, Farhad Akbari; Jena, Himanshu Sekhar; Nematollahi, Parisa; Esrafili, Mehdi D.; Garczarek, Piotr; Van Hecke, Kristof; Servati Gargari, Masoumeh; Kirillov, Alexander M.","Halide ion-driven self-assembly of Zn(ii) compounds derived from an asymmetrical hydrazone building block: a combined experimental and theoretical study","New J. Chem.","2016","40","12","10116","","10.1039/C6NJ01534D","","","1.5418","CuKα","","0.0533","0.0382","","","0.0909","0.1007","","","","","","1.024","","","","has coordinates","190229","2020-10-21","18:00:00",""
"7055824","7.67182","0.00017","12.9965","0.0003","30.545","0.0008","90","","90","","90","","3045.54","0.13","122","30","122","30","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C28 H30 Br2 N6 O6 Zn -","- C28 H30 Br2 N6 O6 Zn -","- C112 H120 Br8 N24 O24 Zn4 -","4","0.5","","Mahmoudi, Ghodrat; Afkhami, Farhad Akbari; Jena, Himanshu Sekhar; Nematollahi, Parisa; Esrafili, Mehdi D.; Garczarek, Piotr; Van Hecke, Kristof; Servati Gargari, Masoumeh; Kirillov, Alexander M.","Halide ion-driven self-assembly of Zn(ii) compounds derived from an asymmetrical hydrazone building block: a combined experimental and theoretical study","New J. Chem.","2016","40","12","10116","","10.1039/C6NJ01534D","","","1.5418","CuKα","","0.0423","0.0294","","","0.0667","0.0726","","","","","","1.026","","","","has coordinates","190229","2020-10-21","18:00:00",""
"7055825","22.0619","0.0006","22.0619","0.0006","7.3434","0.0004","90","","90","","90","","3574.2","0.2","293","2","293.15","","","","","","","","","6","I 4/m","-I 4","87","","","","- C56 H60 Cl8 N12 O12 Zn4 -","- C52 H44 Cl8 N12 O8 Zn4 -","- C104 H88 Cl16 N24 O16 Zn8 -","2","0.125","","Mahmoudi, Ghodrat; Afkhami, Farhad Akbari; Jena, Himanshu Sekhar; Nematollahi, Parisa; Esrafili, Mehdi D.; Garczarek, Piotr; Van Hecke, Kristof; Servati Gargari, Masoumeh; Kirillov, Alexander M.","Halide ion-driven self-assembly of Zn(ii) compounds derived from an asymmetrical hydrazone building block: a combined experimental and theoretical study","New J. Chem.","2016","40","12","10116","","10.1039/C6NJ01534D","","","1.5418","CuKα","","0.0397","0.0321","","","0.0848","0.0884","","","","","","1.074","","","","has coordinates","190229","2020-10-21","18:00:00",""
"7055826","21.5463","0.0013","8.3435","0.0005","25.3092","0.0015","90","","107.29","0.002","90","","4344.3","0.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H18 N4 O3 V -","- C26 H18 N4 O3 V -","- C208 H144 N32 O24 V8 -","8","1","","Shit, Madhusudan; Maity, Suvendu; Bera, Sachinath; Weyhermüller, Thomas; Ghosh, Prasanta","Coordination of o-benzosemiquinonate, o-iminobenzosemiquinonate, 4,4′-di-tert-butyl-2,2′-bipyridine and 1,10-phenanthroline anion radicals to oxidovanadium(iv)","New J. Chem.","2016","40","12","10305","","10.1039/C6NJ02220K","","","0.71073","MoKα","","0.1071","0.0857","","","0.1745","0.1845","","","","","","1.242","","","","has coordinates","190237","2020-10-21","18:00:00",""
"7055827","13.8584","0.0005","16.1145","0.0006","22.9607","0.0009","90","","90","","90","","5127.6","0.3","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H18 N5 O5 V -","- C25 H18 N5 O5 V -","- C200 H144 N40 O40 V8 -","8","2","","Shit, Madhusudan; Maity, Suvendu; Bera, Sachinath; Weyhermüller, Thomas; Ghosh, Prasanta","Coordination of o-benzosemiquinonate, o-iminobenzosemiquinonate, 4,4′-di-tert-butyl-2,2′-bipyridine and 1,10-phenanthroline anion radicals to oxidovanadium(iv)","New J. Chem.","2016","40","12","10305","","10.1039/C6NJ02220K","","","0.71073","MoKα","","0.0594","0.0403","","","0.0859","0.0954","","","","","","1.037","","","","has coordinates,has disorder","190237","2020-10-21","18:00:00",""
"7055828","11.1788","0.0005","18.332","0.0009","17.6872","0.0008","90","","107.635","0.002","90","","3454.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H33 N2 O5 V -","- C32 H33 N2 O5 V -","- C128 H132 N8 O20 V4 -","4","1","","Shit, Madhusudan; Maity, Suvendu; Bera, Sachinath; Weyhermüller, Thomas; Ghosh, Prasanta","Coordination of o-benzosemiquinonate, o-iminobenzosemiquinonate, 4,4′-di-tert-butyl-2,2′-bipyridine and 1,10-phenanthroline anion radicals to oxidovanadium(iv)","New J. Chem.","2016","40","12","10305","","10.1039/C6NJ02220K","","","0.71073","MoKα","","0.0825","0.0637","","","0.1727","0.1984","","","","","","1.033","","","","has coordinates,has disorder","190237","2020-10-21","18:00:00",""
"7055829","11.9632","0.0004","12.8382","0.0004","18.2364","0.0006","90","","108.636","0.002","90","","2654","0.15","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H28 Cl N3 O2 Ru -","- C27 H28 Cl N3 O2 Ru -","- C108 H112 Cl4 N12 O8 Ru4 -","4","1","","Mohamed Subarkhan, Mohamed Kasim; Ramesh, Rengan; Liu, Yu","Synthesis and molecular structure of arene ruthenium(ii) benzhydrazone complexes: impact of substitution at the chelating ligand and arene moiety on antiproliferative activity","New J. Chem.","2016","40","11","9813","","10.1039/C6NJ01936F","","","0.71073","MoKα","","0.1388","0.0577","","","0.1505","0.1839","","","","","","1.023","","","","has coordinates","188267","2020-10-21","18:00:00",""
"7055830","7.7924","0.0004","10.7114","0.0004","26.6417","0.0012","90","","91.178","0.002","90","","2223.25","0.17","296","2","296.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Cl N3 O3 Ru -","- C23 H22 Cl N3 O3 Ru -","- C92 H88 Cl4 N12 O12 Ru4 -","4","1","","Mohamed Subarkhan, Mohamed Kasim; Ramesh, Rengan; Liu, Yu","Synthesis and molecular structure of arene ruthenium(ii) benzhydrazone complexes: impact of substitution at the chelating ligand and arene moiety on antiproliferative activity","New J. Chem.","2016","40","11","9813","","10.1039/C6NJ01936F","","","0.71073","MoKα","","0.072","0.0495","","","0.1164","0.1285","","","","","","1.043","","","","has coordinates","188267","2020-10-21","18:00:00",""
"7055831","8.465","0.003","3.8075","0.001","13.823","0.004","90","","90","","90","","445.5","0.2","296","2","296","2","","","","","","","","3","P n m a","-P 2ac 2n","62","EuZrS3","","","- Eu S3 Zr -","- Eu S3 Zr -","- Eu4 S12 Zr4 -","4","0.5","","Guo, Sheng-Ping; Chi, Yang; Zou, Jian-Ping; Xue, Huai-Guo","Crystal and electronic structures, and photoluminescence and photocatalytic properties of α-EuZrS3","New J. Chem.","2016","40","12","10219","","10.1039/C6NJ02106A","","","0.71073","MoKα","","0.0184","0.0147","","","0.027","0.028","","","","","","1.022","","","","has coordinates","190250","2020-10-21","18:00:00",""
"7055832","12.478","0.002","14.351","0.002","21.722","0.003","90","","90","","90","","3889.8","1","100","2","100","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","Zr(L)(NMe2)2(NHMe2)","","- C42 H59 N5 Zr -","- C42 H59 N5 Zr -","- C168 H236 N20 Zr4 -","4","1","","Cimino, Alessandro; Moscatelli, Filippo; Ferretti, Francesco; Ragaini, Fabio; Germain, Stéphane; Hannedouche, Jérôme; Schulz, Emmanuelle; Luconi, Lapo; Rossin, Andrea; Giambastiani, Giuliano","Novel yttrium and zirconium catalysts featuring reduced Ar-BIANH2 ligands for olefin hydroamination (Ar-BIANH2 = bis-arylaminoacenaphthylene)","New J. Chem.","2016","40","12","10285","","10.1039/C6NJ02199A","","x-ray","1.5418","CuKα","","0.06","0.044","","","0.09","0.1191","","","","","","1.113","","","","has coordinates","190248","2020-10-21","18:00:00",""
"7055833","11.6748","0.0003","10.2522","0.0003","16.7835","0.0005","90","","103.528","0.001","90","","1953.12","0.1","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H16 Cl2 N6 -","- C22 H16 Cl2 N6 -","- C88 H64 Cl8 N24 -","4","1","","Gampe, D. M.; Schramm, S.; Kaufmann, M.; Görls, H.; Beckert, R.","N-Phenylfluorubine: one functional dye ‒ chromophor, fluorophor, electron-acceptor and more","New J. Chem.","2016","40","12","10100","","10.1039/C6NJ02544G","","","0.71073","MoKα","","0.0575","0.0448","","","0.0988","0.1055","","","","","","1.117","","","","has coordinates","190246","2020-10-21","18:00:00",""
"7055834","6.9338","0.0004","13.1529","0.0007","13.712","0.001","64.451","0.005","83.6","0.006","79.575","0.006","1108.84","0.13","298","2","298","2","","","","","","","","3","P -1","-P 1","2","AA132","","","- C30 H18 Br2 -","- C30 H18 Br2 -","- C60 H36 Br4 -","2","1","","Alameddine, Bassam; Anju, Rajamohanan Sobhana; Al-Sagheer, Fakhreia; Jenny, Titus A.","Tribenzopentaphene derivatives with lateral aromatic groups: the effect of the nature and position of substituents on emission properties","New J. Chem.","2016","40","12","10363","","10.1039/C6NJ02563C","","","0.71073","MoKα","","0.0475","0.0345","","","0.0933","0.1024","","","","","","0.946","","","","has coordinates","190230","2020-10-21","18:00:00",""
"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",""
"7055837","14.5946","0.0003","12.2931","0.0002","14.917","0.0003","90","","90","","90","","2676.3","0.09","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","cis-hydroxodichlorodipyridinenitrosylruthenium","","- C10 H11 Cl2 N3 O2 Ru -","- C10 H11 Cl2 N3 O2 Ru -","- C80 H88 Cl16 N24 O16 Ru8 -","8","1","","Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A.","Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)]","New J. Chem.","2016","40","12","10267","","10.1039/C6NJ02425D","","","0.71073","MoKα","","0.0345","0.0221","","","0.0508","0.0537","","","","","","1.067","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7055838","12.4068","0.0003","14.0336","0.0003","16.9426","0.0004","90","","90","","90","","2949.91","0.12","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","chloride dichloroaquadipyridinenitrosylruthenium","","- C10 H12 Cl3 N3 O2 Ru -","- C10 H12 Cl3 N3 O2 Ru -","- C80 H96 Cl24 N24 O16 Ru8 -","8","1","","Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A.","Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)]","New J. Chem.","2016","40","12","10267","","10.1039/C6NJ02425D","","","0.71073","MoKα","","0.0319","0.0234","","","0.0838","0.0941","","","","","","0.732","","","","has coordinates","190243","2020-10-21","18:00:00",""
"7055839","15.3824","0.0004","6.9222","0.0002","14.4655","0.0003","90","","117.818","0.001","90","","1362.28","0.06","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","cis-hydroxodichlorodipyridinenitrosylruthenium","","- C10 H11 Cl2 N3 O2 Ru -","- C10 H11 Cl2 N3 O2 Ru -","- C40 H44 Cl8 N12 O8 Ru4 -","4","1","","Makhinya, Alexander N.; Il’in, Maxim A.; Yamaletdinov, Ruslan D.; Korolkov, Ilya V.; Baidina, Iraida A.","Synthesis and crystal structure of nitrosoruthenium complexes cis-[Ru(NO)Py2Cl2(OH)] and cis-[Ru(NO)Py2Cl2(H2O)]Cl. Photoinduced transformations of cis-[Ru(NO)Py2Cl2(OH)]","New J. Chem.","2016","40","12","10267","","10.1039/C6NJ02425D","","","0.71073","MoKα","","0.0614","0.0313","","","0.0616","0.0673","","","","","","0.964","","","","has coordinates","190243","2020-10-21","18:00:00",""
"7055840","11.6485","0.0009","13.9161","0.001","11.8748","0.0008","90","","113.074","0.002","90","","1770.9","0.2","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C6 H30 Mo6 N3 Na2 O34.5 Te -","- C6 H15 Mo6 N3 Na2 O34.5 Te -","- C12 H30 Mo12 N6 Na4 O69 Te2 -","2","1","","Hou, Yujiao; An, Haiyan; Xu, Tieqi; Zhao, Sangen; Luo, Junhua","Chiral polyoxomolybdate-based hybrid compounds obtained by spontaneous resolution: syntheses, structures and non-linear optical properties","New J. Chem.","2016","40","12","10316","","10.1039/C6NJ02709A","","","0.71073","MoKα","","0.0203","0.0198","","","0.0526","0.0532","","","","","","1.026","","","","has coordinates","190245","2020-10-21","18:00:00",""
"7055841","11.6541","0.0002","13.9037","0.0003","11.8748","0.0003","90","","113.161","0.001","90","","1769.06","0.07","296","2","296","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C6 H30 Mo6 N3 Na2 O34.5 Te -","- C6 H15 Mo6 N3 Na2 O34.5 Te -","- C12 H30 Mo12 N6 Na4 O69 Te2 -","2","1","","Hou, Yujiao; An, Haiyan; Xu, Tieqi; Zhao, Sangen; Luo, Junhua","Chiral polyoxomolybdate-based hybrid compounds obtained by spontaneous resolution: syntheses, structures and non-linear optical properties","New J. Chem.","2016","40","12","10316","","10.1039/C6NJ02709A","","","0.71073","MoKα","","0.0246","0.024","","","0.0635","0.0642","","","","","","1.028","","","","has coordinates","190245","2020-10-21","18:00:00",""
"7055842","11.6276","0.0005","13.9826","0.0007","11.8503","0.0007","90","","113.215","0.002","90","","1770.67","0.16","296","2","296","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C6 H30 Mo6 N3 Na2 O34.5 Se -","- C6 H15 Mo6 N3 Na2 O34.5 Se -","- C12 H30 Mo12 N6 Na4 O69 Se2 -","2","1","","Hou, Yujiao; An, Haiyan; Xu, Tieqi; Zhao, Sangen; Luo, Junhua","Chiral polyoxomolybdate-based hybrid compounds obtained by spontaneous resolution: syntheses, structures and non-linear optical properties","New J. Chem.","2016","40","12","10316","","10.1039/C6NJ02709A","","","0.71073","MoKα","","0.0279","0.0275","","","0.0718","0.0722","","","","","","1.076","","","","has coordinates","190245","2020-10-21","18:00:00",""
"7055843","13.5784","0.0013","13.6097","0.001","19.0544","0.001","71.442","0.01","75.023","0.009","83.412","0.012","3222.7","0.5","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H104 Eu2 N12 Si4 -","- C46 H104 Eu2 N12 Si4 -","- C92 H208 Eu4 N24 Si8 -","2","1","","Liu, Qianqian; Wang, Chuanyong; Zhang, Xingmin; Xue, Mingqiang; Yao, Yingming; Zhang, Yong; Shen, Qi","Synthesis and molecular structures of divalent bridged bis(guanidinate) europium complexes and their application in intermolecular hydrophosphination of alkenes and alkynes","New J. Chem.","2016","40","12","10447","","10.1039/C6NJ02508K","","","0.71075","MoKα","","0.1289","0.0851","","","0.1607","0.1836","","","","","","1.133","","","","has coordinates,has disorder","190236","2020-10-21","18:00:00",""
"7055844","12.834","0.004","14.323","0.004","19.638","0.007","90","","107.298","0.006","90","","3446.6","1.9","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C64 H104 Eu2 N12 O4 -","- C64 H104 Eu2 N12 O4 -","- C128 H208 Eu4 N24 O8 -","2","0.5","","Liu, Qianqian; Wang, Chuanyong; Zhang, Xingmin; Xue, Mingqiang; Yao, Yingming; Zhang, Yong; Shen, Qi","Synthesis and molecular structures of divalent bridged bis(guanidinate) europium complexes and their application in intermolecular hydrophosphination of alkenes and alkynes","New J. Chem.","2016","40","12","10447","","10.1039/C6NJ02508K","","","0.71075","MoKα","","0.0648","0.0471","","","0.1115","0.1233","","","","","","1.083","","","","has coordinates,has disorder","190236","2020-10-21","18:00:00",""
"7055845","14.6965","0.0005","13.2218","0.0004","23.7134","0.0008","90","","92.135","0.003","90","","4604.7","0.3","223","2","223","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H76 Cl Eu N6 O3 Si2 -","- C35 H76 Cl Eu N6 O3 Si2 -","- C140 H304 Cl4 Eu4 N24 O12 Si8 -","4","1","","Liu, Qianqian; Wang, Chuanyong; Zhang, Xingmin; Xue, Mingqiang; Yao, Yingming; Zhang, Yong; Shen, Qi","Synthesis and molecular structures of divalent bridged bis(guanidinate) europium complexes and their application in intermolecular hydrophosphination of alkenes and alkynes","New J. Chem.","2016","40","12","10447","","10.1039/C6NJ02508K","","","0.71073","MoKα","","0.0931","0.0722","","","0.1869","0.2072","","","","","","1.069","","","","has coordinates,has disorder","190236","2020-10-21","18:00:00",""
"7055846","15.7722","0.0007","17.7021","0.0007","17.77","0.0007","90","","97.681","0.002","90","","4916.9","0.4","296","2","296.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C53 H46 As2 N4 O Ru S -","- C53 H46 As2 N4 O Ru S -","- C212 H184 As8 N16 O4 Ru4 S4 -","4","1","","Raj Kumar, Ramasamy; Ramesh, Rengan; Małecki, Jan Grzegorz","Steric control on the coordination behaviour of carbazole thiosemicarbazones towards [RuH(Cl)(CO)(AsPh3)3]: a combined experimental and theoretical study","New J. Chem.","2016","40","12","10084","","10.1039/C6NJ02430K","","","0.71073","MoKα","","0.1288","0.0698","","","0.0969","0.1126","","","","","","1.038","","","","has coordinates","190239","2020-10-21","18:00:00",""
"7055847","12.3121","0.0007","13.7064","0.0007","17.7353","0.0009","86.508","0.004","71.243","0.005","67.212","0.005","2605.8","0.3","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H51 As2 N5 O Ru S -","- C61 H51 As2 N5 O Ru S -","- C122 H102 As4 N10 O2 Ru2 S2 -","2","1","","Raj Kumar, Ramasamy; Ramesh, Rengan; Małecki, Jan Grzegorz","Steric control on the coordination behaviour of carbazole thiosemicarbazones towards [RuH(Cl)(CO)(AsPh3)3]: a combined experimental and theoretical study","New J. Chem.","2016","40","12","10084","","10.1039/C6NJ02430K","","x-ray","0.71073","MoKα","","0.0927","0.0539","","","0.1328","0.1624","","","","","","1.018","","","","has coordinates","190239","2020-10-21","18:00:00",""
"7055848","14.2118","0.0005","14.2118","0.0005","63.501","0.004","90","","90","","90","","12825.6","1","296.15","","296.15","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- C45 H55 Eu3 O35 -","- C45 H31 Eu3 O23 -","- C360 H248 Eu24 O184 -","8","0.5","","Fan, Liming; Fan, Weiliu; Li, Bin; Zhao, Xian; Zhang, Xiutang","W-shaped 1,3-di(2,4-dicarboxyphenyl)benzene based lanthanide coordination polymers with tunable white light emission","New J. Chem.","2016","40","12","10440","","10.1039/C6NJ00294C","","","0.71073","MoKα","","0.0749","0.0618","","","0.1278","0.1327","","","","","","1.063","","","","has coordinates","190244","2020-10-21","18:00:00",""
"7055849","14.1842","0.0014","14.1842","0.0014","63.709","0.009","90","","90","","90","","12818","3","296.15","","296.15","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- C45 H55 O35 Tb3 -","- C45 H31 O23 Tb3 -","- C360 H248 O184 Tb24 -","8","0.5","","Fan, Liming; Fan, Weiliu; Li, Bin; Zhao, Xian; Zhang, Xiutang","W-shaped 1,3-di(2,4-dicarboxyphenyl)benzene based lanthanide coordination polymers with tunable white light emission","New J. Chem.","2016","40","12","10440","","10.1039/C6NJ00294C","","","0.71073","MoKα","","0.0955","0.0815","","","0.1772","0.1842","","","","","","1.1","","","","has coordinates,has disorder","190244","2020-10-21","18:00:00",""
"7055850","14.1545","0.0003","14.1545","0.0003","62.938","0.002","90","","90","","90","","12609.6","0.6","296.15","","296.15","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- C45 H55 Dy3 O35 -","- C45 H31 Dy3 O23 -","- C360 H248 Dy24 O184 -","8","0.5","","Fan, Liming; Fan, Weiliu; Li, Bin; Zhao, Xian; Zhang, Xiutang","W-shaped 1,3-di(2,4-dicarboxyphenyl)benzene based lanthanide coordination polymers with tunable white light emission","New J. Chem.","2016","40","12","10440","","10.1039/C6NJ00294C","","","0.71073","MoKα","","0.0376","0.0281","","","0.059","0.0613","","","","","","1.041","","","","has coordinates","190244","2020-10-21","18:00:00",""
"7055851","14.309","0.0004","14.309","0.0004","63.9","0.004","90","","90","","90","","13083.4","1","296.15","","296.15","","","","","","","","","4","I -4 2 d","I -4 2bw","122","","","","- C45 H55 O35 Sm3 -","- C45 H31 O23 Sm3 -","- C360 H248 O184 Sm24 -","8","0.5","","Fan, Liming; Fan, Weiliu; Li, Bin; Zhao, Xian; Zhang, Xiutang","W-shaped 1,3-di(2,4-dicarboxyphenyl)benzene based lanthanide coordination polymers with tunable white light emission","New J. Chem.","2016","40","12","10440","","10.1039/C6NJ00294C","","","0.71073","MoKα","","0.0483","0.0372","","","0.0819","0.087","","","","","","1.064","","","","has coordinates","190244","2020-10-21","18:00:00",""
"7055852","19.4562","0.0031","15.796","0.0025","10.1007","0.0016","90","","103.17","0.002","90","","3022.6","0.8","110","2","110","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C68 H54.24 Cu2 N4 O11.12 S4 -","- C68 H54.236 Cu2 N4 O11.118 S4 -","- C136 H108.472 Cu4 N8 O22.236 S8 -","2","0.5","","Adhikari, Sangita; Sahana, Animesh; Kumari, Babli; Ganguly, Durba; Das, Saurabh; Banerjee, Prajna Paramita; Banerjee, Gautam; Chattopadhyay, Ansuman; Fondo, Matilde; Matalobos, Jesús Sanmartín; Brandão, Paula; Félix, Vítor; Das, Debasis","Molecular diversity in several pyridyl based Cu(ii) complexes: biophysical interaction and redox triggered fluorescence switch","New J. Chem.","2016","40","12","10378","","10.1039/C6NJ02381A","","x-ray","0.7107","MoKα","","0.0694","0.0433","","","0.0991","0.1123","","","","","","1.045","","","","has coordinates,has disorder","190249","2020-10-21","18:00:00",""
"7055853","7.39817","0.00015","13.0179","0.0002","14.3767","0.0003","90","","90","","90","","1384.6","0.05","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C7 H7 N O3 -","- C7 H7 N O3 -","- C56 H56 N8 O24 -","8","1","","Adhikari, Sangita; Sahana, Animesh; Kumari, Babli; Ganguly, Durba; Das, Saurabh; Banerjee, Prajna Paramita; Banerjee, Gautam; Chattopadhyay, Ansuman; Fondo, Matilde; Matalobos, Jesús Sanmartín; Brandão, Paula; Félix, Vítor; Das, Debasis","Molecular diversity in several pyridyl based Cu(ii) complexes: biophysical interaction and redox triggered fluorescence switch","New J. Chem.","2016","40","12","10378","","10.1039/C6NJ02381A","","","0.71073","MoKα","","0.0394","0.0378","","","0.1093","0.1108","","","","","","1.064","","","","has coordinates","190249","2020-10-21","18:00:00",""
"7055854","8.7731","0.0005","13.7449","0.0007","16.6071","0.0009","90","","93.648","0.002","90","","1998.52","0.19","100","2","100","2","","","","","","","Synthetic","6","P 1 21 1","P 2yb","4","","","","- C14 H20 Cu N2 O13 S -","- C14 H19 Cu N2 O13 S -","- C56 H76 Cu4 N8 O52 S4 -","4","2","","Adhikari, Sangita; Sahana, Animesh; Kumari, Babli; Ganguly, Durba; Das, Saurabh; Banerjee, Prajna Paramita; Banerjee, Gautam; Chattopadhyay, Ansuman; Fondo, Matilde; Matalobos, Jesús Sanmartín; Brandão, Paula; Félix, Vítor; Das, Debasis","Molecular diversity in several pyridyl based Cu(ii) complexes: biophysical interaction and redox triggered fluorescence switch","New J. Chem.","2016","40","12","10378","","10.1039/C6NJ02381A","","x-ray","0.71073","MoKα","","0.0283","0.0255","","","0.0654","0.0664","","","","","","1.065","","","","has coordinates","190249","2020-10-21","18:00:00",""
"7055855","13.067","0.0009","17.8555","0.0012","36.247","0.003","90","","90","","90","","8457.1","1.1","100","2","100","2","","","","","","","","6","F d d d","-F 2uv 2vw","70","","","","- C14 H20 Cl Cu2 N3 O13 -","- C14 H20 Cl Cu2 N3 O13 -","- C224 H320 Cl16 Cu32 N48 O208 -","16","","","Adhikari, Sangita; Sahana, Animesh; Kumari, Babli; Ganguly, Durba; Das, Saurabh; Banerjee, Prajna Paramita; Banerjee, Gautam; Chattopadhyay, Ansuman; Fondo, Matilde; Matalobos, Jesús Sanmartín; Brandão, Paula; Félix, Vítor; Das, Debasis","Molecular diversity in several pyridyl based Cu(ii) complexes: biophysical interaction and redox triggered fluorescence switch","New J. Chem.","2016","40","12","10378","","10.1039/C6NJ02381A","","","0.71073","MoKα","","0.0668","0.0433","","","0.1041","0.1202","","","","","","1.026","","","","has coordinates,has disorder","190249","2020-10-21","18:00:00",""
"7055856","8.4875","0.0009","14.7989","0.0015","8.7734","0.0009","90","","101.334","0.002","90","","1080.5","0.19","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H22 Cu N8 O6 -","- C16 H22 Cu N8 O6 -","- C32 H44 Cu2 N16 O12 -","2","0.5","","Cheng, Meiling; Sun, Lin; Han, Wei; Wang, Shen; Liu, Qi; Sun, Xiaoqiang; Xi, Haitao","Effect of N ancillary ligands on the structure, nuclearity and magnetic behavior of Cu(ii)‒pyrazolecarboxylate complexes","New J. Chem.","2016","40","12","10504","","10.1039/C6NJ02338J","","","0.71073","MoKα","","0.0396","0.0314","","","0.0946","0.0998","","","","","","1.055","","","","has coordinates","190235","2020-10-21","18:00:00",""
"7055857","12.4984","0.0011","7.2846","0.0011","17.4974","0.0019","90","","102.95","0.003","90","","1552.5","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H16 Cu2 N4 O8 -","- C10 H16 Cu2 N4 O8 -","- C40 H64 Cu8 N16 O32 -","4","0.5","","Cheng, Meiling; Sun, Lin; Han, Wei; Wang, Shen; Liu, Qi; Sun, Xiaoqiang; Xi, Haitao","Effect of N ancillary ligands on the structure, nuclearity and magnetic behavior of Cu(ii)‒pyrazolecarboxylate complexes","New J. Chem.","2016","40","12","10504","","10.1039/C6NJ02338J","","","0.71073","MoKα","","0.0379","0.0333","","","0.0801","0.0876","","","","","","1.191","","","","has coordinates","190235","2020-10-21","18:00:00",""
"7055858","7.0667","0.0015","9.232","0.002","11.548","0.003","95.15","0.004","95.809","0.004","105.873","0.004","715.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H20 Cu2 N6 O11 -","- C20 H20 Cu2 N6 O11 -","- C20 H20 Cu2 N6 O11 -","1","0.5","","Cheng, Meiling; Sun, Lin; Han, Wei; Wang, Shen; Liu, Qi; Sun, Xiaoqiang; Xi, Haitao","Effect of N ancillary ligands on the structure, nuclearity and magnetic behavior of Cu(ii)‒pyrazolecarboxylate complexes","New J. Chem.","2016","40","12","10504","","10.1039/C6NJ02338J","","","0.71073","MoKα","","0.0696","0.0569","","","0.1681","0.1815","","","","","","1.098","","","","has coordinates,has disorder","190235","2020-10-21","18:00:00",""
"7055859","12.4393","0.0009","20.3403","0.0015","22.337","0.0015","90","","102.641","0.002","90","","5514.7","0.7","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C106 H114 Cu6 N24 O29 -","- C106 H114 Cu6 N24 O29 -","- C212 H228 Cu12 N48 O58 -","2","0.5","","Cheng, Meiling; Sun, Lin; Han, Wei; Wang, Shen; Liu, Qi; Sun, Xiaoqiang; Xi, Haitao","Effect of N ancillary ligands on the structure, nuclearity and magnetic behavior of Cu(ii)‒pyrazolecarboxylate complexes","New J. Chem.","2016","40","12","10504","","10.1039/C6NJ02338J","","","0.71073","MoKα","","0.0785","0.0448","","","0.1073","0.1242","","","","","","1.034","","","","has coordinates,has disorder","190235","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",""
"7055863","7.9693","0.0005","8.4129","0.0005","9.1302","0.0005","68.058","0.005","85.402","0.005","71.258","0.006","537.13","0.06","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","[1-methyl-3-carboxymethyl benzimidazolium betaine]2 CuBr2","","- C20 H20 Br2 Cu N4 O4 -","- C20 H20 Br2 Cu N4 O4 -","- C20 H20 Br2 Cu N4 O4 -","1","0.5","","Czekański, Łukasz; Hoffmann, Stanisław K.; Barczyński, Piotr; Gąsowska, Anna; Bregier-Jarzębowska, Romualda; Zalewska, Alina; Goslar, Janina; Ratajczak-Sitarz, Małgorzata; Katrusiak, Andrzej","Crystal structure and physical properties of 1-methyl-3-(carboxymethyl)benzimidazolium betaine·CuBr2 in crystal and water solution","New J. Chem.","2016","40","12","10526","","10.1039/C6NJ03192G","","","0.71073","MoKα","","0.0398","0.029","","","0.0681","0.0722","","","","","","1.008","","","","has coordinates","190233","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",""
"7056064","12.998","0.0003","17.766","0.0004","24.193","0.0005","90","","120.521","0.001","90","","4812.63","0.19","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Cyclometalated ruthenium complexes from naturally occurring quinones: Studies on their photophysical features, computational details and trypanocidal activity?","","- C49 H39 F12 N9 O P2 Ru -","- C49 H39 F12 N9 O P2 Ru -","- C196 H156 F48 N36 O4 P8 Ru4 -","4","1","","Souza, Clayton; Silva, Rafaela; Fernandes, Philipe; Souza Filho, Jose D.; Duarte, Hélio Anderson; Araujo, Maria Helena; Simone, Carlos; de Castro, Solange; Menna-Barreto, Rubem F. S.; Demicheli, Cynthia; da Silva Júnior, Eufrânio N.","Cyclometalated ruthenium complexes from naturally occurring quinones: Studies on their photophysical features, computational details and trypanocidal activity","New J. Chem.","2017","","","","","10.1039/C7NJ00379J","","","0.71073","MoKα","","0.0884","0.054","","","0.1407","0.1579","","","","","","0.925","","","","has coordinates","194316","2020-10-21","18:00:00",""
"7056065","7.34","0.0007","18.9644","0.0018","23.232","0.002","90","","90","","90","","3233.9","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4-(4-chlorophenyl)-2-(5-(4-chlorophenyl)-1H-pyrazol-1-yl) thiazole","","- C18 H11 Cl2 N3 S -","- C18 H11 Cl2 N3 S -","- C144 H88 Cl16 N24 S8 -","8","1","","Meshram, Harshadas Mitaram; Sridevi, Bhima; Tangella, Yellaiah; Korrapati, Suresh Babu; Nanubolu, Jagadeesh Babu; Routhu, Sunitha Rani; C., Ganesh Kumar; Kamal, Ahmed","Sulfamic Acid Catalyzed One-Pot, Three-Component Green Approach: Synthesis and Cytotoxic Evaluation of Pyrazolyl-Thiazole Congeners","New J. Chem.","2017","","","","","10.1039/C7NJ00042A","","","0.71073","MoKα","","0.0606","0.0591","","","0.1245","0.1253","","","","","","1.337","","","","has coordinates","194317","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",""
"7056068","10.3062","0.0015","10.3062","0.0015","8.3458","0.0017","90","","90","","120","","767.7","0.2","153.15","","153.15","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- B3 Be3 F4 Li O9 Sr3 -","- B3 Be3 F4 Li O9 Sr3 -","- B9 Be9 F12 Li3 O27 Sr9 -","3","0.166667","","Guo, Shu; Liang, Fei; Liu, Lijuan; Xia, Mingjun; Fang, Zhi; Wu, Ruofei; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian","LiSr3Be3B3O9F4: A New Ultraviolet Nonlinear Optical Crystal for Fourth-harmonic Generation of Nd:YAG Lasers","New J. Chem.","2017","","","","","10.1039/C7NJ00160F","","","0.710747","MoKα","","0.0283","0.0278","","","0.0649","0.0651","","","","","","1.076","","","","has coordinates","194353","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",""
"7056078","5.5092","0.0017","15.45","0.005","7.287","0.002","90","","90","","90","","620.2","0.3","296","2","296","2","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Ba O6 Pb Si2 -","- Ba O6 Pb Si2 -","- Ba4 O24 Pb4 Si8 -","4","0.25","","Dong, Lingyun; Jia, Liangliang; Wang, Lijun","New lead(II) borates in the PbO/PbF2/H3BO3 ternary phase diagram: syntheses and structures of β-Pb6B10O21 and Pb4B8O16","New J. Chem.","2017","","","","","10.1039/C7NJ00203C","","","0.71073","MoKα","","0.0238","0.0202","","","0.0474","0.0494","","","","","","1.061","","","","has coordinates","194573","2020-10-21","18:00:00",""
"7056079","7.252","0.0011","5.4841","0.0008","24.352","0.004","90","","90","","90","","968.5","0.3","296","2","296","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Ba2 O10 Pb S Si2 -","- Ba2 O10 Pb S Si2 -","- Ba8 O40 Pb4 S4 Si8 -","4","0.5","","Dong, Lingyun; Jia, Liangliang; Wang, Lijun","New lead(II) borates in the PbO/PbF2/H3BO3 ternary phase diagram: syntheses and structures of β-Pb6B10O21 and Pb4B8O16","New J. Chem.","2017","","","","","10.1039/C7NJ00203C","","","0.71073","MoKα","","0.044","0.0297","","","0.0566","0.0608","","","","","","1.029","","","","has coordinates","194573","2020-10-21","18:00:00",""
"7056080","10.172","0.0005","11.8006","0.0008","12.8576","0.0007","90.105","0.005","101.559","0.005","94.484","0.005","1507.2","0.15","120","","120","","","","","","","","","3","P -1","-P 1","2","","","","- C72 H64 Cl6 -","- C72 H64 Cl6 -","- C72 H64 Cl6 -","1","0.5","","Zhu, Chongwei; Duhayon, Carine; Romero-Borja, Daniel; Maldonado, Jose-Luis; Ramos-Ortiz, Gabriel; Saquet, Alix; Maraval, Valérie; Chauvin, Remi","Hexaaryl-carbo-benzenes revisited: novel synthetic route, crystallographic data, and prospects of electrochemical behavior","New J. Chem.","2017","","","","","10.1039/C7NJ00028F","","","0.71073","MoKα","","0.0836","0.0529","","0.0793","0.0562","0.0516","","","","","","1.1092","","","","has coordinates","194632","2020-10-21","18:00:00",""
"7056081","12.4948","0.0005","16.0972","0.0006","20.2765","0.0009","90","","90","","90","","4078.2","0.3","100","","100","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C55 H31 Cl3 -","- C55 H31 Cl3 -","- C220 H124 Cl12 -","4","1","","Zhu, Chongwei; Duhayon, Carine; Romero-Borja, Daniel; Maldonado, Jose-Luis; Ramos-Ortiz, Gabriel; Saquet, Alix; Maraval, Valérie; Chauvin, Remi","Hexaaryl-carbo-benzenes revisited: novel synthetic route, crystallographic data, and prospects of electrochemical behavior","New J. Chem.","2017","","","","","10.1039/C7NJ00028F","","","0.71073","MoKα","","0.0461","0.039","","0.0501","0.0393","0.0369","","","","","","1.1134","","","","has coordinates","194632","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",""
"7056084","22.1317","0.0019","7.8771","0.0006","21.0725","0.0018","90","","109.938","0.013","90","","3453.5","0.6","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","{[Cu(dmpzmpy)(C5O5)].H2O}n","","","- C16 H15 Cu N3 O6 -","- C16 H15 Cu N3 O6 -","- C128 H120 Cu8 N24 O48 -","8","1","","Massoud, Salah S.; Williams, Gabrielle F.; Louka, Febee R.; Henary, Maher M.; Herchel, Radovan; Travnicek, Zdenek; Fischer, Roland; Mautner, Franz Andreas","Croconato-bridged copper(II) complexes. Synthesis, structure and magnetic characterization","New J. Chem.","2017","","","","","10.1039/C6NJ03943J","","","0.71073","MoKα","","0.1017","0.096","","","0.2205","0.2234","","","","","","1.282","","","","has coordinates,has disorder","194917","2020-10-21","18:00:00",""
"7056085","13.9834","0.0013","19.8834","0.0019","16.6189","0.0015","90","","112.605","0.004","90","","4265.7","0.7","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Cu2(Et4dien)2(C5O5)](ClO4)2.3H2O","","","- C29 H64 Cl2 Cu2 N6 O16 -","- C29 H64 Cl2 Cu2 N6 O16 -","- C116 H256 Cl8 Cu8 N24 O64 -","4","1","","Massoud, Salah S.; Williams, Gabrielle F.; Louka, Febee R.; Henary, Maher M.; Herchel, Radovan; Travnicek, Zdenek; Fischer, Roland; Mautner, Franz Andreas","Croconato-bridged copper(II) complexes. Synthesis, structure and magnetic characterization","New J. Chem.","2017","","","","","10.1039/C6NJ03943J","","","0.71073","MoKα","","0.1276","0.1043","","","0.2423","0.2595","","","","","","1.156","","","","has coordinates,has disorder","194917","2020-10-21","18:00:00",""
"7056086","15.66","0.0012","16.0434","0.0013","20.4427","0.0018","90","","110.511","0.004","90","","4810.4","0.7","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","[Cu2(C5O5)(pmap)2](ClO4)2.2H2O","","","- C45 H48 Cl2 Cu2 N8 O15 -","- C45 H48 Cl2 Cu2 N8 O15 -","- C180 H192 Cl8 Cu8 N32 O60 -","4","2","","Massoud, Salah S.; Williams, Gabrielle F.; Louka, Febee R.; Henary, Maher M.; Herchel, Radovan; Travnicek, Zdenek; Fischer, Roland; Mautner, Franz Andreas","Croconato-bridged copper(II) complexes. Synthesis, structure and magnetic characterization","New J. Chem.","2017","","","","","10.1039/C6NJ03943J","","","0.71073","MoKα","","0.1052","0.0704","","","0.1575","0.1762","","","","","","1.076","","","","has coordinates,has disorder","194917","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",""
"7056092","19.1011","0.0005","9.0666","0.00019","32.4789","0.0008","90","","90","","90","","5624.8","0.2","175.6","0.8","175.6","0.8","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H28 N4 O18 Pb4 -","- C20 H26 N4 O18 Pb4 -","- C160 H208 N32 O144 Pb32 -","8","1","","Dai, Jun-Wei; zheng, jianmei; Li, Haiyan; Zhou, Jin-Mei; Dong, Xin; Zhou, Zhao-Hui","Halide assisted formations of polymeric ethylenediaminetetraacetato lead(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00611J","","","0.71073","MoKα","","0.0675","0.0423","","","0.0675","0.0736","","","","","","1.066","","","","has coordinates,has disorder","195256","2020-10-21","18:00:00",""
"7056093","7.5204","0.0004","8.8464","0.0004","13.5079","0.0005","72.888","0.004","81.027","0.004","75.571","0.004","828.46","0.07","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H32 Cl2 N4 O20 Pb5 -","- C20 H32 Cl2 N4 O20 Pb5 -","- C20 H32 Cl2 N4 O20 Pb5 -","1","0.5","","Dai, Jun-Wei; zheng, jianmei; Li, Haiyan; Zhou, Jin-Mei; Dong, Xin; Zhou, Zhao-Hui","Halide assisted formations of polymeric ethylenediaminetetraacetato lead(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00611J","","","0.71073","MoKα","","0.03","0.0258","","","0.0596","0.0608","","","","","","1.009","","","","has coordinates","195256","2020-10-21","18:00:00",""
"7056094","8.4173","0.0005","8.4523","0.0006","11.035","0.0008","71.442","0.007","89.744","0.005","76.903","0.006","722.96","0.09","178.7","0.7","178.7","0.7","","","","","","","","5","P -1","-P 1","2","","","","- C20 H28 N4 O18 Pb4 -","- C20 H28 N4 O18 Pb4 -","- C20 H28 N4 O18 Pb4 -","1","0.5","","Dai, Jun-Wei; zheng, jianmei; Li, Haiyan; Zhou, Jin-Mei; Dong, Xin; Zhou, Zhao-Hui","Halide assisted formations of polymeric ethylenediaminetetraacetato lead(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00611J","","","0.71073","MoKα","","0.0462","0.0363","","","0.0684","0.0721","","","","","","1.041","","","","has coordinates","195256","2020-10-21","18:00:00",""
"7056095","7.5998","0.001","8.8154","0.0012","13.729","0.0018","72.365","0.012","80.702","0.011","75.351","0.011","844.5","0.2","176.8","0.3","176.8","0.3","","","","","","","","6","P -1","-P 1","2","","","","- C20 H32 Br2 N4 O20 Pb5 -","- C20 H32 Br2 N4 O20 Pb5 -","- C20 H32 Br2 N4 O20 Pb5 -","1","0.5","","Dai, Jun-Wei; zheng, jianmei; Li, Haiyan; Zhou, Jin-Mei; Dong, Xin; Zhou, Zhao-Hui","Halide assisted formations of polymeric ethylenediaminetetraacetato lead(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00611J","","","0.71073","MoKα","","0.0798","0.0645","","","0.1338","0.1439","","","","","","1.037","","","","has coordinates","195256","2020-10-21","18:00:00",""
"7056096","9.9725","0.0006","13.6991","0.0008","16.1145","0.0009","76.131","0.003","74.391","0.003","84.035","0.003","2056.6","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H15 N O8 -","- C25 H15 N O8 -","- C100 H60 N4 O32 -","4","2","","., Mayank; Singh, Amanpreet; Raj, Pushap; Kaur, Randeep; Singh, Ajnesh; Kaur, Navneet; Singh, Narinder","Zwitterionic Liquid (ZIL) Coated CuO as an Efficient Catalyst for the Green Syntheses of Bis-Coumarins derivatives via One-Pot Multi-component Reactions Using Mechanochemistry","New J. Chem.","2017","","","","","10.1039/C6NJ03763A","","","0.71073","MoKα","","0.1877","0.0989","","","0.1657","0.1874","","","","","","1.052","","","","has coordinates","195278","2020-10-21","18:00:00",""
"7056097","9.1088","0.0004","9.372","0.0004","13.9495","0.0005","97.358","0.001","92.518","0.002","118.232","0.001","1033.06","0.07","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H10 N2 O4 -","- C11 H10 N2 O4 -","- C44 H40 N8 O16 -","4","2","","., Mayank; Singh, Amanpreet; Raj, Pushap; Kaur, Randeep; Singh, Ajnesh; Kaur, Navneet; Singh, Narinder","Zwitterionic Liquid (ZIL) Coated CuO as an Efficient Catalyst for the Green Syntheses of Bis-Coumarins derivatives via One-Pot Multi-component Reactions Using Mechanochemistry","New J. Chem.","2017","","","","","10.1039/C6NJ03763A","","","0.71073","MoKα","","0.0467","0.0391","","","0.1095","0.1149","","","","","","1.06","","","","has coordinates,has disorder","195278","2020-10-21","18:00:00",""
"7056098","7.7936","0.0001","26.5402","0.0002","7.988","0.0001","90","","90.009","0.001","90","","1652.27","0.03","293","2","293","2","","","","","","","Fungus","4","P 1 21 1","P 2yb","4","YX","Talaramide A","","- C18 H21 N O5 -","- C18 H21 N O5 -","- C72 H84 N4 O20 -","4","2","","Chen, Senhua; He, Liqing; Dongni, Chen; Cai, Ruilin; long, yuhua; Lu, Yongjun; She, Zhi-Gang","Talaramide A, an Unusual Alkaloid from the Mangrove Endophytic Fungus Talaromyces sp. (HZ-YX1) as Inhibitor of Mycobacterial PknG","New J. Chem.","2017","","","","","10.1039/C7NJ00059F","","","1.54178","CuKα","","0.047","0.046","","","0.1252","0.1258","","","","","","1.175","","","","has coordinates","195410","2020-10-21","18:00:00",""
"7056099","6.5577","0.0007","31.045","0.003","5.842","0.0006","90","","95.054","0.002","90","","1184.7","0.2","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H6 N12 O4 -","- C6 H6 N12 O4 -","- C24 H24 N48 O16 -","4","1","","Shreeve, Jean'ne M.; Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.","Resolving Synthetic Challenges Faced in the Syntheses of Asymmetric N,N’-Ethylene-Bridged Energetic Compounds","New J. Chem.","2017","","","","","10.1039/C7NJ00327G","","","0.71073","MoKα","","0.0444","0.0353","","","0.0862","0.0909","","","","","","1.039","","","","has coordinates","195482","2020-10-21","18:00:00",""
"7056100","29.426","0.004","8.4217","0.0011","11.1029","0.0014","90","","100.699","0.005","90","","2703.7","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 N13 Na O6 -","- C6 H4 N13 Na O6 -","- C48 H32 N104 Na8 O48 -","8","2","","Shreeve, Jean'ne M.; Kumar, Dheeraj; Imler, Gregory H.; Parrish, Damon A.","Resolving Synthetic Challenges Faced in the Syntheses of Asymmetric N,N’-Ethylene-Bridged Energetic Compounds","New J. Chem.","2017","","","","","10.1039/C7NJ00327G","","","0.71073","MoKα","","0.1383","0.0765","","","0.1766","0.2025","","","","","","1.032","","","","has coordinates","195482","2020-10-21","18:00:00",""
"7056101","11.9211","0.0005","8.3391","0.0004","8.476","0.0004","90","","90","","90","","842.61","0.07","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C4 H3 N5 O6 -","- C4 H3 N5 O6 -","- C16 H12 N20 O24 -","4","1","","Ma, Qing; Jiang, Tao; Chi, Yu; Chen, Ya; Wang, Jun; Huang, Jinglun; Nie, Fude","A novel multi-nitrogen 2,4,6,8,10,12-hexanitrohexaazaisowurtzitane based energetic cocrystal with 1-methyl-3,4,5-trinitropyrazole as a donor: experimental and theoretical investigations of intermolecular interactions","New J. Chem.","2017","","","","","10.1039/C6NJ03976F","","","0.71073","MoKα","","0.0499","0.0386","","","0.0796","0.0912","","","","","","1.044","","","","has coordinates","195533","2020-10-21","18:00:00",""
"7056102","8.3515","0.0003","11.4299","0.0007","11.9398","0.0006","90","","98.663","0.004","90","","1126.73","0.1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H9 N17 O18 -","- C10 H9 N17 O18 -","- C20 H18 N34 O36 -","2","1","","Ma, Qing; Jiang, Tao; Chi, Yu; Chen, Ya; Wang, Jun; Huang, Jinglun; Nie, Fude","A novel multi-nitrogen 2,4,6,8,10,12-hexanitrohexaazaisowurtzitane based energetic cocrystal with 1-methyl-3,4,5-trinitropyrazole as a donor: experimental and theoretical investigations of intermolecular interactions","New J. Chem.","2017","","","","","10.1039/C6NJ03976F","","","0.71073","MoKα","","0.0719","0.0487","","","0.0855","0.0996","","","","","","1.044","","","","has coordinates","195533","2020-10-21","18:00:00",""
"7056103","5.2605","0.0011","9.4604","0.0019","20.691","0.004","90","","90.7","0.03","90","","1029.6","0.4","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C30 H22 -","- C30 H22 -","- C60 H44 -","2","0.5","","Wu, Dong-En; Wang, Man-Ning; Luo, Yang-Hui; Zhang, Yawen; Ma, Yu-Heng; Sun, Baiwang","Tuning the structures and photophysical properties of 9,10-distyrylanthrance (DSA) via fluorine substitution","New J. Chem.","2017","","","","","10.1039/C6NJ03884K","","","0.71073","MoKα","","0.1681","0.0846","","","0.164","0.194","","","","","","1.003","","","","has coordinates","195534","2020-10-21","18:00:00",""
"7056104","9.363","0.0019","5.22","0.001","21.662","0.004","90","","96.92","0.03","90","","1051","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H20 F2 -","- C30 H20 F2 -","- C60 H40 F4 -","2","0.5","","Wu, Dong-En; Wang, Man-Ning; Luo, Yang-Hui; Zhang, Yawen; Ma, Yu-Heng; Sun, Baiwang","Tuning the structures and photophysical properties of 9,10-distyrylanthrance (DSA) via fluorine substitution","New J. Chem.","2017","","","","","10.1039/C6NJ03884K","","","0.71073","MoKα","","0.1498","0.1188","","","0.3553","0.3852","","","","","","1.455","","","","has coordinates","195534","2020-10-21","18:00:00",""
"7056105","9.408","0.0019","10.249","0.002","12.766","0.003","106.25","0.03","90.87","0.03","115.16","0.03","1056.8","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C30 H20 F2 -","- C30 H20 F2 -","- C60 H40 F4 -","2","1","","Wu, Dong-En; Wang, Man-Ning; Luo, Yang-Hui; Zhang, Yawen; Ma, Yu-Heng; Sun, Baiwang","Tuning the structures and photophysical properties of 9,10-distyrylanthrance (DSA) via fluorine substitution","New J. Chem.","2017","","","","","10.1039/C6NJ03884K","","","0.71073","MoKα","","0.1324","0.0679","","","0.1579","0.1926","","","","","","1.003","","","","has coordinates","195534","2020-10-21","18:00:00",""
"7056106","8.4268","0.0003","9.2446","0.0003","12.4656","0.0004","81.2037","0.0013","85.3644","0.0016","84.7588","0.0016","953.46","0.06","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Ethyl chalcone","(E)-3-(4-(bis(2-chloroethyl)amino)phenyl)-1-(4-ethylphenyl)prop-2-en-1-one","","- C21 H23 Cl2 N O -","- C21 H23 Cl2 N O -","- C42 H46 Cl4 N2 O2 -","2","1","","Xavier, Janet Sabina; Karthikeyan, J.; Velmurugan, Gunasekaran; Manoharan, Muthu Tamizh; Shetty, A. Nityananda","Design and in vitro biological evaluation of substituted chalcones synthesized from Nitrogen mustards as potent microtubule targeted anticancer agents","New J. Chem.","2017","","","","","10.1039/C7NJ00265C","","","0.71073","MoKα","","0.0577","0.0453","","","0.1177","0.1277","","","","","","1.057","","","","has coordinates","195535","2020-10-21","18:00:00",""
"7056107","14.8845","0.0004","16.7875","0.001","8.0709","0.0009","90","","91.708","0.003","90","","2015.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Chalcone","","- C21 H23 Cl2 N O3 -","- C21 H23 Cl2 N O3 -","- C84 H92 Cl8 N4 O12 -","4","1","","Xavier, Janet Sabina; Karthikeyan, J.; Velmurugan, Gunasekaran; Manoharan, Muthu Tamizh; Shetty, A. Nityananda","Design and in vitro biological evaluation of substituted chalcones synthesized from Nitrogen mustards as potent microtubule targeted anticancer agents","New J. Chem.","2017","","","","","10.1039/C7NJ00265C","","","0.71073","MoKα","","0.0922","0.0458","","","0.1094","0.1472","","","","","","1.063","","","","has coordinates,has disorder","195535","2020-10-21","18:00:00",""
"7056108","8.3361","0.0003","9.1285","0.0004","12.246","0.0005","81.63","0.002","84.562","0.002","83.133","0.002","912.49","0.06","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methoxy chalcone","","- C20 H21 Cl2 N O2 -","- C20 H21 Cl2 N O2 -","- C40 H42 Cl4 N2 O4 -","2","1","","Xavier, Janet Sabina; Karthikeyan, J.; Velmurugan, Gunasekaran; Manoharan, Muthu Tamizh; Shetty, A. Nityananda","Design and in vitro biological evaluation of substituted chalcones synthesized from Nitrogen mustards as potent microtubule targeted anticancer agents","New J. Chem.","2017","","","","","10.1039/C7NJ00265C","","","0.71073","MoKα","","0.0595","0.0404","","","0.1091","0.1373","","","","","","0.872","","","","has coordinates,has disorder","195535","2020-10-21","18:00:00",""
"7056109","8.099","0.0002","9.3548","0.0002","12.8639","0.0004","75.6264","0.0012","79.1564","0.0013","79.016","0.0013","916.6","0.04","296","2","296","2","","","","","","","","6","P -1","-P 1","2","Bromo chalcone","(E)-3-(4-(bis(2-chloroethyl)amino)phenyl)-1-(4-bromophenyl)prop-2-en-1-one","","- C19 H18 Br Cl2 N O -","- C18.99 H17.98 Br Cl2 N O -","- C37.98 H35.96 Br2 Cl4 N2 O2 -","2","1","","Xavier, Janet Sabina; Karthikeyan, J.; Velmurugan, Gunasekaran; Manoharan, Muthu Tamizh; Shetty, A. Nityananda","Design and in vitro biological evaluation of substituted chalcones synthesized from Nitrogen mustards as potent microtubule targeted anticancer agents","New J. Chem.","2017","","","","","10.1039/C7NJ00265C","","","0.71073","MoKα","","0.0501","0.0364","","","0.0747","0.0808","","","","","","1.033","","","","has coordinates,has disorder","195535","2020-10-21","18:00:00",""
"7056110","8.1897","0.0004","9.3642","0.0004","12.3569","0.0006","77.946","0.002","81.053","0.002","83.095","0.003","911.7","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Chalcone","","- C20 H21 Cl2 N O -","- C20 H21 Cl2 N O -","- C40 H42 Cl4 N2 O2 -","2","1","","Xavier, Janet Sabina; Karthikeyan, J.; Velmurugan, Gunasekaran; Manoharan, Muthu Tamizh; Shetty, A. Nityananda","Design and in vitro biological evaluation of substituted chalcones synthesized from Nitrogen mustards as potent microtubule targeted anticancer agents","New J. Chem.","2017","","","","","10.1039/C7NJ00265C","","","0.71073","MoKα","","0.0757","0.0428","","","0.1058","0.1319","","","","","","1.064","","","","has coordinates,has disorder","195535","2020-10-21","18:00:00",""
"7056111","8.0622","0.0005","9.3324","0.0006","12.5869","0.0008","78.365","0.003","81.741","0.004","81.832","0.004","911.68","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","Nitrochalcone","(E)-3-(4-(bis(2-chloroethyl)amino)phenyl)-1-(4-nitrophenyl)prop-2-en-1-one","","- C19 H18 Cl2 N2 O3 -","- C19 H18 Cl2 N2 O3 -","- C38 H36 Cl4 N4 O6 -","2","1","","Xavier, Janet Sabina; Karthikeyan, J.; Velmurugan, Gunasekaran; Manoharan, Muthu Tamizh; Shetty, A. Nityananda","Design and in vitro biological evaluation of substituted chalcones synthesized from Nitrogen mustards as potent microtubule targeted anticancer agents","New J. Chem.","2017","","","","","10.1039/C7NJ00265C","","","0.71073","MoKα","","0.0792","0.064","","","0.1984","0.2187","","","","","","1.065","","","","has coordinates","195535","2020-10-21","18:00:00",""
"7056112","7.2755","0.0003","12.9036","0.0005","13.5575","0.0005","100.275","0.002","92.818","0.002","96.958","0.002","1239.88","0.08","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H22 N8 Ni O2 -","- C26 H22 N8 Ni O2 -","- C52 H44 N16 Ni2 O4 -","2","1","","Pramanik, Shuvam; Dutta, Suhana; Roy, Sima; Dinda, Soumitra; Ghorui, Tapas; Mitra, Arup Kumar; Pramanik, Kausikisankar; Ganguly, Sanjib","Luminescent Closed Shell Nickel(II) Pyridyl-azo-oximates and the Open Shell Anion Radical Congener: Molecular and Electronic Structure, Ligand Redox and Biological Activity","New J. Chem.","2017","","","","","10.1039/C7NJ00402H","","","0.71073","MoKα","","0.0416","0.0329","","","0.1004","0.1092","","","","","","0.899","","","","has coordinates","195615","2020-10-21","18:00:00",""
"7056113","15.1732","0.0011","15.568","0.0011","22.2494","0.0016","78.053","0.001","83.127","0.001","62.745","0.001","4569.1","0.6","173","2","173.15","","","","","","","","","7","P -1","-P 1","2","","","","- C92 H72 Ag2 F12 N8 O8 P2 -","- C92 H72 Ag2 F12 N8 O8 P2 -","- C184 H144 Ag4 F24 N16 O16 P4 -","2","1","","Liu, Qingxiang; Wei, Deng-Che; Zhao, Dong-Xue; Sun, Xiao-Feng; Zhao, Zhi-Xiang; Yan, Jing","Macrometallocycle binuclear NHC silver(I) complexes: synthesis, structure and recognition for o-phenylenediamine","New J. Chem.","2017","","","","","10.1039/C7NJ00276A","","","0.71073","MoKα","","0.1152","0.0949","","","0.2722","0.2908","","","","","","1.156","","","","has coordinates","195616","2020-10-21","18:00:00",""
"7056114","11.1719","0.0004","11.2926","0.0004","28.5875","0.001","90","","98.454","0.001","90","","3567.4","0.2","296","2","296.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C76 H64 Ag2 F12 N8 O8 P2 -","- C76 H64 Ag2 F12 N8 O8 P2 -","- C152 H128 Ag4 F24 N16 O16 P4 -","2","0.5","","Liu, Qingxiang; Wei, Deng-Che; Zhao, Dong-Xue; Sun, Xiao-Feng; Zhao, Zhi-Xiang; Yan, Jing","Macrometallocycle binuclear NHC silver(I) complexes: synthesis, structure and recognition for o-phenylenediamine","New J. Chem.","2017","","","","","10.1039/C7NJ00276A","","","0.71073","MoKα","","0.0693","0.06","","","0.142","0.1498","","","","","","1.031","","","","has coordinates,has disorder","195616","2020-10-21","18:00:00",""
"7056115","9.3833","0.0006","20.3902","0.0013","25.4603","0.0016","82.388","0.001","80.031","0.001","85.566","0.002","4748","0.5","173","2","173.15","","","","","","","","","8","P -1","-P 1","2","","","","- C195.4 H165.8 Ag4 Cl1.4 F24 N17 O16 P4 -","- C195.4 H165.8 Ag4 Cl1.4 F24 N17 O16 P4 -","- C195.4 H165.8 Ag4 Cl1.4 F24 N17 O16 P4 -","1","0.5","","Liu, Qingxiang; Wei, Deng-Che; Zhao, Dong-Xue; Sun, Xiao-Feng; Zhao, Zhi-Xiang; Yan, Jing","Macrometallocycle binuclear NHC silver(I) complexes: synthesis, structure and recognition for o-phenylenediamine","New J. Chem.","2017","","","","","10.1039/C7NJ00276A","","","0.71073","MoKα","","0.1133","0.084","","","0.2218","0.2501","","","","","","1.043","","","","has coordinates,has disorder","195616","2020-10-21","18:00:00",""
"7056116","14.458","0.003","14.898","0.003","37.068","0.006","90","","97.327","0.003","90","","7919","3","296","2","296.15","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C80.5 H73 Ag2 Cl F12 N8 O8 P2 -","- C80.5 H73 Ag2 Cl F12 N8 O8 P2 -","- C322 H292 Ag8 Cl4 F48 N32 O32 P8 -","4","1","","Liu, Qingxiang; Wei, Deng-Che; Zhao, Dong-Xue; Sun, Xiao-Feng; Zhao, Zhi-Xiang; Yan, Jing","Macrometallocycle binuclear NHC silver(I) complexes: synthesis, structure and recognition for o-phenylenediamine","New J. Chem.","2017","","","","","10.1039/C7NJ00276A","","","0.71073","MoKα","","0.073","0.0596","","","0.1683","0.1823","","","","","","1.028","","","","has coordinates","195616","2020-10-21","18:00:00",""
"7056117","7.2202","0.0002","10.6578","0.0003","20.9068","0.0005","90","","90","","90","","1608.81","0.07","297","2","297","2","","","","","","","(-)-Menthyl diazoacetate and acrylonitrile","4","P 21 21 21","P 2ac 2ab","19","","(5R)-5-cyano-3-carbmenthoxy-2-pyrazoline","","- C15 H23 N3 O2 -","- C15 H23 N3 O2 -","- C60 H92 N12 O8 -","4","1","","Chen, Cheng; Li, Yan; Jia, Xiangxiang; Li, Feifei; Chen, Fangjuan; Liu, Lijian","Wavelength-Focused Organic Molecule Materials with Diazoacetate or Fumarate as Monofluorophore","New J. Chem.","2017","","","","","10.1039/C6NJ03952A","","","1.54178","CuKα","","0.0335","0.0276","","","0.075","0.0753","","","","","","1.057","","","","has coordinates","195617","2020-10-21","18:00:00",""
"7056118","17.6722","0.0007","17.3463","0.0007","7.397","0.0003","90","","90","","90","","2267.53","0.16","296","2","296","2","","","","","","","","6","A e a 2","A 2 -2ab","41","","","","- C18 H22 Cl2 Cu N8 O3 -","- C18 H22 Cl2 Cu N8 O3 -","- C72 H88 Cl8 Cu4 N32 O12 -","4","0.5","","Lavrenova, Ludmila G.; Kuz'menko, Tatyana A.; Ivanova, Alina D.; Smolentsev, Anton I.; Komarov, Vladislav; Bogomyakov, Artem Stepanovich; Sheludyakova, Lilia A.; Vorontsova, Elena V.","Synthesis, magnetic and cytotoxic properties of copper(II) halide complexes with 1,2,4-triazolo[1,5-a] benzimidazoles","New J. Chem.","2017","","","","","10.1039/C7NJ00533D","","","0.71073","MoKα","","0.0295","0.0278","","","0.0753","0.0763","","","","","","1.066","","","","has coordinates","195686","2020-10-21","18:00:00",""
"7056119","18.028","0.003","7.2842","0.0012","17.278","0.002","90","","92.963","0.01","90","","2265.9","0.6","303","","303","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 Br2 Cu N8 O3 -","- C18 H22 Br2 Cu N8 O3 -","- C72 H88 Br8 Cu4 N32 O12 -","4","0.5","","Lavrenova, Ludmila G.; Kuz'menko, Tatyana A.; Ivanova, Alina D.; Smolentsev, Anton I.; Komarov, Vladislav; Bogomyakov, Artem Stepanovich; Sheludyakova, Lilia A.; Vorontsova, Elena V.","Synthesis, magnetic and cytotoxic properties of copper(II) halide complexes with 1,2,4-triazolo[1,5-a] benzimidazoles","New J. Chem.","2017","","","","","10.1039/C7NJ00533D","","","1.54178","CuKα","","0.0666","0.0551","","","0.1406","0.1452","","","","","","1.116","","","","has coordinates","195686","2020-10-21","18:00:00",""
"7056120","13.9357","0.0003","6.6873","0.0001","27.1213","0.0004","90","","92.325","0.001","90","","2525.41","0.08","273","2","273","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C16 H26 Cl2 Cu N6 O8 S2 -","- C16 H26 Cl2 Cu N6 O8 S2 -","- C64 H104 Cl8 Cu4 N24 O32 S8 -","4","0.5","","Das, Saurabh; Santra, Ramesh Chandra; Ganguly, Durba; Jana, Subrata; Banyal, Neha; Singh, Jyotsna; Saha, Abhijit; Chattopadhyay, Shouvik; Mukhopadhyay, Kasturi","Synthesizing a CuII complex of tinidazole to tune the generation of the nitro radical anion in order to strike a balance between efficacy and toxic side effects","New J. Chem.","2017","","","","","10.1039/C7NJ00261K","","","0.71073","MoKα","","0.0356","0.0306","","","0.0829","0.0866","","","","","","1.057","","","","has coordinates","195774","2020-10-21","18:00:00",""
"7056121","10.4417","0.0003","17.767","0.0005","10.7908","0.0003","90","","101.367","0.001","90","","1962.62","0.1","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H15 N4 O5 V -","- C22 H15 N4 O5 V -","- C88 H60 N16 O20 V4 -","4","1","","Shit, Madhusudan; Bera, Sachinath; Maity, Suvendu; Weyhermueller, Thomas; Ghosh, Prasanta","Coordination of o-benzosemiquinonate, o-iminobenzosemiquinonate and aldimine anion radicals to oxidovanadium(IV)","New J. Chem.","2017","","","","","10.1039/C7NJ00186J","","","0.71073","MoKα","","0.0872","0.0557","","","0.135","0.1565","","","","","","1.022","","","","has coordinates","195799","2020-10-21","18:00:00",""
"7056122","15.194","0.002","19.427","0.002","9.3109","0.0005","90","","106.744","0.006","90","","2631.8","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H31 N2 O4 V -","- C30 H31 N2 O4 V -","- C120 H124 N8 O16 V4 -","4","1","","Shit, Madhusudan; Bera, Sachinath; Maity, Suvendu; Weyhermueller, Thomas; Ghosh, Prasanta","Coordination of o-benzosemiquinonate, o-iminobenzosemiquinonate and aldimine anion radicals to oxidovanadium(IV)","New J. Chem.","2017","","","","","10.1039/C7NJ00186J","","","0.71073","MoKα","","0.0437","0.0336","","","0.0842","0.0908","","","","","","1.052","","","","has coordinates","195799","2020-10-21","18:00:00",""
"7056123","15.213","0.003","9.5292","0.0012","12.588","0.002","90","","99.66","0.02","90","","1799","0.5","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 N2 O4 V -","- C21 H18 N2 O4 V -","- C84 H72 N8 O16 V4 -","4","1","","Shit, Madhusudan; Bera, Sachinath; Maity, Suvendu; Weyhermueller, Thomas; Ghosh, Prasanta","Coordination of o-benzosemiquinonate, o-iminobenzosemiquinonate and aldimine anion radicals to oxidovanadium(IV)","New J. Chem.","2017","","","","","10.1039/C7NJ00186J","","","0.71073","MoKα","","0.0819","0.0479","","","0.0903","0.1031","","","","","","1.06","","","","has coordinates","195799","2020-10-21","18:00:00",""
"7056124","29.889","0.002","14.192","0.0008","20.2188","0.0013","90","","129.985","0.004","90","","6571.4","0.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32.5 H23 Cl N4 O8 S V2 -","- C32.5 H23 Cl N4 O8 S V2 -","- C260 H184 Cl8 N32 O64 S8 V16 -","8","1","","Shit, Madhusudan; Bera, Sachinath; Maity, Suvendu; Weyhermueller, Thomas; Ghosh, Prasanta","Coordination of o-benzosemiquinonate, o-iminobenzosemiquinonate and aldimine anion radicals to oxidovanadium(IV)","New J. Chem.","2017","","","","","10.1039/C7NJ00186J","","","0.71073","MoKα","","0.0781","0.0569","","","0.1603","0.1851","","","","","","1.054","","","","has coordinates","195799","2020-10-21","18:00:00",""
"7056125","14.6581","0.0002","16.2338","0.0002","16.55","0.0002","90","","92.759","0.001","90","","3933.62","0.09","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","ct-[RuCl(CO)(dppb)(bipy)]PF6","","- C39 H36 Cl F6 N2 O P3 Ru -","- C39 H36 Cl F6 N2 O P3 Ru -","- C156 H144 Cl4 F24 N8 O4 P12 Ru4 -","4","1","","Barbosa, Marilia; Correa, Rodrigo S.; Bastos, Tanira; Pozzi, Lucas; Moreira, Diogo R.; Ellena, Javier A.; Doriguetto, Antonio C.; Silveira, Rafael; Rodrigues de Oliveira, Clayton; Kuznetsov, Aleksey E.; Malta, Valeria rodrigues dos santos; Soares, Milena Botelho; Batista, Alzir A.","Structural isomerism of Ru(II)-carbonyl complexes: synthesis, characterization and their antitrypanosomal activities","New J. Chem.","2017","","","","","10.1039/C7NJ00125H","","x-ray","0.7107","MoKα","","0.0783","0.0533","","","0.1388","0.1659","","","","","","1.063","","","","has coordinates","195865","2020-10-21","18:00:00",""
"7056126","12.495","0.0004","16.3401","0.0006","19.2663","0.0006","90","","101.085","0.002","90","","3860.2","0.2","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C41 H36 Cl F6 N2 O P3 Ru -","- C41 H36 Cl F6 N2 O P3 Ru -","- C164 H144 Cl4 F24 N8 O4 P12 Ru4 -","4","1","","Barbosa, Marilia; Correa, Rodrigo S.; Bastos, Tanira; Pozzi, Lucas; Moreira, Diogo R.; Ellena, Javier A.; Doriguetto, Antonio C.; Silveira, Rafael; Rodrigues de Oliveira, Clayton; Kuznetsov, Aleksey E.; Malta, Valeria rodrigues dos santos; Soares, Milena Botelho; Batista, Alzir A.","Structural isomerism of Ru(II)-carbonyl complexes: synthesis, characterization and their antitrypanosomal activities","New J. Chem.","2017","","","","","10.1039/C7NJ00125H","","x-ray","0.71073","MoKα","","0.0589","0.0579","","","0.1331","0.1338","","","","","","1.201","","","","has coordinates","195865","2020-10-21","18:00:00",""
"7056127","15.396","0.007","15.396","0.007","14.482","0.015","90","","90","","90","","3433","4","296","2","296","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C44 H20 F8 N4 Pt -","- C44 H20 F8 N4 Pt -","- C176 H80 F32 N16 Pt4 -","4","0.25","","Arunkumar, Chellaiah; Kooriyaden, Fasalu Rahman; Zhang, Xiaochen; Subramaniam, Sujatha; Zhao, Jianzhang","Fluorinated meso-tetraaryl Pt(II)-porphyrins: Structure, Photophysical, Electrochemical and Phosphorescent Oxygen Sensing Studies","New J. Chem.","2017","","","","","10.1039/C7NJ01141E","","","0.71073","MoKα","","0.0415","0.0307","","","0.0755","0.0984","","","","","","1.176","","","","has coordinates","195906","2020-10-21","18:00:00",""
"7056128","16.2871","0.0007","8.7492","0.0003","16.0372","0.0005","90","","113.761","0.002","90","","2091.57","0.14","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H24 F12 N4 Pt -","- C48 H24 F12 N4 Pt -","- C96 H48 F24 N8 Pt2 -","2","0.5","","Arunkumar, Chellaiah; Kooriyaden, Fasalu Rahman; Zhang, Xiaochen; Subramaniam, Sujatha; Zhao, Jianzhang","Fluorinated meso-tetraaryl Pt(II)-porphyrins: Structure, Photophysical, Electrochemical and Phosphorescent Oxygen Sensing Studies","New J. Chem.","2017","","","","","10.1039/C7NJ01141E","","","0.71073","MoKα","","0.042","0.0251","","","0.0648","0.0725","","","","","","1.104","","","","has coordinates","195906","2020-10-21","18:00:00",""
"7056129","13.9647","0.0005","17.0557","0.0006","12.7566","0.0004","90","","110.58","0.001","90","","2844.44","0.17","293","2","293","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C48 H34 Cl2 F8 N4 O16 Pt -","- C48 H26 Cl2 F8 N4 O16 Pt -","- C96 H52 Cl4 F16 N8 O32 Pt2 -","2","0.25","","Arunkumar, Chellaiah; Kooriyaden, Fasalu Rahman; Zhang, Xiaochen; Subramaniam, Sujatha; Zhao, Jianzhang","Fluorinated meso-tetraaryl Pt(II)-porphyrins: Structure, Photophysical, Electrochemical and Phosphorescent Oxygen Sensing Studies","New J. Chem.","2017","","","","","10.1039/C7NJ01141E","","","0.71073","MoKα","","0.0359","0.0359","","","0.0969","0.0969","","","","","","1.169","","","","has coordinates,has disorder","195906","2020-10-21","18:00:00",""
"7056130","12.8728","0.0015","9.7876","0.0011","15.2958","0.0019","90","","112.529","0.004","90","","1780.1","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C43 H35 Cl3 O4 -","- C43 H35 Cl3 O4 -","- C86 H70 Cl6 O8 -","2","1","","Jhulki, Samik; Bajpai, Alankriti; Nagarajaiah, H.; Chow, Tahsin J.; Moorthy, J. Narasimha","Tri- and tetraarylanthracenes with novel λ, χ and ψ topologies as blue-emissive as well as fluorescent host materials in organic light-emitting diodes (OLEDs)","New J. Chem.","2017","","","","","10.1039/C7NJ00324B","","","0.71073","MoKα","","0.1687","0.0962","","","0.2254","0.2441","","","","","","1.303","","","","has coordinates","195907","2020-10-21","18:00:00",""
"7056131","15.7016","0.0007","9.8725","0.0005","25.8617","0.0012","90","","99.232","0.001","90","","3957","0.3","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C87 H68 Cl12 O8 -","- C87 H68 Cl12 O8 -","- C174 H136 Cl24 O16 -","2","1","","Jhulki, Samik; Bajpai, Alankriti; Nagarajaiah, H.; Chow, Tahsin J.; Moorthy, J. Narasimha","Tri- and tetraarylanthracenes with novel λ, χ and ψ topologies as blue-emissive as well as fluorescent host materials in organic light-emitting diodes (OLEDs)","New J. Chem.","2017","","","","","10.1039/C7NJ00324B","","","0.71073","MoKα","","0.1725","0.0921","","","0.2","0.2233","","","","","","1.125","","","","has coordinates,has disorder","195907","2020-10-21","18:00:00",""
"7056132","9.5927","0.0012","9.8024","0.0011","12.2341","0.0016","69.693","0.011","88.749","0.01","76.188","0.01","1045.3","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H46 Mo2 N6 O10 -","- C42 H46 Mo2 N6 O10 -","- C42 H46 Mo2 N6 O10 -","1","0.5","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Sarkar, Bithika; Maurya, Mannar R.; Mukherjee, Sanjib K.; Chowdhury, Pramit","New polymeric, dimeric and mononuclear dioxidomolybdenum(vi) complexes with an ONO donor ligand: crystal structures, DFT calculations, catalytic performance and protein binding study of the ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00136C","","","0.71073","MoKα","","0.1125","0.0895","","","0.1996","0.213","","","","","","1.119","","","","has coordinates,has disorder","195954","2020-10-21","18:00:00",""
"7056133","10.252","0.006","15.389","0.008","14.046","0.008","90","","100.56","0.009","90","","2178","2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 Mo N4 O4 -","- C23 H22 Mo N4 O4 -","- C92 H88 Mo4 N16 O16 -","4","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Sarkar, Bithika; Maurya, Mannar R.; Mukherjee, Sanjib K.; Chowdhury, Pramit","New polymeric, dimeric and mononuclear dioxidomolybdenum(vi) complexes with an ONO donor ligand: crystal structures, DFT calculations, catalytic performance and protein binding study of the ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00136C","","","0.71073","MoKα","","0.1172","0.054","","","0.0994","0.1235","","","","","","0.98","","","","has coordinates","195954","2020-10-21","18:00:00",""
"7056134","11.092","0.004","8.109","0.003","18.807","0.006","90","","105.213","0.016","90","","1632.3","1","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H15 Mo N3 O4 -","- C17 H15 Mo N3 O4 -","- C68 H60 Mo4 N12 O16 -","4","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Sarkar, Bithika; Maurya, Mannar R.; Mukherjee, Sanjib K.; Chowdhury, Pramit","New polymeric, dimeric and mononuclear dioxidomolybdenum(vi) complexes with an ONO donor ligand: crystal structures, DFT calculations, catalytic performance and protein binding study of the ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00136C","","","0.71073","MoKα","","0.0799","0.059","","","0.1767","0.2021","","","","","","1.087","","","","has coordinates","195954","2020-10-21","18:00:00",""
"7056135","13.8977","0.0007","7.1879","0.0003","20.6638","0.0007","90","","98.207","0.004","90","","2043.08","0.15","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 Mo N3 O5 S -","- C19 H21 Mo N3 O5 S -","- C76 H84 Mo4 N12 O20 S4 -","4","1","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Sarkar, Bithika; Maurya, Mannar R.; Mukherjee, Sanjib K.; Chowdhury, Pramit","New polymeric, dimeric and mononuclear dioxidomolybdenum(vi) complexes with an ONO donor ligand: crystal structures, DFT calculations, catalytic performance and protein binding study of the ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00136C","","","0.71073","MoKα","","0.0556","0.0415","","","0.0857","0.0919","","","","","","1.057","","","","has coordinates","195954","2020-10-21","18:00:00",""
"7056136","28.2944","0.001","7.8023","0.0003","21.3607","0.0007","90","","100.514","0.003","90","","4636.4","0.3","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 Mo N5 O4 -","- C23 H23 Mo N5 O4 -","- C184 H184 Mo8 N40 O32 -","8","2","","Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Drew, Michael G. B.; Sarkar, Bithika; Maurya, Mannar R.; Mukherjee, Sanjib K.; Chowdhury, Pramit","New polymeric, dimeric and mononuclear dioxidomolybdenum(vi) complexes with an ONO donor ligand: crystal structures, DFT calculations, catalytic performance and protein binding study of the ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00136C","","","0.71073","MoKα","","0.1174","0.0647","","","0.0913","0.1057","","","","","","0.993","","","","has coordinates,has disorder","195954","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",""
"7056157","8.8042","0.0005","9.8572","0.0006","13.1313","0.0008","106.022","0.005","103.017","0.005","102.921","0.005","1016.28","0.12","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H23 F6 Na O7 -","- C15 H23 F6.006 Na O7 -","- C30 H46 F12.012 Na2 O14 -","2","1","","Catalano, Maria R.; Pellegrino, Anna Lucia; Rossi, Patrizia; Paoli, Paola; Cortelletti, Paolo; Pedroni, Marco; Speghini, Adolfo; Malandrino, Graziella","Upconverting Er3+, Yb3+ activated β-NaYF4 thin films: a solution route using a novel sodium β-diketonate polyether adduct","New J. Chem.","2017","","","","","10.1039/C7NJ00236J","","","1.54184","CuKα","","0.0558","0.0379","","","0.0927","0.1041","","","","","","1.029","","","","has coordinates,has disorder","196557","2020-10-21","18:00:00",""
"7056158","8.449","0.003","13.113","0.004","9.937","0.003","90","","102.064","0.003","90","","1076.6","0.6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H10 Cl4 Mo N O -","- C4 H10 Cl4 Mo N O -","- C16 H40 Cl16 Mo4 N4 O4 -","4","1","","Bartalucci, Niccolò; Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Schoch, Silvia; Zacchini, Stefano","Unusual activation pathways of amines in the reactions with molybdenum pentachloride","New J. Chem.","2017","","","","","10.1039/C6NJ03992H","","","0.71073","MoKα","","0.0343","0.0278","","","0.0648","0.0682","","","","","","1.041","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7056159","11.8263","0.0017","8.2825","0.0012","10.2388","0.0015","90","","90","","90","","1002.9","0.3","100","2","100","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C4 H7 Cl5 Mo N -","- C4 H7 Cl5 Mo N -","- C16 H28 Cl20 Mo4 N4 -","4","1","","Bartalucci, Niccolò; Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Schoch, Silvia; Zacchini, Stefano","Unusual activation pathways of amines in the reactions with molybdenum pentachloride","New J. Chem.","2017","","","","","10.1039/C6NJ03992H","","","0.71073","MoKα","","0.0248","0.0227","","","0.0392","0.0398","","","","","","1.083","","","","has coordinates","196571","2020-10-21","18:00:00",""
"7056160","13.8611","0.0007","13.6266","0.0007","14.124","0.0006","90","","90","","90","","2667.7","0.2","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H32 Cl9.6 Mo2 N2 O0.4 -","- C12 H32 Cl9.6 Mo2 N2 O0.4 -","- C48 H128 Cl38.4 Mo8 N8 O1.6 -","4","0.5","","Bartalucci, Niccolò; Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Schoch, Silvia; Zacchini, Stefano","Unusual activation pathways of amines in the reactions with molybdenum pentachloride","New J. Chem.","2017","","","","","10.1039/C6NJ03992H","","","0.71073","MoKα","","0.0813","0.0803","","","0.1909","0.1913","","","","","","1.212","","","","has coordinates,has disorder","196571","2020-10-21","18:00:00",""
"7056161","10.0833","0.0009","13.2029","0.001","16.6033","0.0012","90","","103.818","0.006","90","","2146.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C43 H42 Cl8 Mo N2 -","- C43 H42 Cl8 Mo N2 -","- C86 H84 Cl16 Mo2 N4 -","2","0.5","","Bartalucci, Niccolò; Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Schoch, Silvia; Zacchini, Stefano","Unusual activation pathways of amines in the reactions with molybdenum pentachloride","New J. Chem.","2017","","","","","10.1039/C6NJ03992H","","","0.71073","MoKα","","0.1822","0.0627","","","0.1378","0.1941","","","","","","0.97","","","","has coordinates,has disorder","196571","2020-10-21","18:00:00",""
"7056162","6.6315","0.0017","7.648","0.002","11.839","0.003","106.915","0.002","96.903","0.003","102.798","0.003","549.1","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H22 Cl8 Mo2 N2 -","- C12 H22 Cl8 Mo2 N2 -","- C12 H22 Cl8 Mo2 N2 -","1","0.5","","Bartalucci, Niccolò; Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Schoch, Silvia; Zacchini, Stefano","Unusual activation pathways of amines in the reactions with molybdenum pentachloride","New J. Chem.","2017","","","","","10.1039/C6NJ03992H","","","0.71073","MoKα","","0.0376","0.0317","","","0.0728","0.076","","","","","","1.093","","","","has coordinates","196571","2020-10-21","18:00:00",""
"7056163","7.9913","0.0005","27.2271","0.0015","13.7004","0.0008","90","","90.321","0.004","90","","2980.9","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H39 Cl8 Mo2 N6 -","- C14 H39 Cl8 Mo2 N6 -","- C56 H156 Cl32 Mo8 N24 -","4","1","","Bartalucci, Niccolò; Bortoluzzi, Marco; Marchetti, Fabio; Pampaloni, Guido; Schoch, Silvia; Zacchini, Stefano","Unusual activation pathways of amines in the reactions with molybdenum pentachloride","New J. Chem.","2017","","","","","10.1039/C6NJ03992H","","","0.71073","MoKα","","0.0534","0.0461","","","0.1042","0.1092","","","","","","1.063","","","","has coordinates","196571","2020-10-21","18:00:00",""
"7056164","12.633","0.003","9.977","0.002","12.085","0.002","90","","112.39","0.03","90","","1408.4","0.6","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H11 N7 -","- C17 H11 N7 -","- C68 H44 N28 -","4","0.5","","Cabrero-Antonino, Maria; Ballesteros-Garrido, Rafael; Chiassai, Leonardo; Escrivá, Emilio; Ramirez de Arellano, Carmen; Ballesteros, Rafael; Abarca, Belén","Synthesis of New Terpyridine-like ligands based on Triazolopyridines and Benzotriazoles","New J. Chem.","2017","","","","","10.1039/C7NJ00962C","","","0.71073","MoKα","","0.0648","0.0398","","","0.102","0.1116","","","","","","1.058","","","","has coordinates","196611","2020-10-21","18:00:00",""
"7056165","13.4031","0.0003","25.5461","0.0005","13.0244","0.0003","90","","91.208","0.002","90","","4458.52","0.17","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H31 F12 N17 P2 Ru -","- C40 H31 F12 N17 P2 Ru -","- C160 H124 F48 N68 P8 Ru4 -","4","1","","Cabrero-Antonino, Maria; Ballesteros-Garrido, Rafael; Chiassai, Leonardo; Escrivá, Emilio; Ramirez de Arellano, Carmen; Ballesteros, Rafael; Abarca, Belén","Synthesis of New Terpyridine-like ligands based on Triazolopyridines and Benzotriazoles","New J. Chem.","2017","","","","","10.1039/C7NJ00962C","","","0.71073","MoKα","","0.0955","0.056","","","0.1296","0.1541","","","","","","1.074","","","","has coordinates","196611","2020-10-21","18:00:00",""
"7056166","11.5077","0.001","12.262","0.0007","15.7286","0.0011","90","","109.805","0.009","90","","2088.1","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","2,2,6,6,13-pentamethyl-3-methylene-2,2a,2a1,3,4,5,5a,6-octahydroindolo[3,2,1-de]pyrano[5,4,3,2-lmn]-phenanthridine","","- C26 H29 N O -","- C26 H29 N O -","- C104 H116 N4 O4 -","4","2","","Yedukondalu, Nalli; Thakur, Vandana; Mohmmed, Asif; Gupta, Vivek; Ali, Asif","POCl3-mediated Cyclization of (+)-S-Mahanimbine Led to the Divergent Synthesis of Natural Product Derivatives with Antiplasmodial Activity.","New J. Chem.","2017","","","","","10.1039/C7NJ00487G","","","0.71073","MoKα","","0.082","0.0463","","","0.0787","0.0911","","","","","","1.031","","","","has coordinates","196621","2020-10-21","18:00:00",""
"7056167","8.4284","0.0006","18.5039","0.0014","23.3119","0.0016","90","","93.851","0.005","90","","3627.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","MK-POCL3-R","5,7-dimethyl-2-(propan-2-ylidene)-1,2,3,4,5,13-hexahydro-1,5- methanooxocino[3,2-a]carbazole","","- C23 H25 N O -","- C23 H25 N O -","- C184 H200 N8 O8 -","8","2","","Yedukondalu, Nalli; Thakur, Vandana; Mohmmed, Asif; Gupta, Vivek; Ali, Asif","POCl3-mediated Cyclization of (+)-S-Mahanimbine Led to the Divergent Synthesis of Natural Product Derivatives with Antiplasmodial Activity.","New J. Chem.","2017","","","","","10.1039/C7NJ00487G","","","0.71073","MoKα","","0.176","0.0791","","","0.1726","0.2269","","","","","","0.989","","","","has coordinates","203412","2020-10-21","18:00:00",""
"7056168","13.1508","0.001","13.2882","0.0009","16.3883","0.0009","90","","104.519","0.007","90","","2772.4","0.3","293.6","0.4","293.6","0.4","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H25 N4 O14 Sm Zn -","- C22 H25 N4 O14 Sm Zn -","- C88 H100 N16 O56 Sm4 Zn4 -","4","1","","Zheng, Shan shan; Dong, WK; Zhang, Yang; Chen, Le; Ding, Yujie","Four Salamo-type 3d-4f hetero-bimetallic [ZnIILnIII] complexes: Syntheses, Crystal Structures, Luminescent and Magnetic Properties","New J. Chem.","2017","","","","","10.1039/C6NJ04090J","","","0.7107","MoKα","","0.1443","0.0724","","","0.0931","0.1335","","","","","","0.967","","","","has coordinates,has disorder","196622","2020-10-21","18:00:00",""
"7056169","13.1508","0.0007","13.2769","0.0005","16.3725","0.0009","90","","104.442","0.006","90","","2768.3","0.2","298.84","0.1","298.84","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H25 Eu N4 O14 Zn -","- C22 H25 Eu N4 O14 Zn -","- C88 H100 Eu4 N16 O56 Zn4 -","4","1","","Zheng, Shan shan; Dong, WK; Zhang, Yang; Chen, Le; Ding, Yujie","Four Salamo-type 3d-4f hetero-bimetallic [ZnIILnIII] complexes: Syntheses, Crystal Structures, Luminescent and Magnetic Properties","New J. Chem.","2017","","","","","10.1039/C6NJ04090J","","x-ray","0.71073","MoKα","","0.0931","0.049","","","0.0639","0.0842","","","","","","1.014","","","","has coordinates,has disorder","196622","2020-10-21","18:00:00",""
"7056170","13.095","0.0005","13.2699","0.0004","16.3621","0.0006","90","","104.27","0.004","90","","2755.5","0.17","298.84","0.1","298.84","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H25 Dy N4 O14 Zn -","- C22 H25 Dy N4 O14 Zn -","- C88 H100 Dy4 N16 O56 Zn4 -","4","1","","Zheng, Shan shan; Dong, WK; Zhang, Yang; Chen, Le; Ding, Yujie","Four Salamo-type 3d-4f hetero-bimetallic [ZnIILnIII] complexes: Syntheses, Crystal Structures, Luminescent and Magnetic Properties","New J. Chem.","2017","","","","","10.1039/C6NJ04090J","","x-ray","0.71073","MoKα","","0.0489","0.0337","","","0.0563","0.0642","","","","","","1.042","","","","has coordinates,has disorder","196622","2020-10-21","18:00:00",""
"7056171","13.113","0.0006","13.2655","0.0005","16.3649","0.0007","90","","104.34","0.005","90","","2758","0.2","298.84","0.1","298.84","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H25 N4 O14 Tb Zn -","- C22 H25 N4 O14 Tb Zn -","- C88 H100 N16 O56 Tb4 Zn4 -","4","1","","Zheng, Shan shan; Dong, WK; Zhang, Yang; Chen, Le; Ding, Yujie","Four Salamo-type 3d-4f hetero-bimetallic [ZnIILnIII] complexes: Syntheses, Crystal Structures, Luminescent and Magnetic Properties","New J. Chem.","2017","","","","","10.1039/C6NJ04090J","","x-ray","0.71073","MoKα","","0.0615","0.0386","","","0.061","0.0723","","","","","","1.046","","","","has coordinates,has disorder","196622","2020-10-21","18:00:00",""
"7056172","8.153","0.0005","11.1982","0.001","14.3416","0.0008","78.653","0.006","84.574","0.005","83.732","0.006","1272.51","0.16","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H27 Cl2 Ir N4 -","- C21 H27 Cl2 Ir N4 -","- C42 H54 Cl4 Ir2 N8 -","2","1","","Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.","Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01079F","","","1.54184","CuKα","","0.0574","0.056","","","0.1504","0.1516","","","","","","1.106","","","","has coordinates","196736","2020-10-21","18:00:00",""
"7056173","8.2836","0.0005","11.4551","0.0009","12.2705","0.0007","103.762","0.006","93.088","0.005","104.169","0.006","1088.71","0.13","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H23 Cl Co F6 N4 P -","- C19 H23 Cl Co F6 N4 P -","- C38 H46 Cl2 Co2 F12 N8 P2 -","2","1","","Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.","Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01079F","","","1.54184","CuKα","","0.0464","0.0405","","","0.0984","0.1018","","","","","","1.028","","","","has coordinates","196736","2020-10-21","18:00:00",""
"7056174","8.3924","0.0004","11.5244","0.0005","13.1783","0.0006","109.543","0.004","92.325","0.004","108.365","0.004","1124.68","0.1","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C20 H25 Cl Co F6 N4 P -","- C20 H25 Cl Co F6 N4 P -","- C40 H50 Cl2 Co2 F12 N8 P2 -","2","1","","Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.","Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01079F","","","0.71073","MoKα","","0.0405","0.0339","","","0.0764","0.0794","","","","","","1.05","","","","has coordinates","196736","2020-10-21","18:00:00",""
"7056175","12.9323","0.0003","8.1971","0.0002","10.4445","0.0003","90","","90","","90","","1107.19","0.05","150","2","150","2","","","","","","","","7","P m n 21","P 2ac -2","31","","","","- C20 H23 Cl F6 N2 P Rh -","- C20 H23 Cl F6 N2 P Rh -","- C40 H46 Cl2 F12 N4 P2 Rh2 -","2","0.5","","Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.","Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01079F","","","1.54184","CuKα","","0.0257","0.0254","","","0.0637","0.0646","","","","","","1.075","","","","has coordinates","196736","2020-10-21","18:00:00",""
"7056176","8.2257","0.0003","11.4475","0.0004","12.6623","0.0004","102","0.003","93.609","0.003","105.079","0.003","1117.44","0.07","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H23 Cl F6 N4 P Rh -","- C19 H23 Cl F6 N4 P Rh -","- C38 H46 Cl2 F12 N8 P2 Rh2 -","2","1","","Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.","Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01079F","","","0.71073","MoKα","","0.0363","0.0318","","","0.076","0.0784","","","","","","1.041","","","","has coordinates","196736","2020-10-21","18:00:00",""
"7056177","8.8142","0.0001","15.6347","0.0002","15.1228","0.0002","90","","90.195","0.001","90","","2084.02","0.05","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H23 B Cl F4 Ir N4 -","- C19 H23 B Cl F4 Ir N4 -","- C76 H92 B4 Cl4 F16 Ir4 N16 -","4","1","","Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.","Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01079F","","","0.71073","MoKα","","0.0267","0.0229","","","0.0453","0.0466","","","","","","1.124","","","","has coordinates","196736","2020-10-21","18:00:00",""
"7056178","8.5377","0.0002","21.2436","0.0004","11.3841","0.0002","90","","94.301","0.002","90","","2058.94","0.07","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H22 B Cl F4 Ir N3 -","- C19 H22 B Cl F4 Ir N3 -","- C76 H88 B4 Cl4 F16 Ir4 N12 -","4","1","","Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.","Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01079F","","","0.71073","MoKα","","0.0422","0.0331","","","0.0664","0.0692","","","","","","1.139","","","","has coordinates","196736","2020-10-21","18:00:00",""
"7056179","13.252","0.003","16.668","0.002","10.2556","0.0018","90","","103.378","0.014","90","","2203.8","0.7","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C31 H23 P -","- C31 H23 P -","- C124 H92 P4 -","4","1","","Hariharan, P. S.; Mariyatra, M. Baby; Mothi, E. M.; Neels, Antonia; Rosair, Georgina; Anthony, Savarimuthu Philip","Polymorphism and benzene solvent controlled stimuli responsive reversible fluorescence switching in triphenylphosphoniumfluorenylide crystals","New J. Chem.","2017","","","","","10.1039/C7NJ01136A","","","0.71073","MoKα","","0.0533","0.0454","","","0.1205","0.1284","","","","","","1.081","","","","has coordinates","196737","2020-10-21","18:00:00",""
"7056180","27.996","0.002","11.8779","0.0009","17.3544","0.0013","90","","113.26","0.003","90","","5301.9","0.7","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C37 H29 P -","- C37 H29 P -","- C296 H232 P8 -","8","1","","Hariharan, P. S.; Mariyatra, M. Baby; Mothi, E. M.; Neels, Antonia; Rosair, Georgina; Anthony, Savarimuthu Philip","Polymorphism and benzene solvent controlled stimuli responsive reversible fluorescence switching in triphenylphosphoniumfluorenylide crystals","New J. Chem.","2017","","","","","10.1039/C7NJ01136A","","","0.71073","MoKα","","0.0598","0.038","","","0.0985","0.1189","","","","","","1.106","","","","has coordinates","196737","2020-10-21","18:00:00",""
"7056181","9.474","0.004","10.294","0.004","13.926","0.005","98.394","0.003","105.105","0.003","115.34","0.004","1132.3","0.8","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H40 N3 O12 P3 -","- C11 H40 N3 O12 P3 -","- C22 H80 N6 O24 P6 -","2","1","","Sun, Yu-Ling; Zheng, Bei-Bei; Zhang, Wen","Role of crystallization water molecules on hydrogen-bonded structures and dielectric phase transitions in amino trimethylene phosphonic acid-based crystals","New J. Chem.","2017","","","","","10.1039/C7NJ00612H","","","0.71073","MoKα","","0.0438","0.0356","","","0.1008","0.1148","","","","","","1.089","","","","has coordinates","196738","2020-10-21","18:00:00",""
"7056182","14.728","0.0017","14.728","0.0017","23.716","0.005","90","","90","","120","","4455.1","1.2","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C30 H92 N8 O19 P6 -","- C30 H92.0004 N8 O19 P6 -","- C90 H276.001 N24 O57 P18 -","3","0.166667","","Sun, Yu-Ling; Zheng, Bei-Bei; Zhang, Wen","Role of crystallization water molecules on hydrogen-bonded structures and dielectric phase transitions in amino trimethylene phosphonic acid-based crystals","New J. Chem.","2017","","","","","10.1039/C7NJ00612H","","","0.71073","MoKα","","0.1047","0.0775","","","0.2244","0.2479","","","","","","1.057","","","","has coordinates","196738","2020-10-21","18:00:00",""
"7056183","9.528","0.003","10.348","0.004","14.003","0.005","98.391","0.004","105.168","0.002","115.423","0.002","1149.5","0.7","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H40 N3 O12 P3 -","- C11 H40 N3 O12 P3 -","- C22 H80 N6 O24 P6 -","2","1","","Sun, Yu-Ling; Zheng, Bei-Bei; Zhang, Wen","Role of crystallization water molecules on hydrogen-bonded structures and dielectric phase transitions in amino trimethylene phosphonic acid-based crystals","New J. Chem.","2017","","","","","10.1039/C7NJ00612H","","","0.71073","MoKα","","0.052","0.0414","","","0.125","0.1464","","","","","","1.094","","","","has coordinates","196738","2020-10-21","18:00:00",""
"7056184","11.42","0.007","11.647","0.007","11.79","0.007","104.083","0.008","99.682","0.005","103.12","0.008","1439.3","1.5","103","2","103","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H94 N8 O20 P6 -","- C30 H96 N8 O21 P6 -","- C30 H96 N8 O21 P6 -","1","0.5","","Sun, Yu-Ling; Zheng, Bei-Bei; Zhang, Wen","Role of crystallization water molecules on hydrogen-bonded structures and dielectric phase transitions in amino trimethylene phosphonic acid-based crystals","New J. Chem.","2017","","","","","10.1039/C7NJ00612H","","","0.71073","MoKα","","0.045","0.0388","","","0.1062","0.1117","","","","","","1.068","","","","has coordinates","196738","2020-10-21","18:00:00",""
"7056185","11.474","0.009","11.641","0.009","11.834","0.009","103.678","0.009","99.604","0.005","102.404","0.011","1460","2","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H96 N8 O21 P6 -","- C30 H92 N8 O21 P6 -","- C30 H92 N8 O21 P6 -","1","0.5","","Sun, Yu-Ling; Zheng, Bei-Bei; Zhang, Wen","Role of crystallization water molecules on hydrogen-bonded structures and dielectric phase transitions in amino trimethylene phosphonic acid-based crystals","New J. Chem.","2017","","","","","10.1039/C7NJ00612H","","","0.71073","MoKα","","0.0539","0.0441","","","0.1171","0.1241","","","","","","1.026","","","","has coordinates,has disorder","196738","2020-10-21","18:00:00",""
"7056186","11.1904","0.0016","13.7744","0.0017","14.105","0.002","90","","102.815","0.006","90","","2120","0.5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 N O4 -","- C23 H28 N O4 -","- C92 H112 N4 O16 -","4","1","","Pal, Santanu Kumar; Kaur, Supreet; Punjani, Vidhika; Mohiuddin, Golam","Orthogonal smectic and nematic ordering in three-ring polar bent-core molecules with anti-parallel arrangement","New J. Chem.","2017","","","","","10.1039/C7NJ00272F","","","0.71075","MoKα","","0.122","0.0756","","","0.1928","0.2453","","","","","","1.071","","","","has coordinates","196739","2020-10-21","18:00:00",""
"7056187","8.431","0.007","9.94","0.003","13.486","0.015","108.84","0.07","98.46","0.18","96.64","0.16","1041.8","1.8","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H24 F N O4 -","- C25 H24 F N O4 -","- C50 H48 F2 N2 O8 -","2","1","","Pal, Santanu Kumar; Kaur, Supreet; Punjani, Vidhika; Mohiuddin, Golam","Orthogonal smectic and nematic ordering in three-ring polar bent-core molecules with anti-parallel arrangement","New J. Chem.","2017","","","","","10.1039/C7NJ00272F","","","0.71075","MoKα","","0.0706","0.0562","","","0.1379","0.1794","","","","","","0.974","","","","has coordinates","196739","2020-10-21","18:00:00",""
"7056188","9.7378","0.0005","33.4196","0.0017","13.9653","0.0006","90","","105.609","0.001","90","","4377.2","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[diaquatetraquis((2,6-dichlorophenyl)amino)phenyl)acetato-k2O,O')bis((mu-2,6-dichlorophenyl)amino)phenyl)acetato-k2O,O':kO)dimethanoldidysprosium(III)]","","- C86 H72 Cl12 Dy2 N6 O16 -","- C86 H72 Cl12 Dy2 N6 O16 -","- C172 H144 Cl24 Dy4 N12 O32 -","2","0.5","","Echenique-Errandonea, Estitxu; Oyarzabal, Itziar; Cepeda, Javier; San sebastian, Eider; Rodriguez-Dieguez, Antonio; Seco, José M","Photoluminescent and magnetic analysis of a family of lanthanide(III) complexes based on diclofenac","New J. Chem.","2017","","","","","10.1039/C7NJ00794A","","","0.71073","MoKα","","0.1351","0.0655","","","0.0656","0.0771","","","","","","1.064","","","","has coordinates","196740","2020-10-21","18:00:00",""
"7056189","9.87","0.0004","33.5491","0.0016","13.9418","0.0006","90","","105.907","0.0012","90","","4439.8","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[diaquatetraquis((2,6-dichlorophenyl)amino)phenyl)acetato-k2O,O')bis((mu-2,6-dichlorophenyl)amino)phenyl)acetato-k2O,O':kO)dimethanoldipraseodymium(III)]","","- C86 H72 Cl12 N6 O16 Pr2 -","- C86 H72 Cl12 N6 O16 Pr2 -","- C172 H144 Cl24 N12 O32 Pr4 -","2","0.5","","Echenique-Errandonea, Estitxu; Oyarzabal, Itziar; Cepeda, Javier; San sebastian, Eider; Rodriguez-Dieguez, Antonio; Seco, José M","Photoluminescent and magnetic analysis of a family of lanthanide(III) complexes based on diclofenac","New J. Chem.","2017","","","","","10.1039/C7NJ00794A","","","0.71073","MoKα","","0.0282","0.023","","","0.0501","0.0519","","","","","","1.061","","","","has coordinates","196740","2020-10-21","18:00:00",""
"7056190","43.418","0.011","7.5014","0.0018","14.333","0.004","90","","105.777","0.008","90","","4492","2","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H15 N3 O7 S -","- C27 H15 N3 O7 S -","- C216 H120 N24 O56 S8 -","8","1","","_, Shweta; Kumar, Ajit; -, Neeraj; Ashthana, Sharad Kumar; Upadhyay, Kaushal Kumar","A smart ratiometric red fluorescent chemodosimeter for fluoride based on anthraquinone nosylate","New J. Chem.","2017","","","","","10.1039/C7NJ01575E","","","0.71073","MoKα","","0.0999","0.0575","","","0.1378","0.1685","","","","","","1.041","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7056191","13.4552","0.0012","13.5618","0.0012","25.287","0.002","96.117","0.003","103.136","0.003","91.355","0.003","4462.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H122 N4 O10 Ti2 -","- C74 H122 N4 O10 Ti2 -","- C148 H244 N8 O20 Ti4 -","2","1","","Wang, Baolong; Zhao, Huanqin; Wang, Liying; Sun, Junmin; Zhang, Yongfeng; Cao, Zhenzhu","Immortal Ring-Opening Polymerization of Lactides with Super High Monomer to Catalyst Ratios Initiated by Zirconium and Titanium Complexes Containing Multidentate Amino-bis(phenolate) Ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00483D","","","0.71073","MoKα","","0.0809","0.0588","","","0.147","0.158","","","","","","1.02","","","","has coordinates,has disorder","196742","2020-10-21","18:00:00",""
"7056192","11.867","0.0006","16.2871","0.0009","24.4789","0.0014","105.498","0.002","90.376","0.002","102.18","0.002","4446.6","0.4","282","2","282","2","","","","","","","","5","P -1","-P 1","2","","","","- C81 H124 N4 O6 Zr -","- C81 H124 N4 O6 Zr -","- C162 H248 N8 O12 Zr2 -","2","1","","Wang, Baolong; Zhao, Huanqin; Wang, Liying; Sun, Junmin; Zhang, Yongfeng; Cao, Zhenzhu","Immortal Ring-Opening Polymerization of Lactides with Super High Monomer to Catalyst Ratios Initiated by Zirconium and Titanium Complexes Containing Multidentate Amino-bis(phenolate) Ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00483D","","","0.71073","MoKα","","0.0573","0.0495","","","0.1367","0.1426","","","","","","1.005","","","","has coordinates,has disorder","196742","2020-10-21","18:00:00",""
"7056193","18.6301","0.0016","5.101","0.0005","16.2579","0.0014","90","","119.173","0.003","90","","1349","0.2","298","2","298","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C24 H30 F2 N0 O4 S2 Sn -","- C24 H30 F2 O4 S2 Sn -","- C48 H60 F4 O8 S4 Sn2 -","2","0.5","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.0667","0.0641","","","0.1684","0.1722","","","","","","1.038","","","","has coordinates,has disorder","196743","2020-10-21","18:00:00",""
"7056194","29.26","0.003","5.217","0.0005","20.7101","0.0018","90","","121.175","0.002","90","","2704.8","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H30 F2 O4 Se2 Sn -","- C24 H30 F2 O4 Se2 Sn -","- C96 H120 F8 O16 Se8 Sn4 -","4","0.5","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.1128","0.0697","","","0.1632","0.1795","","","","","","1.078","","","","has coordinates,has disorder","196743","2020-10-21","18:00:00",""
"7056195","11.6817","0.0009","11.9698","0.001","17.8333","0.0015","90","","94.401","0.001","90","","2486.2","0.4","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H48 F4 O10 S4 Sn4 -","- C40 H48 F4 O10 S4 Sn4 -","- C80 H96 F8 O20 S8 Sn8 -","2","0.5","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.0874","0.0437","","","0.0779","0.093","","","","","","0.962","","","","has coordinates","196743","2020-10-21","18:00:00",""
"7056196","9.6149","0.0008","12.9348","0.0011","22.7853","0.0019","90","","90","","90","","2833.7","0.4","298","2","298","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 F O2 Se Sn -","- C11 H15 F O2 Se Sn -","- C88 H120 F8 O16 Se8 Sn8 -","8","2","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.1378","0.0751","","","0.1801","0.2055","","","","","","0.965","","","","has coordinates","196743","2020-10-21","18:00:00",""
"7056197","17.0682","0.0014","15.0174","0.0013","20.0535","0.0017","90","","93.693","0.001","90","","5129.4","0.8","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C40 H48 F4 O10 Se4 Sn4 -","- C40 H48 F4 O10 Se4 Sn4 -","- C160 H192 F16 O40 Se16 Sn16 -","4","0.5","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.0813","0.048","","","0.1088","0.1259","","","","","","1.05","","","","has coordinates,has disorder","196743","2020-10-21","18:00:00",""
"7056198","10.5943","0.0009","14.476","0.0013","16.9105","0.0014","87.293","0.001","90.023","0.002","68.535","0.011","2410.4","0.4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H66 F2 O4 S2 Sn2 -","- C40 H66 F2 O4 S2 Sn2 -","- C80 H132 F4 O8 S4 Sn4 -","2","1","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.2374","0.1224","","","0.2919","0.318","","","","","","1.237","","","","has coordinates","196743","2020-10-21","18:00:00",""
"7056199","11.0008","0.0011","10.2461","0.0009","13.0833","0.0012","90","","107.192","0.002","90","","1408.8","0.2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H15 F O2 S Sn -","- C11 H15 F O2 S Sn -","- C44 H60 F4 O8 S4 Sn4 -","4","1","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.0681","0.0388","","","0.0821","0.0975","","","","","","1.073","","","","has coordinates,has disorder","196743","2020-10-21","18:00:00",""
"7056200","10.3868","0.0008","13.7639","0.0011","18.295","0.0016","111.926","0.003","97.549","0.002","90.506","0.001","2400.5","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H66 F2 O4 Se2 Sn2 -","- C40 H66 F2 O4 Se2 Sn2 -","- C80 H132 F4 O8 Se4 Sn4 -","2","1","","Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin","Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ00500H","","","0.71073","MoKα","","0.1386","0.0666","","","0.1317","0.145","","","","","","1.11","","","","has coordinates","196743","2020-10-21","18:00:00",""
"7056201","9.5986","0.0005","9.7691","0.0005","10.0811","0.0005","102.586","0.003","97.413","0.002","116.651","0.002","796.22","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H17 N2 O4 P -","- C16 H17 N2 O4 P -","- C32 H34 N4 O8 P2 -","2","1","","Sudhapriya, Narayanasamy; Balachandran, Chandrasekar; Awale, Suresh; Perumal, Paramasivan Thirumalai","Sn(II)-mediated facile approach for the synthesis of 2-aryl-2H-indazole-3-phosphonates and their anticancer activity","New J. Chem.","2017","","","","","10.1039/C7NJ00843K","","","0.71073","MoKα","","0.0585","0.0378","","","0.0903","0.1066","","","","","","1.045","","","","has coordinates","196744","2020-10-21","18:00:00",""
"7056202","10.396","0.002","11.229","0.002","5.8102","0.0013","90","","90","","90","","678.3","0.2","173","2","173","2","","","","","","","","4","P n n 2","P 2 -2n","34","","","","- C5 H6 N8 O13 -","- C5 H6 N8 O13 -","- C10 H12 N16 O26 -","2","0.5","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Yang, Hongwei","An interesting ring cleavage of 1,2,4-oxadiazole ring","New J. Chem.","2017","","","","","10.1039/C7NJ01119A","","","0.71073","MoKα","","0.0729","0.0449","","","0.0834","0.096","","","","","","1.01","","","","has coordinates","196785","2020-10-21","18:00:00",""
"7056203","8.8179","0.0015","9.2863","0.0016","11.802","0.002","90","","101.562","0.004","90","","946.8","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 N7 O7 -","- C4 H5 N7 O7 -","- C16 H20 N28 O28 -","4","1","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Yang, Hongwei","An interesting ring cleavage of 1,2,4-oxadiazole ring","New J. Chem.","2017","","","","","10.1039/C7NJ01119A","","","0.71073","MoKα","","0.119","0.0498","","","0.0728","0.0878","","","","","","1.02","","","","has coordinates","196785","2020-10-21","18:00:00",""
"7056204","7.1401","0.0011","7.804","0.0013","10.6428","0.0019","90","","109.113","0.003","90","","560.34","0.16","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C4 H5 N7 O10 -","- C4 H5 N7 O10 -","- C8 H10 N14 O20 -","2","1","","Yu, Qiong; Cheng, Guangbin; Ju, Xuehai; Lu, Chunxu; Yang, Hongwei","An interesting ring cleavage of 1,2,4-oxadiazole ring","New J. Chem.","2017","","","","","10.1039/C7NJ01119A","","","0.71073","MoKα","","0.0694","0.0444","","","0.0763","0.087","","","","","","1.022","","","","has coordinates","196785","2020-10-21","18:00:00",""
"7056205","12.7372","0.001","13.5883","0.0012","26.157","0.003","82.596","0.003","76.789","0.003","82.552","0.003","4347","0.7","150","","150","","","","","","","","synthesis as described","5","P 1","P 1","1","","","","- C97.5 H77.5 Cl4.5 N10 O8 -","- C97.5 H77.5 Cl4.5 N10 O8 -","- C195 H155 Cl9 N20 O16 -","2","2","","Gallo, Emma; Carminati, Daniela; Intrieri, Daniela; Le Gac, Stéphane; Roisnel, Thierry; Boitrel, Bernard; Toma, Lucio; Legnani, Laura","Synthesis, Characterisation and Catalytic Use of Iron Porphyrin Amino Ester Conjugates","New J. Chem.","2017","","","","","10.1039/C7NJ01189J","","x-ray","0.71073","MoKα","","0.0993","0.0811","","","0.2286","0.249","","","","","","1.101","","","","has coordinates","203412","2020-10-21","18:00:00",""
"7056206","8.5886","0.0002","9.2505","0.0003","9.5924","0.0003","75.382","0.003","71.148","0.003","87.868","0.003","697.06","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H26 Cl4 F2 N8 P4 -","- C20 H26 Cl4 F2 N8 P4 -","- C20 H26 Cl4 F2 N8 P4 -","1","0.5","","Elmas, Gamze; Okumuş, Aytuğ; Sevinç, Pelin; Kılıç, Zeynel; Açık, Leyla; Atalan, Mustafa; Turk, Mustafa; Deniz, Gökberk; Hökelek, Tuncer","Phosphorus-nitrogen compounds. Part 37. Syntheses and structural characterizations, biological activities of mono and bis(4-fluorobenzyl)spirocyclotetraphosphazenes","New J. Chem.","2017","","","","","10.1039/C7NJ00478H","","","0.71073","MoKα","","0.0471","0.0425","","","0.1132","0.1176","","","","","","1.055","","","","has coordinates","196820","2020-10-21","18:00:00",""
"7056207","37.3694","0.0012","10.3766","0.0003","15.8615","0.0005","90","","90","","90","","6150.6","0.3","173","2","173","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C22 H30 Cl4 F2 N8 P4 -","- C22 H30 Cl4 F2 N8 P4 -","- C176 H240 Cl32 F16 N64 P32 -","8","1","","Elmas, Gamze; Okumuş, Aytuğ; Sevinç, Pelin; Kılıç, Zeynel; Açık, Leyla; Atalan, Mustafa; Turk, Mustafa; Deniz, Gökberk; Hökelek, Tuncer","Phosphorus-nitrogen compounds. Part 37. Syntheses and structural characterizations, biological activities of mono and bis(4-fluorobenzyl)spirocyclotetraphosphazenes","New J. Chem.","2017","","","","","10.1039/C7NJ00478H","","","0.71073","MoKα","","0.0835","0.0482","","","0.0872","0.0984","","","","","","1.038","","","","has coordinates","196820","2020-10-21","18:00:00",""
"7056208","8.8404","0.0003","19.0391","0.0005","9.1699","0.0003","90","","101.828","0.002","90","","1510.64","0.08","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Cl4 F2 N8 P4 -","- C22 H30 Cl4 F2 N8 P4 -","- C44 H60 Cl8 F4 N16 P8 -","2","0.5","","Elmas, Gamze; Okumuş, Aytuğ; Sevinç, Pelin; Kılıç, Zeynel; Açık, Leyla; Atalan, Mustafa; Turk, Mustafa; Deniz, Gökberk; Hökelek, Tuncer","Phosphorus-nitrogen compounds. Part 37. Syntheses and structural characterizations, biological activities of mono and bis(4-fluorobenzyl)spirocyclotetraphosphazenes","New J. Chem.","2017","","","","","10.1039/C7NJ00478H","","","0.71073","MoKα","","0.0558","0.0371","","","0.0987","0.1157","","","","","","1.081","","","","has coordinates","196820","2020-10-21","18:00:00",""
"7056209","14.1757","0.0006","9.6136","0.0003","17.0845","0.0006","90","","97.777","0.002","90","","2306.85","0.15","160","2","160","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C16 H19 I4 N2 O4 -","- C16 H19 I4 N2 O4 -","- C64 H76 I16 N8 O16 -","4","1","","Hadjikakou, Sotiris K.; Banti, C. N.; Kourkoumelis, Nikolaos; Raptopoulou, Catherine; Psycharis, Vassilis","N-(4-hydroxyphenyl)acetamide against di-iodine towards polyiodide dianion","New J. Chem.","2017","","","","","10.1039/C7NJ01117B","","","0.71073","MoKα","","0.0264","0.0234","","","0.0543","0.0557","","","","","","1.05","","","","has coordinates","196895","2020-10-21","18:00:00",""
"7056210","10.1275","0.0003","15.4288","0.0004","19.3778","0.0006","90","","103.679","0.002","90","","2942","0.15","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H35 Fe N4 O3 -","- C35 H35 Fe N4 O3 -","- C140 H140 Fe4 N16 O12 -","4","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0395","0.0258","","","0.047","0.0481","","","","","","0.82","","","","has coordinates","196896","2020-10-21","18:00:00",""
"7056211","10.2617","0.0003","15.2514","0.0003","19.5057","0.0005","90","","105.111","0.002","90","","2947.19","0.13","110","","110","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H35 Fe N6 O2 -","- C34 H35 Fe N6 O2 -","- C136 H140 Fe4 N24 O8 -","4","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0338","0.0268","","","0.0651","0.0671","","","","","","1.007","","","","has coordinates","196896","2020-10-21","18:00:00",""
"7056212","10.3034","0.0003","15.3208","0.0004","18.1489","0.0006","90","","101.693","0.003","90","","2805.46","0.15","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H31 Cl Fe N3 O2 -","- C32 H31 Cl Fe N3 O2 -","- C128 H124 Cl4 Fe4 N12 O8 -","4","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0458","0.0404","","","0.1097","0.1126","","","","","","1.054","","","","has coordinates","196896","2020-10-21","18:00:00",""
"7056213","18.7577","0.0005","18.8838","0.0006","16.1938","0.0004","90","","90","","90","","5736.1","0.3","100","","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C32 H31 Fe N6 O2 -","- C32 H31 Fe N6 O2 -","- C256 H248 Fe8 N48 O16 -","8","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0468","0.0307","","","0.0686","0.0717","","","","","","0.878","","","","has coordinates","196896","2020-10-21","18:00:00",""
"7056214","9.8877","0.0002","12.8918","0.0002","13.8494","0.0002","102.167","0.001","97.837","0.001","109.243","0.001","1588.28","0.05","110","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H29 Br2 Fe N6 O2 -","- C32 H29 Br2 Fe N6 O2 -","- C64 H58 Br4 Fe2 N12 O4 -","2","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0352","0.0329","","","0.0898","0.0908","","","","","","1.123","","","","has coordinates,has disorder","196896","2020-10-21","18:00:00",""
"7056215","9.6274","0.0003","15.2106","0.0003","19.5026","0.0007","90","","97.639","0.003","90","","2830.59","0.15","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H25 Cl2 Fe N6 O2 -","- C30 H25 Cl2 Fe N6 O2 -","- C120 H100 Cl8 Fe4 N24 O8 -","4","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0555","0.0458","","","0.1257","0.1347","","","","","","1.082","","","","has coordinates","196896","2020-10-21","18:00:00",""
"7056216","9.4543","0.0003","15.3791","0.0004","19.5339","0.0005","90","","95.402","0.002","90","","2827.59","0.14","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H25 Cl2 Fe N4 O3 -","- C31 H25 Cl2 Fe N4 O3 -","- C124 H100 Cl8 Fe4 N16 O12 -","4","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0362","0.0328","","","0.0941","0.0984","","","","","","1.077","","","","has coordinates","196896","2020-10-21","18:00:00",""
"7056217","10.1152","0.0003","13.0131","0.0003","13.8985","0.0004","101.157","0.002","96.653","0.002","110.337","0.002","1649.33","0.08","110","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H31 Br2 Fe N6 O2 -","- C33 H31 Br2 Fe N6 O2 -","- C66 H62 Br4 Fe2 N12 O4 -","2","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0348","0.0303","","","0.0788","0.0801","","","","","","0.959","","","","has coordinates,has disorder","196896","2020-10-21","18:00:00",""
"7056218","10.949","0.0003","11.8076","0.0003","13.3882","0.0003","97.761","0.002","104.537","0.002","109.503","0.002","1533.21","0.07","110","","110","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H35 Cl Fe N3 O2 -","- C34 H35 Cl Fe N3 O2 -","- C68 H70 Cl2 Fe2 N6 O4 -","2","1","","Pogány, Lukáš; Moncol, Jan; Pavlik, Jan; Salitros, Ivan","Series of High Spin Mononuclear Iron(III) Complexes with Schiff Base ligands derived from 2-hydroxybenzophenones","New J. Chem.","2017","","","","","10.1039/C7NJ00617A","","","1.54186","CuKα","","0.0328","0.0288","","","0.0728","0.0738","","","","","","0.965","","","","has coordinates","196896","2020-10-21","18:00:00",""
"7056219","15.6116","0.0005","15.6116","0.0005","44.947","0.003","90","","90","","120","","9486.9","0.8","173","2","173","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C45 H50 Cl6 Cu6 Gd2 N8 O13 -","- C45 H50.0004 Cl6 Cu6 Gd2 N8 O13 -","- C270 H300.002 Cl36 Cu36 Gd12 N48 O78 -","6","0.166667","","Wang, Hui-Sheng; Yang, Feng-Jun; Long, Qiao-Qiao; Huang, Zhi-Yong; Chen, Wei; Pan, Zhiquan","Syntheses, Crystal Structures, and Magnetic Properties of a Family of Heterometallic Octanuclear [Cu6Ln2] (Ln = Dy(III), Tb(III), Ho(III), Er(III), and Gd(III)) Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00459A","","","0.71073","MoKα","","0.0876","0.054","","","0.1363","0.1529","","","","","","1.055","","","","has coordinates","196931","2020-10-21","18:00:00",""
"7056220","15.8523","0.0006","15.8523","0.0006","44.49","0.007","90","","90","","120","","9682.3","1.6","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C45 H48 Cl6 Cu6 N8 O12 Tb2 -","- C45 H48 Cl6 Cu6 N8 O12 Tb2 -","- C270 H288 Cl36 Cu36 N48 O72 Tb12 -","6","0.166667","","Wang, Hui-Sheng; Yang, Feng-Jun; Long, Qiao-Qiao; Huang, Zhi-Yong; Chen, Wei; Pan, Zhiquan","Syntheses, Crystal Structures, and Magnetic Properties of a Family of Heterometallic Octanuclear [Cu6Ln2] (Ln = Dy(III), Tb(III), Ho(III), Er(III), and Gd(III)) Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00459A","","","0.71073","MoKα","","0.1799","0.1166","","","0.3294","0.3585","","","","","","1.181","","","","has coordinates","196931","2020-10-21","18:00:00",""
"7056221","15.6219","0.0005","15.6219","0.0005","44.866","0.003","90","","90","","120","","9482.3","0.8","173","2","173","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C45 H50 Cl6 Cu6 Ho2 N8 O13 -","- C45 H50.0004 Cl6 Cu6 Ho2 N8 O13 -","- C270 H300.002 Cl36 Cu36 Ho12 N48 O78 -","6","0.166667","","Wang, Hui-Sheng; Yang, Feng-Jun; Long, Qiao-Qiao; Huang, Zhi-Yong; Chen, Wei; Pan, Zhiquan","Syntheses, Crystal Structures, and Magnetic Properties of a Family of Heterometallic Octanuclear [Cu6Ln2] (Ln = Dy(III), Tb(III), Ho(III), Er(III), and Gd(III)) Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00459A","","","0.71073","MoKα","","0.0761","0.0389","","","0.0787","0.0867","","","","","","1.011","","","","has coordinates","196931","2020-10-21","18:00:00",""
"7056222","15.7612","0.0005","15.7612","0.0005","44.844","0.002","90","","90","","120","","9647.5","0.6","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C45 H62 Cl6 Cu6 Er2 N8 O19 -","- C45 H62.0004 Cl6 Cu6 Er2 N8 O19 -","- C270 H372.002 Cl36 Cu36 Er12 N48 O114 -","6","0.166667","","Wang, Hui-Sheng; Yang, Feng-Jun; Long, Qiao-Qiao; Huang, Zhi-Yong; Chen, Wei; Pan, Zhiquan","Syntheses, Crystal Structures, and Magnetic Properties of a Family of Heterometallic Octanuclear [Cu6Ln2] (Ln = Dy(III), Tb(III), Ho(III), Er(III), and Gd(III)) Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00459A","","","0.71073","MoKα","","0.0654","0.0352","","","0.0784","0.0918","","","","","","1.042","","","","has coordinates,has disorder","196931","2020-10-21","18:00:00",""
"7056223","15.6308","0.0012","15.6308","0.0012","44.638","0.007","90","","90","","120","","9444.9","1.8","293","2","293","2","","","","","","","","7","R -3 c :H","-R 3 2""c","167","","","","- C45 H50 Cl6 Cu6 Dy2 N8 O13 -","- C45 H50.0004 Cl6 Cu6 Dy2 N8 O13 -","- C270 H300.002 Cl36 Cu36 Dy12 N48 O78 -","6","0.166667","","Wang, Hui-Sheng; Yang, Feng-Jun; Long, Qiao-Qiao; Huang, Zhi-Yong; Chen, Wei; Pan, Zhiquan","Syntheses, Crystal Structures, and Magnetic Properties of a Family of Heterometallic Octanuclear [Cu6Ln2] (Ln = Dy(III), Tb(III), Ho(III), Er(III), and Gd(III)) Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ00459A","","","0.71073","MoKα","","0.1208","0.0732","","","0.1781","0.1934","","","","","","1.064","","","","has coordinates","196931","2020-10-21","18:00:00",""
"7056224","19.468","0.002","12.1352","0.0013","11.6945","0.0011","90","","92.665","0.004","90","","2759.8","0.5","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C48 H16 N16 O40 -","- C48 H16 N16 O40 -","- C96 H32 N32 O80 -","2","0.5","","Zhang, Cheng Xing; Cheng, Guangbin; xiong, hualin; yang, hongwei","14,16,34,36,54,56,74,76-octanitro-2,4,6,8-tetraoxa-1,3,5,7(1,3) -tetrabenzenacyclooctaphane and its derivatives: Thermally Stable Explosive with Outstanding Properties","New J. Chem.","2017","","","","","10.1039/C7NJ01057E","","","0.71073","MoKα","","0.1093","0.0621","","","0.1183","0.1416","","","","","","1.06","","","","has coordinates,has disorder","196932","2020-10-21","18:00:00",""
"7056225","11.2554","0.0006","19.5586","0.0009","20.6007","0.001","99.125","0.002","98.574","0.002","95.584","0.002","4393.5","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H28 N8 O24 -","- C34 H28 N8 O24 -","- C136 H112 N32 O96 -","4","2","","Zhang, Cheng Xing; Cheng, Guangbin; xiong, hualin; yang, hongwei","14,16,34,36,54,56,74,76-octanitro-2,4,6,8-tetraoxa-1,3,5,7(1,3) -tetrabenzenacyclooctaphane and its derivatives: Thermally Stable Explosive with Outstanding Properties","New J. Chem.","2017","","","","","10.1039/C7NJ01057E","","","0.71073","MoKα","","0.1398","0.058","","","0.1148","0.1429","","","","","","1.068","","","","has coordinates,has disorder","196932","2020-10-21","18:00:00",""
"7056226","9.022","0.0005","30.897","0.002","22.709","0.002","90","","110.681","0.003","90","","5922.3","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3b","","- C56 H84 N12 O8 -","- C56 H84 N12 O8 -","- C224 H336 N48 O32 -","4","1","","Canard, Gabriel; Jacquemin, Denis; SIRI, Olivier; Azarias, Cloé; Chen, Zhongrui","Straighforward Metal-Free Synthesis of an Azacalix[6]arene Forming a Host-Guest Complex with Fullerene C60","New J. Chem.","2017","","","","","10.1039/C7NJ00697G","","","0.71073","MoKα","","0.319","0.1173","","","0.2937","0.3704","","","","","","0.914","","","","has coordinates,has disorder","196933","2020-10-21","18:00:00",""
"7056227","14.8072","0.0005","41.1391","0.0012","34.898","0.002","90","","95.387","0.005","90","","21164.4","1.5","173","0.1","173","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C185 H304 N36 O33 S9 -","- C185 H304 N36 O33 S9 -","- C740 H1216 N144 O132 S36 -","4","1","","Canard, Gabriel; Jacquemin, Denis; SIRI, Olivier; Azarias, Cloé; Chen, Zhongrui","Straighforward Metal-Free Synthesis of an Azacalix[6]arene Forming a Host-Guest Complex with Fullerene C60","New J. Chem.","2017","","","","","10.1039/C7NJ00697G","","x-ray","1.54184","CuKα","","0.2692","0.167","","","0.4174","0.4808","","","","","","1.286","","","","has coordinates,has disorder","196933","2020-10-21","18:00:00",""
"7056228","12.5399","0.0002","16.3862","0.0003","20.942","0.0003","80.9688","0.0013","86.279","0.0013","79.9538","0.0014","4181.57","0.12","100.02","0.1","100.15","","","","","","","","","9","P -1","-P 1","2","","","","- C65 H92 Cl2 Cu F24 N12 Ni O8 P4 -","- C65 H92 Cl2 Cu F24 N12 Ni O8 P4 -","- C130 H184 Cl4 Cu2 F48 N24 Ni2 O16 P8 -","2","1","","Tomczyk, Karolina; Wozny, Mateusz; Domagala, Slawomir; Wieckowska, Agnieszka; Pawłowska, Joanna; Wozniak, Krzysztof; Korybut-Daszkiewicz, Bohdan","Rotaxanes composed of dibenzo-24-crown-8 and macrocyclic transition metal complexing tetraimine units","New J. Chem.","2017","","","","","10.1039/C7NJ00909G","","x-ray","0.71073","MoKα","","0.1011","0.0762","","","0.2516","0.2663","","","","","","1.079","","","","has coordinates,has disorder","204135","2020-10-21","18:00:00",""
"7056229","12.7226","0.0004","16.6566","0.0006","20.9375","0.0006","76.752","0.003","87.027","0.003","81.031","0.003","4265.5","0.2","100","0.1","100.15","","","","","","","","","8","P -1","-P 1","2","","","","- C66 H93.5 Cl2 F24 N12.5 Ni2 O8 P4 -","- C66 H93.5 Cl2 F24 N12.5 Ni2 O8 P4 -","- C132 H187 Cl4 F48 N25 Ni4 O16 P8 -","2","1","","Tomczyk, Karolina; Wozny, Mateusz; Domagala, Slawomir; Wieckowska, Agnieszka; Pawłowska, Joanna; Wozniak, Krzysztof; Korybut-Daszkiewicz, Bohdan","Rotaxanes composed of dibenzo-24-crown-8 and macrocyclic transition metal complexing tetraimine units","New J. Chem.","2017","","","","","10.1039/C7NJ00909G","","x-ray","1.54184","CuKα","","0.1154","0.1061","","","0.3443","0.3602","","","","","","1.635","","","","has coordinates,has disorder","204135","2020-10-21","18:00:00",""
"7056230","13.7274","0.0003","16.1814","0.0004","21.4063","0.0004","74.0155","0.0019","88.0178","0.0017","69.385","0.002","4268.12","0.18","100","0.1","100","0.1","","","","","","","","8","P -1","-P 1","2","","","","- C70.7 H103.39 Cu F24 N12 Ni O10.23 P4 -","- C70.699 H103.398 Cu F24 N12 Ni O10.233 P4 -","- C141.398 H206.796 Cu2 F48 N24 Ni2 O20.466 P8 -","2","1","","Tomczyk, Karolina; Wozny, Mateusz; Domagala, Slawomir; Wieckowska, Agnieszka; Pawłowska, Joanna; Wozniak, Krzysztof; Korybut-Daszkiewicz, Bohdan","Rotaxanes composed of dibenzo-24-crown-8 and macrocyclic transition metal complexing tetraimine units","New J. Chem.","2017","","","","","10.1039/C7NJ00909G","","x-ray","0.71073","MoKα","","0.0802","0.0403","","","0.0998","0.1066","","","","","","0.923","","","","has coordinates,has disorder","204135","2020-10-21","18:00:00",""
"7056231","15.85747","0.00018","16.3923","0.0002","17.6221","0.0002","82.1184","0.0011","63.7171","0.0012","88.1675","0.001","4066.21","0.09","100","0.1","100.15","","","","","","","","","7","P -1","-P 1","2","","","","- C65.36 H96.18 F24 N12 Ni2 O10.18 P4 -","- C65.365 H96.178 F24 N12 Ni2 O10.179 P4 -","- C130.73 H192.356 F48 N24 Ni4 O20.358 P8 -","2","1","","Tomczyk, Karolina; Wozny, Mateusz; Domagala, Slawomir; Wieckowska, Agnieszka; Pawłowska, Joanna; Wozniak, Krzysztof; Korybut-Daszkiewicz, Bohdan","Rotaxanes composed of dibenzo-24-crown-8 and macrocyclic transition metal complexing tetraimine units","New J. Chem.","2017","","","","","10.1039/C7NJ00909G","","x-ray","1.54184","CuKα","","0.0895","0.0794","","","0.227","0.2364","","","","","","1.029","","","","has coordinates,has disorder","204135","2020-10-21","18:00:00",""
"7056232","6.246","0.002","23.899","0.007","8.301","0.002","90","","97.582","0.013","90","","1228.3","0.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","tetrazol ylselanyl methyl (p-tolyl) oxadiazole","2-((1H-tetrazol-5-ylselanyl)methyl)-5-(p-tolyl)-1,3,4-oxadiazole","","- C11 H10 N6 O Se -","- C11 H10 N6 O Se -","- C44 H40 N24 O4 Se4 -","4","1","","Leal, Julliano Guerin; Sauer, André Carpes; Mayer, João Cândido Pilar; Stefanello, Sílvio Terra; Gonçalves, Debora Farina; Soares, FAA; Iglesias, Bernardo Almeida; Back, Davi Fernando; Rodrigues, Oscar E. D.; Dornelles, Luciano","Synthesis and electrochemical and antioxidant properties of chalcogenocyanateoxadiazole and 5-heteroarylchalcogenomethyl-1H-tetrazole derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ00920H","","","0.71073","MoKα","","0.0481","0.0386","","","0.138","0.1436","","","","","","1.167","","","","has coordinates","287889","2023-11-30","14:14:23",""
"7056233","11.0531","0.0005","12.0593","0.0006","12.8518","0.0007","63.248","0.002","75.096","0.002","88.79","0.002","1469.31","0.13","150","","150","","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C36 H24 O8 P2 -","- C36 H24 O8 P2 -","- C72 H48 O16 P4 -","2","1","","Bouhachicha, M.; Ngo Ndimba, A.; Roisnel, T.; Lalli, C.; Argouarch, G.","Pure phosphotriesters as versatile ligands in transition metal catalysis: efficient hydrosilylation of ketones and diethylzinc addition to aldehydes","New J. Chem.","2017","","","","","10.1039/C7NJ00566K","","x-ray","0.71073","MoKα","","0.0472","0.0349","","","0.0894","0.0962","","","","","","1.033","","","","has coordinates","196969","2020-10-21","18:00:00",""
"7056234","11.0492","0.0008","6.9453","0.0006","13.528","0.001","90","","107.219","0.008","90","","991.61","0.14","297","2","297","2","","","","","","","","4","I 1 2/m 1","-I 2y","12","","4,7-Dimethyl-2H-chromen-2-thione","","- C11 H10 O S -","- C11 H10 O S -","- C44 H40 O4 S4 -","4","0.5","","Delgado Espinosa, Zuly; Saeed, Aamer; Mahmood, Shamsul; Echeverría, Gustavo A.; Piro, Oscar E.; Erben, Mauricio Federico Federico","The Effect of Chalcogen Substitution on the Structure and Spectroscopy of 4,7-Dimethyl-2H-chromen-2-one/thione Analogues","New J. Chem.","2017","","","","","10.1039/C7NJ01311F","","x-ray","1.54184","CuKα","","0.0596","0.0495","","","0.135","0.1507","","","","","","1.039","","","","has coordinates","209173","2020-10-21","18:00:00",""
"7056235","9.243","0.008","12.671","0.009","9.346","0.008","90","","117.356","0.01","90","","972.2","1.4","302","2","302","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H28 O4 -","- C22 H28 O4 -","- C44 H56 O8 -","2","1","","P, Dhanya B; Gopalan, Greeshma; T. R., Reshmitha; Saranya, Jayaram; P, Sharathna; I.G., SHIBI; P, Nisha; K. V., Radhakrishnan","Synthesis and in vitro evaluation of zerumbone pendant derivatives: Potent candidates for anti-diabetic and anti-proliferative activities","New J. Chem.","2017","","","","","10.1039/C7NJ01098B","","","0.71073","MoKα","","0.1215","0.055","","","0.0887","0.1072","","","","","","0.814","","","","has coordinates","196994","2020-10-21","18:00:00",""
"7056236","14.688","0.016","10.009","0.01","15.31","0.016","90","","111.284","0.015","90","","2097","4","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 O5 -","- C23 H28 O5 -","- C92 H112 O20 -","4","1","","P, Dhanya B; Gopalan, Greeshma; T. R., Reshmitha; Saranya, Jayaram; P, Sharathna; I.G., SHIBI; P, Nisha; K. V., Radhakrishnan","Synthesis and in vitro evaluation of zerumbone pendant derivatives: Potent candidates for anti-diabetic and anti-proliferative activities","New J. Chem.","2017","","","","","10.1039/C7NJ01098B","","","0.71073","MoKα","","0.0933","0.0509","","","0.1141","0.1289","","","","","","0.712","","","","has coordinates","196994","2020-10-21","18:00:00",""
"7056237","9.123","0.0009","16.1575","0.0015","21.934","0.002","90","","90","","90","","3233.2","0.5","294","2","294","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C26 H32 Br2 Cl4 Cu3 N4 O4 -","- C26 H32 Br2 Cl4 Cu3 N4 O4 -","- C104 H128 Br8 Cl16 Cu12 N16 O16 -","4","0.5","","Bhattacharjee, Aradhita; Halder, Shibashis; Ghosh, Koushik; Rizzoli, Corrado; Roy, Partha","Mono-, tri- and polynuclear copper(II) complexes of Schiff-base ligands: Synthesis, characterization and catalytic activity towards alcohol oxidation","New J. Chem.","2017","","","","","10.1039/C7NJ00846E","","","0.71073","MoKα","","0.0347","0.0265","","","0.0658","0.0706","","","","","","1.04","","","","has coordinates","196995","2020-10-21","18:00:00",""
"7056238","13.5037","0.0006","16.8086","0.0006","6.7657","0.0003","90","","119.501","0.004","90","","1336.56","0.11","294","2","294","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C11 H14 Cl Cu N5 O -","- C11 H14 Cl Cu N5 O -","- C44 H56 Cl4 Cu4 N20 O4 -","4","1","","Bhattacharjee, Aradhita; Halder, Shibashis; Ghosh, Koushik; Rizzoli, Corrado; Roy, Partha","Mono-, tri- and polynuclear copper(II) complexes of Schiff-base ligands: Synthesis, characterization and catalytic activity towards alcohol oxidation","New J. Chem.","2017","","","","","10.1039/C7NJ00846E","","","0.71073","MoKα","","0.0333","0.0294","","","0.0615","0.0629","","","","","","1.038","","","","has coordinates","196995","2020-10-21","18:00:00",""
"7056239","24.123","0.006","6.7026","0.0016","17.89","0.004","90","","90","","90","","2892.6","1.2","294","2","294","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C12 H17 Cl2 Cu N3 O -","- C12 H17 Cl2 Cu N3 O -","- C96 H136 Cl16 Cu8 N24 O8 -","8","2","","Bhattacharjee, Aradhita; Halder, Shibashis; Ghosh, Koushik; Rizzoli, Corrado; Roy, Partha","Mono-, tri- and polynuclear copper(II) complexes of Schiff-base ligands: Synthesis, characterization and catalytic activity towards alcohol oxidation","New J. Chem.","2017","","","","","10.1039/C7NJ00846E","","","0.71073","MoKα","","0.0607","0.0531","","","0.1267","0.1337","","","","","","1.047","","","","has coordinates","196995","2020-10-21","18:00:00",""
"7056240","13.5975","0.0011","16.1208","0.0013","17.9767","0.0015","90","","103.432","0.001","90","","3832.8","0.5","296","2","296","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C58 H74 B2 Cu Fe2 Gd N21 O10 -","- C58 H74 B2 Cu Fe2 Gd N21 O10 -","- C116 H148 B4 Cu2 Fe4 Gd2 N42 O20 -","2","1","","Deng, Xiao-Wei; Cai, Li-Zheng; Zhu, Zhao-Xia; Gao, Feng; Zhou, Yanling; Yao, Min-Xia","Synthesis, Structures and Magnetic Properties of Chiral 3d-3d'-4f Heterotrimetallic Complexes Based on [(Tp*)Fe(CN)3]-","New J. Chem.","2017","","","","","10.1039/C7NJ01413A","","","0.71073","MoKα","","0.0618","0.0457","","","0.1038","0.1097","","","","","","0.951","","","","has coordinates","197017","2020-10-21","18:00:00",""
"7056241","13.4352","0.0009","16.0651","0.0011","17.6194","0.0012","90","","103.548","0.001","90","","3697.1","0.4","296","2","296","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C58 H74 B2 Cu Fe2 Gd N21 O10 -","- C58 H74 B2 Cu Fe2 Gd N21 O10 -","- C116 H148 B4 Cu2 Fe4 Gd2 N42 O20 -","2","1","","Deng, Xiao-Wei; Cai, Li-Zheng; Zhu, Zhao-Xia; Gao, Feng; Zhou, Yanling; Yao, Min-Xia","Synthesis, Structures and Magnetic Properties of Chiral 3d-3d'-4f Heterotrimetallic Complexes Based on [(Tp*)Fe(CN)3]-","New J. Chem.","2017","","","","","10.1039/C7NJ01413A","","","0.71073","MoKα","","0.0537","0.0421","","","0.0773","0.0813","","","","","","0.982","","","","has coordinates","197017","2020-10-21","18:00:00",""
"7056242","13.559","0.007","16.024","0.009","17.767","0.01","90","","103.229","0.009","90","","3758","4","296","2","296","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C58 H74 B2 Cu Fe2 N21 O10 Tb -","- C58 H74 B2 Cu Fe2 N21 O10 Tb -","- C116 H148 B4 Cu2 Fe4 N42 O20 Tb2 -","2","1","","Deng, Xiao-Wei; Cai, Li-Zheng; Zhu, Zhao-Xia; Gao, Feng; Zhou, Yanling; Yao, Min-Xia","Synthesis, Structures and Magnetic Properties of Chiral 3d-3d'-4f Heterotrimetallic Complexes Based on [(Tp*)Fe(CN)3]-","New J. Chem.","2017","","","","","10.1039/C7NJ01413A","","","0.71073","MoKα","","0.0641","0.0418","","","0.0763","0.0827","","","","","","0.922","","","","has coordinates","197017","2020-10-21","18:00:00",""
"7056243","13.4347","0.0011","16.067","0.0013","17.6509","0.0014","90","","103.589","0.001","90","","3703.4","0.5","296","2","296","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C58 H74 B2 Cu Dy Fe2 N21 O10 -","- C58 H74 B2 Cu Dy Fe2 N21 O10 -","- C116 H148 B4 Cu2 Dy2 Fe4 N42 O20 -","2","1","","Deng, Xiao-Wei; Cai, Li-Zheng; Zhu, Zhao-Xia; Gao, Feng; Zhou, Yanling; Yao, Min-Xia","Synthesis, Structures and Magnetic Properties of Chiral 3d-3d'-4f Heterotrimetallic Complexes Based on [(Tp*)Fe(CN)3]-","New J. Chem.","2017","","","","","10.1039/C7NJ01413A","","","0.71073","MoKα","","0.0379","0.0328","","","0.063","0.0647","","","","","","0.941","","","","has coordinates","197017","2020-10-21","18:00:00",""
"7056244","13.5669","0.0013","16.1004","0.0016","17.8246","0.0018","90","","103.271","0.001","90","","3789.5","0.6","296","2","296","2","","","","","","","","8","P 1 21 1","P 2yb","4","","","","- C58 H74 B2 Cu Fe2 N21 O10 Tb -","- C58 H74 B2 Cu Fe2 N21 O10 Tb -","- C116 H148 B4 Cu2 Fe4 N42 O20 Tb2 -","2","1","","Deng, Xiao-Wei; Cai, Li-Zheng; Zhu, Zhao-Xia; Gao, Feng; Zhou, Yanling; Yao, Min-Xia","Synthesis, Structures and Magnetic Properties of Chiral 3d-3d'-4f Heterotrimetallic Complexes Based on [(Tp*)Fe(CN)3]-","New J. Chem.","2017","","","","","10.1039/C7NJ01413A","","","0.71073","MoKα","","0.0702","0.0484","","","0.11","0.1179","","","","","","0.945","","","","has coordinates","197017","2020-10-21","18:00:00",""
"7056245","13.585","0.003","16.218","0.003","18.401","0.004","90","","103.848","0.004","90","","3936.3","1.4","296","2","296","2","","","","","","","","9","P 1 21 1","P 2yb","4","","","","- C58 H74 B2 Cl0 Cu Dy Fe2 N21 O10 -","- C58 H74 B2 Cu Dy Fe2 N21 O10 -","- C116 H148 B4 Cu2 Dy2 Fe4 N42 O20 -","2","1","","Deng, Xiao-Wei; Cai, Li-Zheng; Zhu, Zhao-Xia; Gao, Feng; Zhou, Yanling; Yao, Min-Xia","Synthesis, Structures and Magnetic Properties of Chiral 3d-3d'-4f Heterotrimetallic Complexes Based on [(Tp*)Fe(CN)3]-","New J. Chem.","2017","","","","","10.1039/C7NJ01413A","","","0.71073","MoKα","","0.0676","0.045","","","0.0807","0.088","","","","","","0.909","","","","has coordinates","197017","2020-10-21","18:00:00",""
"7056246","9.6859","0.0004","11.0724","0.0004","16.5195","0.0005","85.518","0.001","82.355","0.001","86.301","0.001","1747.91","0.11","150","","150","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C38 H47 Cl2 N3 Pd -","- C38 H47 Cl2 N3 Pd -","- C76 H94 Cl4 N6 Pd2 -","2","1","","Boubakri, L.; Yasar, S.; Dorcet, V.; Roisnel, T.; Bruneau, C.; Hamdi, N.; Ozdemir, I.","Synthesis and catalytic applications of palladium N-heterocyclic carbene complexes as efficient pre-catalysts for Suzuki‒Miyaura and Sonogashira coupling reactions","New J. Chem.","2017","","","","","10.1039/C7NJ00488E","","x-ray","0.71073","MoKα","","0.0356","0.0292","","","0.0774","0.0807","","","","","","1.104","","","","has coordinates","197018","2020-10-21","18:00:00",""
"7056247","10.3979","0.001","19.688","0.002","24.765","0.002","90","","99.512","0.003","90","","5000","0.8","150","","150","","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H59 Cl4 N2 P Pd -","- C52 H59 Cl4 N2 P Pd -","- C208 H236 Cl16 N8 P4 Pd4 -","4","1","","Boubakri, L.; Yasar, S.; Dorcet, V.; Roisnel, T.; Bruneau, C.; Hamdi, N.; Ozdemir, I.","Synthesis and catalytic applications of palladium N-heterocyclic carbene complexes as efficient pre-catalysts for Suzuki‒Miyaura and Sonogashira coupling reactions","New J. Chem.","2017","","","","","10.1039/C7NJ00488E","","x-ray","0.71073","MoKα","","0.0462","0.037","","","0.0872","0.0952","","","","","","1.041","","","","has coordinates","197018","2020-10-21","18:00:00",""
"7056248","5.588","0.003","7.545","0.004","11.984","0.006","77.113","0.011","88.392","0.013","87.412","0.012","491.9","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H16 N4 O4 -","- C26 H16 N4 O4 -","- C26 H16 N4 O4 -","1","0.5","","Li, Guo-bi; Yang, Qing Yuan; Pan, Rongkai; Liu, Sheng-Gui; xu, yaowei","Supramolecular structural transformation of N, N´-bis(4-pyridylmethyl)-naphthalene diimide and fluorescence water sensing","New J. Chem.","2017","","","","","10.1039/C6NJ04018G","","","0.71073","MoKα","","0.0669","0.0456","","","0.1067","0.1164","","","","","","1.001","","","","has coordinates","197025","2020-10-21","18:00:00",""
"7056249","27.561","0.003","4.6812","0.0002","21.646","0.004","90","","128.914","0.017","90","","2173","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 N4 O6 -","- C26 H20 N4 O6 -","- C104 H80 N16 O24 -","4","0.5","","Li, Guo-bi; Yang, Qing Yuan; Pan, Rongkai; Liu, Sheng-Gui; xu, yaowei","Supramolecular structural transformation of N, N´-bis(4-pyridylmethyl)-naphthalene diimide and fluorescence water sensing","New J. Chem.","2017","","","","","10.1039/C6NJ04018G","","","1.54178","CuKα","","0.0383","0.0366","","","0.1021","0.1045","","","","","","1.04","","","","has coordinates","197025","2020-10-21","18:00:00",""
"7056250","22.76","0.008","4.6927","0.0012","21.335","0.008","90","","115.96","0.05","90","","2048.8","1.5","373","2","373","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H16 N4 O4 -","- C26 H16 N4 O4 -","- C104 H64 N16 O16 -","4","0.5","","Li, Guo-bi; Yang, Qing Yuan; Pan, Rongkai; Liu, Sheng-Gui; xu, yaowei","Supramolecular structural transformation of N, N´-bis(4-pyridylmethyl)-naphthalene diimide and fluorescence water sensing","New J. Chem.","2017","","","","","10.1039/C6NJ04018G","","","1.54178","CuKα","","0.1265","0.0888","","","0.2442","0.2899","","","","","","1.074","","","","has coordinates","197025","2020-10-21","18:00:00",""
"7056251","7.94","0.002","16.998","0.005","8.091","0.002","90","","90.287","0.005","90","","1092","0.5","173.15","","173.15","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(4-hydroxyphenyl)ethan-2-(4-fluorophenyl)-1-one","","- C14 H11 F O2 -","- C14 H11 F O2 -","- C56 H44 F4 O8 -","4","1","","Mei, Qingqing; Liu, Huizhen; Hou, Minqiang; Liu, Hangyu; Han, Buxing","Selective Hydration of Asymmetric Internal Aryl Alkynes without Directing Groups to α-Aryl Ketones over Cu-based catalyst","New J. Chem.","2017","","","","","10.1039/C7NJ00486A","","","0.71073","MoKα","","0.0527","0.0503","","","0.1162","0.1178","","","","","","1.128","","","","has coordinates","197034","2020-10-21","18:00:00",""
"7056252","10.1366","0.0012","10.928","0.0012","12.6758","0.0014","66.265","0.007","87.951","0.007","81.738","0.007","1271.6","0.3","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C56 H60 B2 F4 N4 O2 S2 -","- C56 H60 B2 F4 N4 O2 S2 -","- C56 H60 B2 F4 N4 O2 S2 -","1","0.5","","Ozdemir, Mehmet; Choi, Donghee; Zorlu, Yunus; Cosut, Bunyemin; Kim, Hyungsug; Kim, Choongik; Usta, Hakan","A New Rod-Shaped BODIPY-Acetylene Molecule for Solution-Processed Semiconducting Microribbons in N-Channel Organic Field-Effect Transistors","New J. Chem.","2017","","","","","10.1039/C7NJ00266A","","","0.71073","MoKα","","0.16","0.086","","0.2739","0.2139","0.2344","","","","","","0.9462","","","","has coordinates","197035","2020-10-21","18:00:00",""
"7056253","22.71271","0.00079","10.67672","0.0005","7.23916","0.00027","90","","90","","90","","1755.48","0.12","298","2","298","","100","","100","","","","from LASSBio","5","P 21 21 21","P 2ac 2ab","19","LASSBio-1773","(E)-N'-(thiophen-2-ylmethylene)cyclohexanecarbohydrazide","","- C17 H18 N2 O6 S -","- C17 H18 N2 O6 S -","- C68 H72 N8 O24 S4 -","4","1","","Ibiapino, Amanda Laura; de Figueiredo, Laysa Pires; Lima, Lídia Moreira; Barreiro, Eliezer J.; Punzo, Francesco; Ferreira, Fabio Furlan","Structural and physicochemical characterization of sulfonylhydrazone derivatives designed as hypoglycemic agents","New J. Chem.","2017","","","","","10.1039/C7NJ00074J","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","","0.0302","1.604","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7056254","28.9007","0.0011","15.0348","0.0004","9.1482","0.0002","90","","90","","90","","3975","0.2","298","2","298","","100","","100","","","","from LASSBio","5","P b c a","-P 2ac 2ab","61","LASSBio-1774","(E)-N'-(thiophen-2-ylmethylene)cyclohexanecarbohydrazide","","- C18 H22 N2 O7 S -","- C18 H22 N2 O7 S -","- C144 H176 N16 O56 S8 -","8","1","","Ibiapino, Amanda Laura; de Figueiredo, Laysa Pires; Lima, Lídia Moreira; Barreiro, Eliezer J.; Punzo, Francesco; Ferreira, Fabio Furlan","Structural and physicochemical characterization of sulfonylhydrazone derivatives designed as hypoglycemic agents","New J. Chem.","2017","","","","","10.1039/C7NJ00074J","powder diffraction","x-ray","1.54056","CuKα~1~","","","","","","","","","0.01126","0.941","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"7056255","12.8322","0.0012","10.9479","0.001","12.991","0.0012","90","","98.115","0.002","90","","1806.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H22 Cd N4 O8 -","- C13 H22 Cd N4 O8 -","- C52 H88 Cd4 N16 O32 -","4","1","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.0223","0.0201","","","0.0528","0.054","","","","","","1.04","","","","has coordinates","197061","2020-10-21","18:00:00",""
"7056256","10.076","0.0017","10.2553","0.0018","13.237","0.002","90","","90","","90","","1367.8","0.4","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H14 Cd N4 O6 -","- C11 H14 Cd N4 O6 -","- C44 H56 Cd4 N16 O24 -","4","1","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.0269","0.0211","","","0.0542","0.0556","","","","","","1.09","","","","has coordinates","197061","2020-10-21","18:00:00",""
"7056257","12.946","0.004","4.102","0.0013","24.925","0.006","90","","114.773","0.013","90","","1201.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 N4 O4 -","- C11 H12 N4 O4 -","- C44 H48 N16 O16 -","4","1","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.1066","0.0543","","","0.1486","0.1789","","","","","","0.945","","","","has coordinates","197061","2020-10-21","18:00:00",""
"7056258","12.3977","0.0011","12.6699","0.0012","9.4124","0.0009","90","","90","","90","","1478.5","0.2","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C11 H16 N4 O7 Zn -","- C11 H16 N4 O7 Zn -","- C44 H64 N16 O28 Zn4 -","4","0.5","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.0656","0.0548","","","0.1384","0.1446","","","","","","1.104","","","","has coordinates","197061","2020-10-21","18:00:00",""
"7056259","8.577","0.004","9.448","0.005","22.037","0.011","90","","90","","90","","1785.8","1.5","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N5 O6 Zn -","- C14 H19 N5 O6 Zn -","- C56 H76 N20 O24 Zn4 -","4","1","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.0711","0.0609","","","0.1371","0.1404","","","","","","1.092","","","","has coordinates","197061","2020-10-21","18:00:00",""
"7056260","23.952","0.007","4.0594","0.0013","12.531","0.004","90","","90","","90","","1218.4","0.7","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C11 H12 N4 O4 -","- C11 H12 N4 O4 -","- C44 H48 N16 O16 -","4","1","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.0796","0.0538","","","0.1437","0.1609","","","","","","1.063","","","","has coordinates","197061","2020-10-21","18:00:00",""
"7056261","8.5459","0.0004","9.4075","0.0005","21.8986","0.0011","90","","90","","90","","1760.55","0.15","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N5 O6 Zn -","- C14 H19 N5 O6 Zn -","- C56 H76 N20 O24 Zn4 -","4","1","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.0313","0.0277","","","0.0651","0.0662","","","","","","1.06","","","","has coordinates","197061","2020-10-21","18:00:00",""
"7056262","12.259","0.004","8.409","0.003","32.758","0.009","90","","90","","90","","3376.9","1.9","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H20 N4 O4 -","- C15 H20 N4 O4 -","- C120 H160 N32 O32 -","8","1","","Cheng, Meiling; Wang, Qinghua; Bao, Jinting; Wu, Yujuan; Sun, Lin; Yang, Bingxin; Liu, Qi","Synthesis and structural diversity of d10 metal coordination polymers constructed from new semi-rigid bis(3-methyl-1H-pyrazole-4-carboxylic acid)alkane ligands","New J. Chem.","2017","","","","","10.1039/C7NJ00835J","","","0.71073","MoKα","","0.0989","0.0658","","","0.191","0.2112","","","","","","1.066","","","","has coordinates,has disorder","197061","2020-10-21","18:00:00",""
"7056263","20.9999","0.001","15.0842","0.0006","24.1747","0.0013","90","","98.065","0.002","90","","7582","0.6","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C77 H89 Cl3 N8 O4 S4 -","- C77 H89 Cl3 N8 O4 S4 -","- C308 H356 Cl12 N32 O16 S16 -","4","1","","Noamane, Mohamed Habib; FERLAY, Sylvie; Abidi, Rym; Kyritsakas, Nathalie; Hosseini, Mir Wais","Synthesis of para- and meta-imino- or -amino-methyl pyridyl appended p-tert-butyl-calix[4]arene or p-tert-butyl-thiacalix[4]arene in 1,3-Alternate conformation","New J. Chem.","2017","","","","","10.1039/C7NJ01389B","","","0.71073","MoKα","","0.2124","0.0883","","","0.2363","0.3068","","","","","","1.025","","","","has coordinates,has disorder","197062","2020-10-21","18:00:00",""
"7056264","14.021","0.003","15.136","0.003","34.374","0.008","90","","93.023","0.003","90","","7285","3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C76 H88 N8 O4 S4 -","- C76 H88 N8 O4 S4 -","- C304 H352 N32 O16 S16 -","4","1","","Noamane, Mohamed Habib; FERLAY, Sylvie; Abidi, Rym; Kyritsakas, Nathalie; Hosseini, Mir Wais","Synthesis of para- and meta-imino- or -amino-methyl pyridyl appended p-tert-butyl-calix[4]arene or p-tert-butyl-thiacalix[4]arene in 1,3-Alternate conformation","New J. Chem.","2017","","","","","10.1039/C7NJ01389B","","","0.71073","MoKα","","0.1536","0.109","","","0.2164","0.2415","","","","","","1.014","","","","has coordinates,has disorder","197062","2020-10-21","18:00:00",""
"7056265","20.9892","0.001","14.9268","0.0012","24.0802","0.0018","90","","98.511","0.002","90","","7461.3","0.9","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C81 H97 Cl3 N8 O4 -","- C81 H94 Cl3 N8 O4 -","- C324 H376 Cl12 N32 O16 -","4","1","","Noamane, Mohamed Habib; FERLAY, Sylvie; Abidi, Rym; Kyritsakas, Nathalie; Hosseini, Mir Wais","Synthesis of para- and meta-imino- or -amino-methyl pyridyl appended p-tert-butyl-calix[4]arene or p-tert-butyl-thiacalix[4]arene in 1,3-Alternate conformation","New J. Chem.","2017","","","","","10.1039/C7NJ01389B","","","0.71073","MoKα","","0.1552","0.0861","","","0.2098","0.2474","","","","","","1.027","","","","has coordinates,has disorder","197062","2020-10-21","18:00:00",""
"7056266","15.0334","0.0016","13.939","0.002","36.796","0.006","90","","97.689","0.002","90","","7641.3","1.8","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C76 H96 N8 O4 S4 -","- C76 H93 N8 O4 S4 -","- C304 H372 N32 O16 S16 -","4","1","","Noamane, Mohamed Habib; FERLAY, Sylvie; Abidi, Rym; Kyritsakas, Nathalie; Hosseini, Mir Wais","Synthesis of para- and meta-imino- or -amino-methyl pyridyl appended p-tert-butyl-calix[4]arene or p-tert-butyl-thiacalix[4]arene in 1,3-Alternate conformation","New J. Chem.","2017","","","","","10.1039/C7NJ01389B","","","0.71073","MoKα","","0.2218","0.1068","","","0.2769","0.3205","","","","","","1.092","","","","has coordinates,has disorder","197062","2020-10-21","18:00:00",""
"7056267","11.8534","0.0006","11.8871","0.0003","12.5771","0.0004","90","","104.182","0.004","90","","1718.13","0.12","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H18 Dy N3 O9 -","- C11 H18 Dy N3 O9 -","- C44 H72 Dy4 N12 O36 -","4","1","","Devi, Bandhana; Koner, Rik Rani; Halder, Aditi","Dysprosium based Coordination Polymer and its Application towards Oxygen Reduction Reaction","New J. Chem.","2017","","","","","10.1039/C7NJ00985B","","","0.71073","MoKα","","0.0706","0.0552","","","0.1119","0.1235","","","","","","1.041","","","","has coordinates","197063","2020-10-21","18:00:00",""
"7056268","24.182","0.002","17.718","0.001","17.929","0.001","90","","90","","90","","7681.8","0.9","100","2","100","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C120 H60 Cl4 N2 -","- C120 H60 Cl3.9994 N2 -","- C480 H240 Cl15.9976 N8 -","4","0.5","","Konarev, Dmitri V.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.","Fullerene C60 dianion salt, (Me4N+)2(C602−)·(TPC)2·2C6H4Cl2, where TPC is triptycene, obtained by a multicomponent approach","New J. Chem.","2017","","","","","10.1039/C7NJ01096F","","","0.895","synchrotron","","0.1939","0.1289","","","0.3256","0.36","","","","","","1.013","","","","has coordinates,has disorder","197064","2020-10-21","18:00:00",""
"7056269","18.945","0.011","4.954","0.003","15.2","0.009","90","","90","","90","","1426.6","1.5","296","2","296","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C17 H10 B F2 N3 O -","- C17 H10 B F2 N3 O -","- C68 H40 B4 F8 N12 O4 -","4","1","","Zhang, Hui; Wu, Yanping; Fan, Minhui; Xiao, Xu-Qiong; Mack, John; Kubheka, Gugu; Nyokong, Tebello; Lu, Hua","Aza boron-pyridyl-isoindoline analogues: synthesis and photophysical properties","New J. Chem.","2017","","","","","10.1039/C7NJ00707H","","","0.71073","MoKα","","0.1627","0.0602","","","0.114","0.1568","","","","","","0.988","","","","has coordinates","197125","2020-10-21","18:00:00",""
"7056270","3.88","0.0012","11.779","0.004","19.292","0.006","90","","90.211","0.008","90","","881.7","0.5","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H7 N O2 -","- C12 H7 N O2 -","- C48 H28 N4 O8 -","4","1","","Zhang, Hui; Wu, Yanping; Fan, Minhui; Xiao, Xu-Qiong; Mack, John; Kubheka, Gugu; Nyokong, Tebello; Lu, Hua","Aza boron-pyridyl-isoindoline analogues: synthesis and photophysical properties","New J. Chem.","2017","","","","","10.1039/C7NJ00707H","","","0.71073","MoKα","","0.1023","0.0531","","","0.1285","0.1578","","","","","","0.9","","","","has coordinates","197125","2020-10-21","18:00:00",""
"7056271","14.0062","0.0002","12.6032","0.0002","28.7138","0.0004","90","","90.001","0.001","90","","5068.64","0.13","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Cs8 In5 Mo24 Na25 O96 -","- Cs8 In5.0024 Mo24 Na25 O96 -","- Cs16 In10.0048 Mo48 Na50 O192 -","2","0.5","","Savina, Aleksandra A.; Solodovnikov, Sergey F.; Belov, Dmitry A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu.; Lazoryak, Bogdan I.; Khaikina, Elena G.","New alluaudite-related triple molybdates Na25Cs8R5(MoO4)24 (R = Sc, In): synthesis, crystal structures and properties","New J. Chem.","2017","","","","","10.1039/C7NJ00202E","","","0.71073","MoKα","","0.0387","0.0356","","","0.1067","0.1093","","","","","","1.067","","","","has coordinates","197126","2020-10-21","18:00:00",""
"7056272","14.0069","0.0003","12.6498","0.0003","28.6491","0.0006","90","","90.007","0.001","90","","5076.18","0.19","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- Cs8 Mo24 Na25 O96 Sc5 -","- Cs8 Mo24 Na25 O96 Sc4.9996 -","- Cs16 Mo48 Na50 O192 Sc9.9992 -","2","0.5","","Savina, Aleksandra A.; Solodovnikov, Sergey F.; Belov, Dmitry A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu.; Lazoryak, Bogdan I.; Khaikina, Elena G.","New alluaudite-related triple molybdates Na25Cs8R5(MoO4)24 (R = Sc, In): synthesis, crystal structures and properties","New J. Chem.","2017","","","","","10.1039/C7NJ00202E","","","0.71073","MoKα","","0.0362","0.0308","","","0.0688","0.0727","","","","","","1.043","","","","has coordinates","197126","2020-10-21","18:00:00",""
"7056273","9.0536","0.0004","9.0906","0.0004","9.9218","0.0004","88.901","0.0011","88.7726","0.0011","85.6563","0.0011","813.93","0.06","100","","100","","","","","","","","","6","P -1","-P 1","2","","Ru2Cl2(N1N2-dibutanoylhydrazine)(?6-p-cymene)2","","- C30 H50 Cl2 N2 O4 Ru2 -","- C30 H50 Cl2 N2 O4 Ru2 -","- C30 H50 Cl2 N2 O4 Ru2 -","1","0.5","","Nikolić, Stefan; Ćirić, Ivanka; Roller, Alexander; Lukes, Vladimir; Arion, Vladimir; Grguric-Sipka, Sanja","Conversion of hydrazides into N,N'-diacylhydrazines in the presence of ruthenium(II)-arene complex","New J. Chem.","2017","","","","","10.1039/C7NJ00965H","","","0.71073","MoKα","","0.0153","0.0149","","","0.0387","0.039","","","","","","1.058","","","","has coordinates","197144","2020-10-21","18:00:00",""
"7056274","9.916","0.0004","12.3781","0.0005","16.9971","0.0007","76.1322","0.0015","78.331","0.0015","88.3137","0.0016","1983.17","0.14","100","","100","","","","","","","","","6","P -1","-P 1","2","","Ru2Cl2(N1N2-dibutanoylhydrazine)(?6-p-cymene)2","","- C38 H56 Cl4 N2 O2 Ru3 -","- C38 H56 Cl4 N2 O2 Ru3 -","- C76 H112 Cl8 N4 O4 Ru6 -","2","1","","Nikolić, Stefan; Ćirić, Ivanka; Roller, Alexander; Lukes, Vladimir; Arion, Vladimir; Grguric-Sipka, Sanja","Conversion of hydrazides into N,N'-diacylhydrazines in the presence of ruthenium(II)-arene complex","New J. Chem.","2017","","","","","10.1039/C7NJ00965H","","","0.71073","MoKα","","0.0236","0.0206","","","0.0498","0.0513","","","","","","1.057","","","","has coordinates","197144","2020-10-21","18:00:00",""
"7056275","9.6072","0.0005","9.7722","0.0005","17.7727","0.0008","95.264","0.002","90.7653","0.0018","93.16","0.002","1658.71","0.14","100","","100","","","","","","","","","6","P -1","-P 1","2","","Ru2Cl2(N1N2-dipentanoylhydrazine)(?6-p-cymene)2","","- C30 H50 Cl2 N2 O4 Ru2 -","- C30 H50 Cl2 N2 O4 Ru2 -","- C60 H100 Cl4 N4 O8 Ru4 -","2","1","","Nikolić, Stefan; Ćirić, Ivanka; Roller, Alexander; Lukes, Vladimir; Arion, Vladimir; Grguric-Sipka, Sanja","Conversion of hydrazides into N,N'-diacylhydrazines in the presence of ruthenium(II)-arene complex","New J. Chem.","2017","","","","","10.1039/C7NJ00965H","","","0.71073","MoKα","","0.0458","0.0337","","","0.0738","0.0816","","","","","","1.051","","","","has coordinates,has disorder","197144","2020-10-21","18:00:00",""
"7056276","13.8233","0.0006","20.4127","0.0009","12.0459","0.0005","90","","103.277","0.0016","90","","3308.2","0.2","100","","100","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","[RuCl(propionylhydrazine)(?6-p-cymene)]Cl","","- C13 H22 Cl2 N2 O Ru -","- C13 H22 Cl2 N2 O Ru -","- C104 H176 Cl16 N16 O8 Ru8 -","8","2","","Nikolić, Stefan; Ćirić, Ivanka; Roller, Alexander; Lukes, Vladimir; Arion, Vladimir; Grguric-Sipka, Sanja","Conversion of hydrazides into N,N'-diacylhydrazines in the presence of ruthenium(II)-arene complex","New J. Chem.","2017","","","","","10.1039/C7NJ00965H","","","0.71073","MoKα","","0.0353","0.0298","","","0.0752","0.0782","","","","","","1.061","","","","has coordinates,has disorder","197144","2020-10-21","18:00:00",""
"7056277","17.7907","0.0017","15.739","0.0012","14.548","0.0012","90","","125.091","0.009","90","","3333.1","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H18 Co N4 O4 -","- C28 H18 Co N4 O4 -","- C112 H72 Co4 N16 O16 -","4","0.5","","Shi, Weiwei; Zhang, Han; Zheng, Xiang-Yu; Lou, Shuaifeng; Hu, Bowen; Yin, GePing; Gao, Yunzhi","Two isomorphous coordination polymers derived metal oxides as high performance anodes for lithium-ion batteries","New J. Chem.","2017","","","","","10.1039/C7NJ00540G","","","0.71073","MoKα","","0.0644","0.047","","","0.1233","0.1317","","","","","","0.977","","","","has coordinates","197145","2020-10-21","18:00:00",""
"7056278","17.998","0.004","13.587","0.003","22.207","0.005","90","","110.746","0.003","90","","5078","2","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H61 Cl2 Fe N3 O6 -","- C48 H61 Cl2 Fe N3 O6 -","- C192 H244 Cl8 Fe4 N12 O24 -","4","1","","Saha, Sandeepta; Choudhury, Chirantan Roy; Gomez Garcia, Carlos J.; Benmansour, Samia; Garribba, Eugenio; Frontera, Antonio; Rizzoli, Corrado; Mitra, Samiran","Trigonal prismatic anionic iron (III) complex of a radical o-imino-benzo-semiquinonate derivative: Structural and spectral analysis","New J. Chem.","2017","","","","","10.1039/C7NJ01212H","","","","","","0.133","","","","","","","","","","","","","","","has coordinates","197146","2020-10-21","18:00:00",""
"7056279","14.598","0.005","5.208","0.005","6.304","0.005","90","0.005","90","0.005","90","0.005","479.3","0.6","293","2","293","2","","","","","","","","6","P n n m","-P 2 2n","58","","","","- C2 H8 Cd2 N2 O7 V2 -","- C2 H8 Cd2 N2 O7 V2 -","- C4 H16 Cd4 N4 O14 V4 -","2","0.25","","Li, Ning; Zhao, Jian-Guo; Xu, Li; Zhang, Zhong; Huang, Liping; Liu, Yiwei; Lu, Ying; Liu, Shuxia","A 3D cadmium−vanadium bimetallic framework with luminescence properties","New J. Chem.","2017","","","","","10.1039/C7NJ01258F","","","0.71069","MoKα","","0.018","0.018","","","0.0476","0.0476","","","","","","1.295","","","","has coordinates","197147","2020-10-21","18:00:00",""
"7056280","10.173","0.002","10.372","0.002","11.119","0.002","90","","90","","90","","1173.2","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H8 Eu N3 O6 -","- C8 H8 Eu N3 O6 -","- C32 H32 Eu4 N12 O24 -","4","1","","Sun, Yan-Qiong; Liu, Qi; Liu, Le-Hui; Ding, Ling; Chen, Yi-Ping","Two 3D nonlinear optical and luminescent Lanthanide-organic frameworks with multidirectional helical intersecting channels","New J. Chem.","2017","","","","","10.1039/C7NJ01081H","","","0.71073","MoKα","","0.0156","0.0149","","","0.034","0.0342","","","","","","0.984","","","","has coordinates","197198","2020-10-21","18:00:00",""
"7056281","10.243","0.002","10.371","0.002","11.131","0.002","90","","90","","90","","1182.4","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H8 N3 O6 Sm -","- C8 H8 N3 O6 Sm -","- C32 H32 N12 O24 Sm4 -","4","1","","Sun, Yan-Qiong; Liu, Qi; Liu, Le-Hui; Ding, Ling; Chen, Yi-Ping","Two 3D nonlinear optical and luminescent Lanthanide-organic frameworks with multidirectional helical intersecting channels","New J. Chem.","2017","","","","","10.1039/C7NJ01081H","","","0.71073","MoKα","","0.0131","0.0129","","","0.0289","0.029","","","","","","1.14","","","","has coordinates","197198","2020-10-21","18:00:00",""
"7056282","6.5251","0.0003","11.4616","0.0004","12.7135","0.0005","114.126","0.001","103.656","0.001","90.594","0.001","837.09","0.06","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- B10 Ca3 O23 V2 -","- B10 Ca3 O23 V2 -","- B20 Ca6 O46 V4 -","2","1","","Chen, Zhaohui; Liu, Yaqin; Shi, Yunjing; Zhang, Wenyao; Jing, Qun; Fang, Yuan; Dong, Xiaoyu","M3V2B10O23 (M = Ca, Sr): Two new vanadoborates with new [V2B10O23]\ιnfty double layers","New J. Chem.","2017","","","","","10.1039/C6NJ04069A","","","0.71073","MoKα","","0.0643","0.0561","","","0.1293","0.1361","","","","","","0.925","","","","has coordinates","197199","2020-10-21","18:00:00",""
"7056283","6.639","0.002","11.571","0.004","12.998","0.004","114.333","0.003","103.334","0.003","90.432","0.003","879.3","0.5","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- B10 O23 Sr3 V2 -","- B10 O23 Sr3 V2 -","- B20 O46 Sr6 V4 -","2","1","","Chen, Zhaohui; Liu, Yaqin; Shi, Yunjing; Zhang, Wenyao; Jing, Qun; Fang, Yuan; Dong, Xiaoyu","M3V2B10O23 (M = Ca, Sr): Two new vanadoborates with new [V2B10O23]\ιnfty double layers","New J. Chem.","2017","","","","","10.1039/C6NJ04069A","","","0.71073","MoKα","","0.0722","0.0516","","","0.1245","0.1406","","","","","","1.018","","","","has coordinates","197200","2020-10-21","18:00:00",""
"7056284","8.0718","0.0006","8.2115","0.0007","11.4425","0.0009","76.477","0.003","82.582","0.003","70.713","0.003","694.9","0.1","100","2","100","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H7 F3 N4 O6 -","- C13 H7 F3 N4 O6 -","- C26 H14 F6 N8 O12 -","2","1","","GAUR, PINKI; Bhaskar Yamjala, Kanka Durga; Banerjee, Shaibal","Efficient Synthetic route to Aromatic Secondary Amines via Pd/RuPhos/TBAB Catalyzed Cross Coupling","New J. Chem.","2017","","","","","10.1039/C7NJ01095H","","","0.71073","MoKα","","0.0756","0.0447","","","","0.1423","","","","","","0.9722","","","","has coordinates","197556","2020-10-21","18:00:00",""
"7056285","8.729","0.003","11.511","0.004","11.634","0.004","104.63","0.005","93.584","0.004","95.062","0.005","1122.3","0.7","296.15","","296.15","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H18 Cl In N2 O15 -","- C16 H18 Cl In N2 O15 -","- C32 H36 Cl2 In2 N4 O30 -","2","1","","Zhang, Lijing; Bai, Fengying; Gao, Xue; Du, Ning; Xing, Yong Heng; Sun, Lixian","Multifunctional Indium Complexes with Fluorescent Sensing and Selective Adsorption Dye Properties","New J. Chem.","2017","","","","","10.1039/C7NJ00680B","","","0.71073","MoKα","","0.0192","0.0178","","","0.0457","0.0468","","","","","","1.068","","","","has coordinates","197557","2020-10-21","18:00:00",""
"7056286","11.882","0.006","16.042","0.008","7.377","0.005","90","","90","","90","","1406.1","1.4","293","2","293","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C10 H11 Cl4 In N2 O -","- C10 H11 Cl4 In N2 O -","- C40 H44 Cl16 In4 N8 O4 -","4","0.25","","Zhang, Lijing; Bai, Fengying; Gao, Xue; Du, Ning; Xing, Yong Heng; Sun, Lixian","Multifunctional Indium Complexes with Fluorescent Sensing and Selective Adsorption Dye Properties","New J. Chem.","2017","","","","","10.1039/C7NJ00680B","","","0.71073","MoKα","","0.0333","0.0296","","","0.0663","0.0679","","","","","","1.174","","","","has coordinates","197557","2020-10-21","18:00:00",""
"7056287","7.4216","0.0011","20.76","0.003","10.8627","0.0016","90","","91.634","0.002","90","","1673","0.4","296.15","","296.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 Cl2 In N O7 -","- C13 H15 Cl2 In N O7 -","- C52 H60 Cl8 In4 N4 O28 -","4","1","","Zhang, Lijing; Bai, Fengying; Gao, Xue; Du, Ning; Xing, Yong Heng; Sun, Lixian","Multifunctional Indium Complexes with Fluorescent Sensing and Selective Adsorption Dye Properties","New J. Chem.","2017","","","","","10.1039/C7NJ00680B","","","0.71073","MoKα","","0.0512","0.0296","","","0.0533","0.0589","","","","","","1.005","","","","has coordinates,has disorder","197557","2020-10-21","18:00:00",""
"7056288","7.3473","0.0009","10.8184","0.0013","20.154","0.002","90","","90","","90","","1602","0.3","296.15","","296.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C14 H13 Cl In N O8 -","- C14 H13 Cl In N O8 -","- C56 H52 Cl4 In4 N4 O32 -","4","1","","Zhang, Lijing; Bai, Fengying; Gao, Xue; Du, Ning; Xing, Yong Heng; Sun, Lixian","Multifunctional Indium Complexes with Fluorescent Sensing and Selective Adsorption Dye Properties","New J. Chem.","2017","","","","","10.1039/C7NJ00680B","","","0.71073","MoKα","","0.0757","0.0496","","","0.0916","0.1021","","","","","","1.05","","","","has coordinates","197557","2020-10-21","18:00:00",""
"7056289","9.97961","0.00016","25.3617","0.0006","10.5814","0.0002","90","","94.6162","0.0016","90","","2669.46","0.09","150","","150","","","","","","","","no","7","P 1 21 1","P 2yb","4","no","Salt of tin(IV) dichloride phthalocyanine with cryptand[2,2,1](Na+) cations, dichlorobenzene solvate","","- C54 H52 Cl4 N10 Na O5 Sn -","- C54 H52 Cl4 N10 Na O5 Sn -","- C108 H104 Cl8 N20 Na2 O10 Sn2 -","2","1","","Konarev, Dmitri V.; Faraonov, Maxim A.; Kuz`min, Alexey V.; Khasanov, Salavat S.; Nakano, Yoshiaki; Norko, Semen I.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.; Batov, Mikhail S.","Crystalline salts of metal phthalocyanine radical anions [M{Pc(•3-)}](•-) (M = Cu(II), Pb(II), V(IV)O, Sn(IV)Cl2) with cryptand(Na+) cations: structure, optical and magnetic properties","New J. Chem.","2017","","","","","10.1039/C7NJ00530J","","","0.71073","MoKα","","0.0929","0.0806","","","0.2292","0.2445","","","","","","1.072","","","","has coordinates,has disorder","197593","2020-10-21","18:00:00",""
"7056290","10.2257","0.0004","25.3147","0.0011","10.6978","0.0004","90","","96.022","0.003","90","","2753.96","0.19","150","","150","","","","","","","","no","7","P 1 21 1","P 2yb","4","no","Salt of tin(IV) dichloride phthalocyanine with the crytand[2,2,2](Na+) cations, dichlorobenzene solvate","","- C56 H56 Cl4 N10 Na O6 Sn -","- C56 H56 Cl4 N10 Na O6 Sn -","- C112 H112 Cl8 N20 Na2 O12 Sn2 -","2","1","","Konarev, Dmitri V.; Faraonov, Maxim A.; Kuz`min, Alexey V.; Khasanov, Salavat S.; Nakano, Yoshiaki; Norko, Semen I.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.; Batov, Mikhail S.","Crystalline salts of metal phthalocyanine radical anions [M{Pc(•3-)}](•-) (M = Cu(II), Pb(II), V(IV)O, Sn(IV)Cl2) with cryptand(Na+) cations: structure, optical and magnetic properties","New J. Chem.","2017","","","","","10.1039/C7NJ00530J","","","0.71073","MoKα","","0.0876","0.0732","","","0.2171","0.2327","","","","","","1.091","","","","has coordinates,has disorder","197593","2020-10-21","18:00:00",""
"7056291","12.7645","0.0001","14.9025","0.0002","27.6673","0.0003","90","","91.874","0.001","90","","5260.14","0.1","120","2","120.15","","","","","","","","no","7","P 1 21/c 1","-P 2ybc","14","no","salt of vanadyl phthalocyanine with the cryptand[2,2,2](Na+) cations, dichlorobenzene solvate","","- C56 H56 Cl2 N10 Na O7 V -","- C56 H56 Cl2 N10 Na O7 V -","- C224 H224 Cl8 N40 Na4 O28 V4 -","4","1","","Konarev, Dmitri V.; Faraonov, Maxim A.; Kuz`min, Alexey V.; Khasanov, Salavat S.; Nakano, Yoshiaki; Norko, Semen I.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.; Batov, Mikhail S.","Crystalline salts of metal phthalocyanine radical anions [M{Pc(•3-)}](•-) (M = Cu(II), Pb(II), V(IV)O, Sn(IV)Cl2) with cryptand(Na+) cations: structure, optical and magnetic properties","New J. Chem.","2017","","","","","10.1039/C7NJ00530J","","","0.71073","MoKα","","0.048","0.037","","","0.0896","0.0956","","","","","","1.022","","","","has coordinates","197593","2020-10-21","18:00:00",""
"7056292","12.5241","0.0008","12.6333","0.001","19.1273","0.001","81.244","0.005","72.634","0.005","64.528","0.007","2606.6","0.3","120","2","120","2","","","","","","","no","7","P -1","-P 1","2","no","copper phthalocyanine salt with cryptand[2,2,2] sodium cations, dichlorobenzene solvate","","- C56 H56 Cl2 Cu N10 Na O6 -","- C56 H56 Cl2 Cu N10 Na O6 -","- C112 H112 Cl4 Cu2 N20 Na2 O12 -","2","1","","Konarev, Dmitri V.; Faraonov, Maxim A.; Kuz`min, Alexey V.; Khasanov, Salavat S.; Nakano, Yoshiaki; Norko, Semen I.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.; Batov, Mikhail S.","Crystalline salts of metal phthalocyanine radical anions [M{Pc(•3-)}](•-) (M = Cu(II), Pb(II), V(IV)O, Sn(IV)Cl2) with cryptand(Na+) cations: structure, optical and magnetic properties","New J. Chem.","2017","","","","","10.1039/C7NJ00530J","","x-ray","0.71073","MoKα","","0.1077","0.057","","","0.088","0.1048","","","","","","1.021","","","","has coordinates","197593","2020-10-21","18:00:00",""
"7056293","12.73638","0.00018","30.5287","0.0004","14.2894","0.0002","90","","109.232","0.0016","90","","5246","0.13","150","0.14","150","0.14","","","","","","","no","7","P 1 21/c 1","-P 2ybc","14","no","lead phthalocyanine salt with cryptand[2,2,2] sodium cations, dichlorobenzene solvate","","- C56 H56 Cl2 N10 Na O6 Pb -","- C56.0018 H56.0036 Cl2 N10.0002 Na1.0001 O6.0006 Pb -","- C224.007 H224.014 Cl8 N40.0008 Na4.0004 O24.0024 Pb4 -","4","1","","Konarev, Dmitri V.; Faraonov, Maxim A.; Kuz`min, Alexey V.; Khasanov, Salavat S.; Nakano, Yoshiaki; Norko, Semen I.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N.; Batov, Mikhail S.","Crystalline salts of metal phthalocyanine radical anions [M{Pc(•3-)}](•-) (M = Cu(II), Pb(II), V(IV)O, Sn(IV)Cl2) with cryptand(Na+) cations: structure, optical and magnetic properties","New J. Chem.","2017","","","","","10.1039/C7NJ00530J","","x-ray","0.71073","MoKα","","0.0253","0.0217","","","0.0504","0.0522","","","","","","1.031","","","","has coordinates,has disorder","197593","2020-10-21","18:00:00",""
"7056294","9.9052","0.0002","8.351","0.0001","25.7006","0.0005","90","","100.503","0.002","90","","2090.29","0.07","293","2","293","2","","","","","","","synthesis as described","6","P 1 2/n 1","-P 2yac","13","","","","- C19 H12 Cl3 Mn N2 O8 -","- C19 H12 Cl3 Mn N2 O8 -","- C76 H48 Cl12 Mn4 N8 O32 -","4","1","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","x-ray","1.54184","CuKα","","0.0489","0.0455","","","0.1251","0.1277","","","","","","1.065","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056295","12.3913","0.0003","15.4738","0.0003","16.4123","0.0002","90","","112.604","0.002","90","","2905.17","0.11","293","2","293","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H22 Cl2 N4 Ni O5 -","- C32 H22 Cl2 N4 Ni O5 -","- C128 H88 Cl8 N16 Ni4 O20 -","4","0.5","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","x-ray","1.54179","CuKα","","0.0425","0.0396","","","0.1145","0.1177","","","","","","1.064","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056296","9.1303","0.0002","14.5345","0.0004","16.2519","0.0004","111.927","0.002","101.346","0.002","91.831","0.002","1948.36","0.09","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C36 H30 Cl4 N6 Ni2 O4 -","- C36 H30 Cl4 N6 Ni2 O4 -","- C72 H60 Cl8 N12 Ni4 O8 -","2","1","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","x-ray","1.54179","CuKα","","0.038","0.0326","","","0.0845","0.0886","","","","","","1.029","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056297","9.9429","0.0005","13.0412","0.0008","13.3013","0.0007","101.807","0.005","109.788","0.005","110.194","0.005","1418.63","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H21 Cl2 N5 Ni O5 -","- C28 H21 Cl2 N5 Ni O5 -","- C56 H42 Cl4 N10 Ni2 O10 -","2","1","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","","1.54179","CuKα","","0.0588","0.0558","","","","0.1667","","","","","","1.05","","","","has coordinates","197639","2020-10-21","18:00:00",""
"7056298","9.2556","0.0003","14.8268","0.0006","16.1754","0.0006","111.483","0.004","100.81","0.003","92.223","0.003","2014.82","0.14","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C36 H30 Cl4 Mn2 N6 O4 -","- C36 H30 Cl4 Mn2 N6 O4 -","- C72 H60 Cl8 Mn4 N12 O8 -","2","1","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","x-ray","1.54179","CuKα","","0.0395","0.0328","","","0.083","0.0878","","","","","","1.055","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056299","14.2239","0.0004","14.4704","0.0004","20.2197","0.0006","90","","103.441","0.003","90","","4047.7","0.2","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C38 H22 Cl4 Mn2 N4 O9 -","- C38 H22 Cl4 Mn2 N4 O9 -","- C152 H88 Cl16 Mn8 N16 O36 -","4","0.5","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","","1.54184","CuKα","","0.064","0.0551","","","","0.1739","","","","","","1.021","","","","has coordinates","197639","2020-10-21","18:00:00",""
"7056300","12.1676","0.0014","20.804","0.002","8.437","0.002","90","","98.687","0.002","90","","2111.2","0.6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18.81 H16.42 Cl2 Co N2 O5 -","- C18.806 H16.418 Cl2 Co N2 O5 -","- C75.224 H65.672 Cl8 Co4 N8 O20 -","4","0.5","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","","0.71073","MoKα","","0.0598","0.0437","","","","0.13","","","","","","0.874","","","","has coordinates,has disorder","197639","2020-10-21","18:00:00",""
"7056301","11.2439","0.0005","11.9828","0.0004","12.2375","0.0005","67.691","0.004","71.274","0.004","82.655","0.003","1444.61","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C61 H36 Cl6 Cr2 N10 O14 -","- C61 H36 Cl6 Cr2 N10 O14 -","- C61 H36 Cl6 Cr2 N10 O14 -","1","0.5","","Androš Dubraja, Lidija; Molcanov, Kresimir; Žilić, Dijana; Kojic-Prodic, Biserka; Wenger, Emmanuel","Multifunctionality and size of the chloranilate ligand define the topology of transition metal coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01058C","","","1.54179","CuKα","","0.054","0.0517","","","","0.1473","","","","","","1.058","","","","has coordinates","197639","2020-10-21","18:00:00",""
"7056302","13.9521","0.0008","10.5005","0.0005","14.1217","0.0008","90","","117.346","0.003","90","","1837.69","0.18","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H13 Cl N4 -","- C23 H13 Cl N4 -","- C92 H52 Cl4 N16 -","4","2","","Giardinetti, Maxime; Marrot, Jérome; Coeffard, Vincent; Moreau, Xavier; Greck, Christine","Synthesis and Fluorosolvatochromic Properties of 1,7-Annulated Indoles","New J. Chem.","2017","","","","","10.1039/C7NJ00365J","","","0.71073","MoKα","","0.0797","0.053","","","0.1221","0.1402","","","","","","1.113","","","","has coordinates","197761","2020-10-21","18:00:00",""
"7056303","19.6402","0.0013","8.4523","0.0005","21.958","0.003","90","","93.816","0.01","90","","3637.1","0.6","93","2","93","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C30 H44 Mn2 N6 O16 -","- C30 H44 Mn2 N6 O16 -","- C120 H176 Mn8 N24 O64 -","4","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.089","0.0625","","","0.0844","0.0916","","","","","","1.069","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056304","20.2718","0.0014","14.4091","0.001","24.8638","0.0017","90","","90","","90","","7262.7","0.9","93","2","93","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C66 H74 Cl4 F12 Mn4 N8 O12 P2 -","- C66 H74 Cl4 F12 Mn4 N8 O12 P2 -","- C264 H296 Cl16 F48 Mn16 N32 O48 P8 -","4","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71073","MoKα","","0.1098","0.0577","","","0.1252","0.1513","","","","","","1.032","","","","has coordinates,has disorder","197762","2020-10-21","18:00:00",""
"7056305","8.325","0.0001","10.8767","0.0001","8.5879","0.0006","90","","110.364","0.008","90","","729.02","0.06","93","2","93","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H20 N2 O3 -","- C15 H20 N2 O3 -","- C30 H40 N4 O6 -","2","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","1.54187","CuKα","","0.0276","0.0263","","","0.0616","0.0623","","","","","","1.057","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056306","9.7305","0.0007","20.371","0.0014","15.4532","0.0011","90","","90","","90","","3063.1","0.4","93","2","93","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C30 H32 Cu2 N4 O4 -","- C30 H32 Cu2 N4 O4 -","- C120 H128 Cu8 N16 O16 -","4","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","1.54178","CuKα","","0.0222","0.0216","","","0.0594","0.0597","","","","","","1.048","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056307","8.267","0.004","14.974","0.008","12.165","0.006","90","","91.544","0.012","90","","1505.4","1.3","223","2","223","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C31 H36 Co2 N4 O9 -","- C31 H36 Co2 N4 O9 -","- C62 H72 Co4 N8 O18 -","2","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.0554","0.045","","","0.0778","0.081","","","","","","1.052","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056308","8.3252","0.0003","14.6827","0.0005","11.7096","0.0008","90","","105.716","0.007","90","","1377.83","0.13","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 Cu N4 O4 -","- C30 H34 Cu N4 O4 -","- C60 H68 Cu2 N8 O8 -","2","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.0355","0.0323","","","0.0789","0.0805","","","","","","1.098","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056309","14.868","0.0004","16.1416","0.0004","16.3814","0.0005","90","","95.451","0.003","90","","3913.65","0.19","93","2","93","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H47 Cl4 N4 Ni2 O8 -","- C36 H47 Cl4 N4 Ni2 O8 -","- C144 H188 Cl16 N16 Ni8 O32 -","4","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71073","MoKα","","0.0461","0.0332","","","0.0756","0.081","","","","","","1.059","","","","has coordinates,has disorder","197762","2020-10-21","18:00:00",""
"7056310","8.3214","0.0005","14.6642","0.0009","11.6946","0.0008","90","","105.64","0.007","90","","1374.22","0.16","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H34 N4 Ni O4 -","- C30 H34 N4 Ni O4 -","- C60 H68 N8 Ni2 O8 -","2","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.0386","0.0339","","","0.0691","0.071","","","","","","1.135","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056311","33.988","0.002","22.4348","0.0004","25.8057","0.0004","90","","90","","90","","19677.2","1.2","93","2","93","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C45 H46 Cl4 Mn3 N6 O6 -","- C45 H46 Cl4 Mn3 N6 O6 -","- C720 H736 Cl64 Mn48 N96 O96 -","16","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","1.54187","CuKα","","0.0529","0.0515","","","0.1372","0.1391","","","","","","1.064","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056312","8.7376","0.0014","12.3604","0.0019","9.2476","0.0014","90","","108.002","0.008","90","","949.9","0.3","93","2","93","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C22 H25 N3 O3 -","- C22 H25 N3 O3 -","- C44 H50 N6 O6 -","2","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.1102","0.098","","","0.2348","0.2438","","","","","","1.094","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056313","9.7831","0.0007","9.0271","0.0006","16.4023","0.0012","90","","103.691","0.007","90","","1407.38","0.18","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 N2 O3 -","- C15 H20 N2 O3 -","- C60 H80 N8 O12 -","4","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.0774","0.054","","","0.1089","0.117","","","","","","1.06","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056314","8.4079","0.0002","12.0756","0.0002","19.9987","0.0014","90","","93.505","0.007","90","","2026.68","0.15","93","2","93","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H44 Co2 N6 O6 -","- C44 H44 Co2 N6 O6 -","- C88 H88 Co4 N12 O12 -","2","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","1.54187","CuKα","","0.1063","0.0793","","","0.2055","0.2592","","","","","","1.092","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056315","32.9393","0.0014","32.2445","0.0014","15.9331","0.0011","90","","94.087","0.007","90","","16879.7","1.6","93","2","93","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C77 H62 B F24 Mn3 N6 O8 -","- C77 H62 B F24 Mn3 N6 O8 -","- C616 H496 B8 F192 Mn24 N48 O64 -","8","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.1284","0.0951","","","0.1716","0.1843","","","","","","1.168","","","","has coordinates,has disorder","197762","2020-10-21","18:00:00",""
"7056316","13.1202","0.0009","13.8904","0.0002","10.9592","0.0001","90","","104.628","0.007","90","","1932.52","0.15","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Tripyalk1","","","- C22 H25 N3 O3 -","- C22 H25 N3 O3 -","- C88 H100 N12 O12 -","4","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","1.54187","CuKα","","0.0514","0.0422","","","0.0971","0.1026","","","","","","1.094","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056317","16.9892","0.0006","13.5833","0.0005","33.108","0.002","90","","90.462","0.006","90","","7640.1","0.6","93","2","93","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C61 H64 Mn4 N8 O11 -","- C61 H64 Mn4 N8 O11 -","- C244 H256 Mn16 N32 O44 -","4","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.1713","0.1347","","","0.2513","0.2724","","","","","","1.089","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056318","10.1205","0.0006","12.7849","0.0008","11.5863","0.0008","90","","96.938","0.007","90","","1488.17","0.17","93","2","93","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 Cu2 N4 O8 -","- C30 H40 Cu2 N4 O8 -","- C60 H80 Cu4 N8 O16 -","2","0.5","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.0389","0.0352","","","0.0914","0.0932","","","","","","1.164","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056319","10.8407","0.0001","15.3854","0.0002","24.009","0.0016","90","","90","","90","","4004.4","0.3","93","2","93","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H27 N3 O4 -","- C22 H27 N3 O4 -","- C176 H216 N24 O32 -","8","1","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","1.54187","CuKα","","0.0771","0.0673","","","0.1974","0.2094","","","","","","1.117","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056320","19.8078","0.0006","15.0917","0.0004","29.829","0.002","90","","96.066","0.007","90","","8867","0.7","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H46 Cl2 Mn2 N6 O6 -","- C45 H46 Cl2 Mn2 N6 O6 -","- C360 H368 Cl16 Mn16 N48 O48 -","8","2","","Shopov, Dimitar Yavorov; Sharninghausen, Liam; Sinha, Shashi Bhushan; Borowski, Julia; Mercado, Brandon; Brudvig, Gary; Crabtree, Robert H.","Synthesis of Pyridine-Alkoxide Ligands for Formation of Polynuclear Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01845B","","","0.71075","MoKα","","0.1011","0.052","","","0.1054","0.1322","","","","","","1.055","","","","has coordinates","197762","2020-10-21","18:00:00",""
"7056321","23.175","0.004","9.9645","0.0011","16.245","0.002","90","","107.625","0.018","90","","3575.3","0.9","294.1","0.3","294.1","0.3","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H15 N5 O -","- C22 H15 N5 O -","- C176 H120 N40 O8 -","8","1","","Dam, Binoyargha; Patil, Ranjit A.; Ma, Yuan-Ron; Pal, Amarta Kumar","Preparation, characterization and catalytic application of nano-Fe3O4-DOPA-SnO2 having high TON and TOF for non-toxic and sustainable synthesis of dihydroquinazolinone derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ01208J","","","0.71073","MoKα","","0.0958","0.0552","","","0.1072","0.1284","","","","","","1.0743","","","","has coordinates","197763","2020-10-21","18:00:00",""
"7056322","14.3966","0.0017","6.8726","0.0005","17.724","0.002","90","","113.844","0.015","90","","1604","0.3","293.25","0.1","293.25","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 N2 O2 -","- C19 H16 N2 O2 -","- C76 H64 N8 O8 -","4","1","","Dam, Binoyargha; Patil, Ranjit A.; Ma, Yuan-Ron; Pal, Amarta Kumar","Preparation, characterization and catalytic application of nano-Fe3O4-DOPA-SnO2 having high TON and TOF for non-toxic and sustainable synthesis of dihydroquinazolinone derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ01208J","","","0.7107","MoKα","","0.101843","0.071879","","","","0.156951","","","","","","1.07444","","","","has coordinates","197763","2020-10-21","18:00:00",""
"7056323","13.027","0.002","8.884","0.0012","11.4246","0.0017","90","","109.209","0.018","90","","1248.6","0.3","289.84","0.17","289.84","0.17","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 N2 O -","- C15 H14 N2 O -","- C60 H56 N8 O4 -","4","1","","Dam, Binoyargha; Patil, Ranjit A.; Ma, Yuan-Ron; Pal, Amarta Kumar","Preparation, characterization and catalytic application of nano-Fe3O4-DOPA-SnO2 having high TON and TOF for non-toxic and sustainable synthesis of dihydroquinazolinone derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ01208J","","","0.7107","MoKα","","0.075829","0.052442","","","","0.153069","","","","","","1.06218","","","","has coordinates","197763","2020-10-21","18:00:00",""
"7056324","7.007","0.0004","17.952","0.002","26.4727","0.0017","90","","90","","90","","3330","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H19 N3 O -","- C19 H19 N3 O -","- C152 H152 N24 O8 -","8","1","","Kumar, Akshay; Trivedi, Manoj; Yadav, Bhaskaran; Sharma, Raj Kishore; Singh, Gurmeet","Synthetic, Spectral and Structural Studies of a Schiff Base and its Anticorrosive Activity on Mild Steel in H2SO4","New J. Chem.","2017","","","","","10.1039/C7NJ00896A","","","0.71073","MoKα","","0.12","0.0671","","","0.1339","0.1694","","","","","","0.7","","","","has coordinates","197764","2020-10-21","18:00:00",""
"7056325","8.8015","0.0015","10.0257","0.0017","13.876","0.002","74.233","0.003","83.559","0.003","64.292","0.003","1061.7","0.3","150","2","150.15","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H14 N10 Ni O5 -","- C20 H14 N10 Ni O5 -","- C40 H28 N20 Ni2 O10 -","2","1","","Rabelo, Renato; Valdo, Ana Karoline Silva Medanha; Robertson, Craig C.; Thomas, Jim; Stumpf, Humberto Osório; Martins, Felipe Terra; Pedroso, Emerson F.; Julve, Miguel; Lloret, Francesc; Cangussu, Danielle","Metal(II)-assisted hydrolysis of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine (tpymt): synthesis, crystal structure and magnetic properties of [Co(bpcam)2]ClO4 . dmso . H2O, [Co(bpcam)2]2[Co(NCS)4] . dmso . H2O and [Ni(bpcam)2] . H2O [Hbpcam = bis(2-pyrimidylcarbonyl)amide]","New J. Chem.","2017","","","","","10.1039/C7NJ00526A","","","0.71073","MoKα","","0.0805","0.0535","","","0.1309","0.1478","","","","","","1.015","","","","has coordinates","197796","2020-10-21","18:00:00",""
"7056326","10.1227","0.0002","22.0252","0.0006","12.4721","0.0003","90","","94.198","0.001","90","","2773.25","0.11","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 Cl Co N10 O10 S -","- C22 H20 Cl Co N10 O10 S -","- C88 H80 Cl4 Co4 N40 O40 S4 -","4","1","","Rabelo, Renato; Valdo, Ana Karoline Silva Medanha; Robertson, Craig C.; Thomas, Jim; Stumpf, Humberto Osório; Martins, Felipe Terra; Pedroso, Emerson F.; Julve, Miguel; Lloret, Francesc; Cangussu, Danielle","Metal(II)-assisted hydrolysis of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine (tpymt): synthesis, crystal structure and magnetic properties of [Co(bpcam)2]ClO4 . dmso . H2O, [Co(bpcam)2]2[Co(NCS)4] . dmso . H2O and [Ni(bpcam)2] . H2O [Hbpcam = bis(2-pyrimidylcarbonyl)amide]","New J. Chem.","2017","","","","","10.1039/C7NJ00526A","","","0.71073","MoKα","","0.0529","0.0415","","","0.1042","0.1117","","","","","","1.037","","","","has coordinates,has disorder","197796","2020-10-21","18:00:00",""
"7056327","19.5807","0.0005","24.4918","0.0006","14.4619","0.0004","90","","117.886","0.001","90","","6130.1","0.3","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C92 H61 Co6 N48 O20 S10 -","- C92 H61 Co6 N48 O20 S10 -","- C184 H122 Co12 N96 O40 S20 -","2","0.5","","Rabelo, Renato; Valdo, Ana Karoline Silva Medanha; Robertson, Craig C.; Thomas, Jim; Stumpf, Humberto Osório; Martins, Felipe Terra; Pedroso, Emerson F.; Julve, Miguel; Lloret, Francesc; Cangussu, Danielle","Metal(II)-assisted hydrolysis of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine (tpymt): synthesis, crystal structure and magnetic properties of [Co(bpcam)2]ClO4 . dmso . H2O, [Co(bpcam)2]2[Co(NCS)4] . dmso . H2O and [Ni(bpcam)2] . H2O [Hbpcam = bis(2-pyrimidylcarbonyl)amide]","New J. Chem.","2017","","","","","10.1039/C7NJ00526A","","","0.71073","MoKα","","0.0512","0.0422","","","0.1287","0.144","","","","","","0.677","","","","has coordinates","197796","2020-10-21","18:00:00",""
"7056328","9.9779","0.0004","12.089","0.0005","10.2249","0.0005","90","","90","","90","","1233.36","0.09","150","2","150","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C2 H18 N2 O10 P2 Zn -","- C2 H18 N2 O10 P2 Zn -","- C8 H72 N8 O40 P8 Zn4 -","4","1","","Vargova, Zuzana; Rostasova, Ingrida; Vilkova, Maria; Gyepes, Robert; Litecka, Miroslava; Kubicek, Vojtech; Imrich, Jan; Lukes, Ivan","Interaction of Zn(II)-cyclen complex with aminomethylphosphonic acid: Original simultaneous potentiometric and 31P NMR data treatment","New J. Chem.","2017","","","","","10.1039/C7NJ00254H","","","0.71073","MoKα","","0.0292","0.0237","","","0.0471","0.0489","","","","","","1.026","","","","has coordinates","197797","2020-10-21","18:00:00",""
"7056329","11.1652","0.0012","11.8584","0.0008","12.0735","0.0011","62.342","0.005","87.199","0.008","74.965","0.007","1362.6","0.2","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H42 Dy2 F12 N4 O10 -","- C54 H42 Dy2 F12 N4 O10 -","- C54 H42 Dy2 F12 N4 O10 -","1","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71073","MoKα","","0.032","0.0293","","","0.0754","0.0762","","","","","","1.008","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056330","11.485","0.003","11.837","0.002","12.232","0.003","94.787","0.001","117.172","0.004","108.494","0.002","1350.6","0.5","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H42 F12 Gd2 N4 O10 -","- C54 H42 F12 Gd2 N4 O10 -","- C54 H42 F12 Gd2 N4 O10 -","1","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71073","MoKα","","0.0204","0.0189","","","0.0507","0.0512","","","","","","1.06","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056331","11.162","0.004","11.852","0.002","12.135","0.003","61.644","0.019","87.4","0.03","75.41","0.03","1362","0.7","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H42 F12 N4 O10 Tb2 -","- C54 H42 F12 N4 O10 Tb2 -","- C54 H42 F12 N4 O10 Tb2 -","1","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71073","MoKα","","0.0881","0.0804","","","0.1963","0.2032","","","","","","1.062","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056332","12.3847","0.0011","22.1376","0.0017","11.3751","0.001","90","","114.766","0.002","90","","2831.8","0.4","113.15","","113.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H46 F12 Gd2 N4 O10 -","- C56 H40.018 F11.994 Gd2 N4 O10 -","- C112 H80.036 F23.988 Gd4 N8 O20 -","2","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71075","MoKα","","0.0713","0.0685","","","0.1517","0.1525","","","","","","1.465","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056333","12.2757","0.0011","22.0146","0.0018","11.4203","0.0011","90","","114.753","0.002","90","","2802.7","0.4","113.15","","113.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H46 Er2 F12 N4 O10 -","- C56 H40.342 Er2 F11.994 N4 O10 -","- C112 H80.684 Er4 F23.988 N8 O20 -","2","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71073","MoKα","","0.0559","0.0494","","","0.1032","0.1048","","","","","","1.441","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056334","11.174","0.003","11.8895","0.0013","12.008","0.003","62.77","0.02","87.11","0.03","74.71","0.03","1363.7","0.6","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H42 F12 Ho2 N4 O10 -","- C54 H42 F12 Ho2 N4 O10 -","- C54 H42 F12 Ho2 N4 O10 -","1","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71073","MoKα","","0.0585","0.055","","","0.1531","0.155","","","","","","1.115","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056335","12.448","0.009","22.405","0.012","11.522","0.008","90","","114.509","0.012","90","","2924","3","113.15","","113.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H46 F12 Ho2 N4 O10 -","- C56 H40.378 F12.006 Ho2 N4 O10 -","- C112 H80.756 F24.012 Ho4 N8 O20 -","2","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71075","MoKα","","0.0762","0.0736","","","0.1589","0.1598","","","","","","1.464","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056336","11.5","0.004","11.839","0.003","12.251","0.004","94.77","0.003","117.275","0.005","108.496","0.004","1353.3","0.7","113.15","","113.15","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H42 Er2 F12 N4 O10 -","- C54 H42 Er2 F12 N4 O10 -","- C54 H42 Er2 F12 N4 O10 -","1","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71073","MoKα","","0.0316","0.0279","","","0.0788","0.0802","","","","","","1.08","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056337","12.3438","0.0011","22.112","0.0018","11.3848","0.001","90","","114.721","0.001","90","","2822.7","0.4","113.15","","113.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H46 F12 N4 O10 Tb2 -","- C56 H40.162 F12.006 N4 O10 Tb2 -","- C112 H80.324 F24.012 N8 O20 Tb4 -","2","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71075","MoKα","","0.0724","0.0699","","","0.1572","0.158","","","","","","1.482","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056338","12.287","0.003","22.05","0.004","11.404","0.002","90","","114.696","0.004","90","","2807.1","1","113.15","","113.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H46 Dy2 F12 N4 O10 -","- C56 H40.366 Dy2 F12.006 N4 O10 -","- C112 H80.732 Dy4 F24.012 N8 O20 -","2","0.5","","Chang, Yi-Xin; Wang, Wen-Min; Zhang, Ru-Xia; Shen, Hai-Yun; Zhou, Xiao-Pu; Wang, Ni-Ni; Cui, Jian-Zhong; Gao, Hong-Ling","Dinuclear Ln(iii) complexes constructed from an 8-hydroxyquinoline Schiff base derivative with different terminal groups show differing slow magnetic relaxation","New J. Chem.","2017","","","","","10.1039/C6NJ04035G","","","0.71075","MoKα","","0.0888","0.0871","","","0.2012","0.2017","","","","","","1.475","","","","has coordinates,has disorder","197839","2020-10-21","18:00:00",""
"7056339","6.7095","0.0002","10.9295","0.0003","19.5603","0.0006","90","","90","","90","","1434.39","0.07","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H9 K N14 O2 -","- C6 H9 K N14 O2 -","- C24 H36 K4 N56 O8 -","4","1","","Safin, Damir A.; Railliet, Antoine P.; Robeyns, Koen; Mitoraj, Mariusz P.; Kubisiak, Piotr; Sagan, Filip; Garcia, Yann","Complexes and salts of the nitrogen-rich triazole‒tetrazole hybrid ligand with alkali and alkaline earth metal cations: experimental and theoretical findings","New J. Chem.","2017","","","","","10.1039/C7NJ01391D","","","0.71073","MoKα","","0.0359","0.0325","","","0.0803","0.0829","","","","","","1.032","","","","has coordinates","197840","2020-10-21","18:00:00",""
"7056340","6.7069","0.0004","20.1149","0.0008","6.7238","0.0004","90","","110.85","0.007","90","","847.7","0.09","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H16 Mg N14 O6 -","- C6 H16 Mg N14 O6 -","- C12 H32 Mg2 N28 O12 -","2","0.5","","Safin, Damir A.; Railliet, Antoine P.; Robeyns, Koen; Mitoraj, Mariusz P.; Kubisiak, Piotr; Sagan, Filip; Garcia, Yann","Complexes and salts of the nitrogen-rich triazole‒tetrazole hybrid ligand with alkali and alkaline earth metal cations: experimental and theoretical findings","New J. Chem.","2017","","","","","10.1039/C7NJ01391D","","","0.71073","MoKα","","0.0429","0.035","","","0.084","0.0877","","","","","","1.073","","","","has coordinates","197840","2020-10-21","18:00:00",""
"7056341","12.994","0.0005","10.8427","0.0003","12.8458","0.0005","90","","119.421","0.005","90","","1576.44","0.12","150","2","150","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C3 H6 N7 Na O2 -","- C3 H6 N7 Na O2 -","- C24 H48 N56 Na8 O16 -","8","1","","Safin, Damir A.; Railliet, Antoine P.; Robeyns, Koen; Mitoraj, Mariusz P.; Kubisiak, Piotr; Sagan, Filip; Garcia, Yann","Complexes and salts of the nitrogen-rich triazole‒tetrazole hybrid ligand with alkali and alkaline earth metal cations: experimental and theoretical findings","New J. Chem.","2017","","","","","10.1039/C7NJ01391D","","","0.71073","MoKα","","0.0296","0.028","","","0.0748","0.0761","","","","","","1.051","","","","has coordinates","197840","2020-10-21","18:00:00",""
"7056342","21.5345","0.0006","6.5665","0.0001","15.7124","0.0004","90","","123.301","0.002","90","","1857","0.09","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C6 H20 Ca N14 O8 -","- C6 H20 Ca N14 O8 -","- C24 H80 Ca4 N56 O32 -","4","0.5","","Safin, Damir A.; Railliet, Antoine P.; Robeyns, Koen; Mitoraj, Mariusz P.; Kubisiak, Piotr; Sagan, Filip; Garcia, Yann","Complexes and salts of the nitrogen-rich triazole‒tetrazole hybrid ligand with alkali and alkaline earth metal cations: experimental and theoretical findings","New J. Chem.","2017","","","","","10.1039/C7NJ01391D","","","0.71073","MoKα","","0.029","0.0267","","","0.0693","0.0706","","","","","","1.095","","","","has coordinates","197840","2020-10-21","18:00:00",""
"7056343","3.4344","0.0008","9.898","0.002","10.611","0.003","115.93","0.03","92.17","0.02","98.473","0.02","318.72","0.16","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H4 Li N7 O -","- C3 H4 Li N7 O -","- C6 H8 Li2 N14 O2 -","2","1","","Safin, Damir A.; Railliet, Antoine P.; Robeyns, Koen; Mitoraj, Mariusz P.; Kubisiak, Piotr; Sagan, Filip; Garcia, Yann","Complexes and salts of the nitrogen-rich triazole‒tetrazole hybrid ligand with alkali and alkaline earth metal cations: experimental and theoretical findings","New J. Chem.","2017","","","","","10.1039/C7NJ01391D","","","0.71073","MoKα","","0.1052","0.0925","","","0.2398","0.2577","","","","","","1.063","","","","has coordinates","197840","2020-10-21","18:00:00",""
"7056344","6.57661","0.00007","10.74411","0.00011","22.3441","0.0003","90","","92.5542","0.001","90","","1577.26","0.03","150","2","150","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C12 H26 Ba2 N28 O9 -","- C12 H26 Ba2 N28 O9 -","- C24 H52 Ba4 N56 O18 -","2","0.5","","Safin, Damir A.; Railliet, Antoine P.; Robeyns, Koen; Mitoraj, Mariusz P.; Kubisiak, Piotr; Sagan, Filip; Garcia, Yann","Complexes and salts of the nitrogen-rich triazole‒tetrazole hybrid ligand with alkali and alkaline earth metal cations: experimental and theoretical findings","New J. Chem.","2017","","","","","10.1039/C7NJ01391D","","","0.71073","MoKα","","0.0276","0.027","","","0.0696","0.0701","","","","","","1.184","","","","has coordinates","197840","2020-10-21","18:00:00",""
"7056345","9.6685","0.0004","9.6685","0.0004","27.3428","0.0007","90","","90","","120","","2213.56","0.14","150","2","150.01","0.1","","","","","","","","5","P 31 2 1","P 31 2""","152","","","","- C34 H28 Fe2 N6 O5 -","- C34 H28 Fe2 N6 O5 -","- C102 H84 Fe6 N18 O15 -","3","0.5","","Yadav, Reena; SINGH, AMITA; Kociok-Kohn, Gabriele; Chauhan, Ratna; Kumar, Abhinav; Gosavi, Suresh W.","Ferrocenyl Benzimidazole with Carboxylic and Nitro Anchors as Potential Sensitizers in Dye-Sensitized Solar Cells","New J. Chem.","2017","","","","","10.1039/C7NJ01464C","","x-ray","0.71073","MoKα","","0.1043","0.0686","","","0.1579","0.1747","","","","","","1.054","","","","has coordinates","198024","2020-10-21","18:00:00",""
"7056346","6.9737","0.0005","10.1021","0.0007","10.3328","0.0007","66.047","0.002","73.622","0.002","73.682","0.002","626.64","0.08","110","2","110","2","","","","","","","","6","P -1","-P 1","2","S116","","","- C22 H27 Cl3 Mn N2 O7 -","- C22 H27 Cl3 Mn N2 O7 -","- C22 H27 Cl3 Mn N2 O7 -","1","0.5","","Chattopadhyay, Shouvik; Sarkar, Nandita; Harms, Klaus; Frontera, Antonio","The importance of unconventional C‒H•••π(SCN) interactions in stabilizing the unexpected syn/anti arrangement of pendant alkoxy side arms in two manganese(IV) Schiff base complexes: Exploration of catechol oxidase and phenoxazinone synthase like activities","New J. Chem.","2017","","","","","10.1039/C7NJ00766C","","","0.71073","MoKα","","0.058","0.0556","","","0.1355","0.1363","","","","","","1.429","","","","has coordinates,has disorder","198066","2020-10-21","18:00:00",""
"7056347","10.7379","0.0005","14.9326","0.0007","18.4749","0.0009","90","","105.857","0.002","90","","2849.6","0.2","110","2","110","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","S113","","","- C27 H35 Mn N3 O8 S -","- C27 H35 Mn N3 O8 S -","- C108 H140 Mn4 N12 O32 S4 -","4","1","","Chattopadhyay, Shouvik; Sarkar, Nandita; Harms, Klaus; Frontera, Antonio","The importance of unconventional C‒H•••π(SCN) interactions in stabilizing the unexpected syn/anti arrangement of pendant alkoxy side arms in two manganese(IV) Schiff base complexes: Exploration of catechol oxidase and phenoxazinone synthase like activities","New J. Chem.","2017","","","","","10.1039/C7NJ00766C","","","0.71073","MoKα","","0.0771","0.0678","","","0.1364","0.1404","","","","","","1.138","","","","has coordinates,has disorder","198066","2020-10-21","18:00:00",""
"7056348","10.5079","0.0003","12.9149","0.0004","19.0193","0.0007","90","","104.295","0.004","90","","2501.16","0.15","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 Cl2 N8 Pt -","- C20 H28 Cl2 N8 Pt -","- C80 H112 Cl8 N32 Pt4 -","4","1","","Łakomska, Iwona; babinska, magdalena; Wojtczak, Andrzej; Kozakiewicz, Anna; Sitkowski, Jerzy; Jarzecki, Andrzej A.","Experimental and theoretical investigation of the complexation of 5-methyl-7-isobutyl-1,2,4-triazolo[1,5-a]pyrimidine by platinum(II) ion","New J. Chem.","2017","","","","","10.1039/C7NJ01112A","","","0.71073","MoKα","","0.0387","0.0244","","","0.0469","0.0488","","","","","","0.946","","","","has coordinates","198067","2020-10-21","18:00:00",""
"7056349","13.0528","0.0004","10.3031","0.0003","13.9763","0.0004","90","","99.763","0.003","90","","1852.37","0.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Cl2 N4 O Pt S -","- C12 H20 Cl2 N4 O Pt S -","- C48 H80 Cl8 N16 O4 Pt4 S4 -","4","1","","Łakomska, Iwona; babinska, magdalena; Wojtczak, Andrzej; Kozakiewicz, Anna; Sitkowski, Jerzy; Jarzecki, Andrzej A.","Experimental and theoretical investigation of the complexation of 5-methyl-7-isobutyl-1,2,4-triazolo[1,5-a]pyrimidine by platinum(II) ion","New J. Chem.","2017","","","","","10.1039/C7NJ01112A","","","0.71073","MoKα","","0.049","0.0351","","","0.0897","0.0927","","","","","","1.044","","","","has coordinates","198067","2020-10-21","18:00:00",""
"7056350","13.983","0.004","7.6739","0.0011","15.073","0.004","90","","116.36","0.04","90","","1449.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H17 Cl2 N5 Pt -","- C10 H17 Cl2 N5 Pt -","- C40 H68 Cl8 N20 Pt4 -","4","1","","Łakomska, Iwona; babinska, magdalena; Wojtczak, Andrzej; Kozakiewicz, Anna; Sitkowski, Jerzy; Jarzecki, Andrzej A.","Experimental and theoretical investigation of the complexation of 5-methyl-7-isobutyl-1,2,4-triazolo[1,5-a]pyrimidine by platinum(II) ion","New J. Chem.","2017","","","","","10.1039/C7NJ01112A","","","0.71073","MoKα","","0.1176","0.0766","","","0.1946","0.213","","","","","","1.041","","","","has coordinates","198067","2020-10-21","18:00:00",""
"7056351","11.469","0.004","9.506","0.001","19.52","0.006","90","","90","","90","","2128.2","1","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C10 H14 N4 -","- C10 H14 N4 -","- C80 H112 N32 -","8","1","","Łakomska, Iwona; babinska, magdalena; Wojtczak, Andrzej; Kozakiewicz, Anna; Sitkowski, Jerzy; Jarzecki, Andrzej A.","Experimental and theoretical investigation of the complexation of 5-methyl-7-isobutyl-1,2,4-triazolo[1,5-a]pyrimidine by platinum(II) ion","New J. Chem.","2017","","","","","10.1039/C7NJ01112A","","","0.71073","MoKα","","0.1066","0.0708","","","0.2051","0.233","","","","","","1.044","","","","has coordinates","198067","2020-10-21","18:00:00",""
"7056352","12.7474","0.0013","16.9894","0.0018","16.8809","0.0018","90","","102.817","0.001","90","","3564.8","0.6","293","2","293.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H51 N4 Nd O Si4 -","- C24 H51 N4 Nd O Si4 -","- C96 H204 N16 Nd4 O4 Si16 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0522","0.0418","","","0.1077","0.1158","","","","","","1.04","","","","has coordinates","198108","2020-10-21","18:00:00",""
"7056353","9.4869","0.0007","19.017","0.0014","19.2467","0.0014","90","","90","","90","","3472.3","0.4","293","2","293.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H51 N4 O Si4 Yb -","- C24 H51 N4 O Si4 Yb -","- C96 H204 N16 O4 Si16 Yb4 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0668","0.0616","","","0.1448","0.1503","","","","","","1.059","","","","has coordinates,has disorder","198108","2020-10-21","18:00:00",""
"7056354","9.5148","0.0009","19.1828","0.0018","19.1886","0.0018","90","","90","","90","","3502.3","0.6","293","2","293.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H51 Dy N4 O Si4 -","- C24 H51 Dy N4 O Si4 -","- C96 H204 Dy4 N16 O4 Si16 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0472","0.0439","","","0.1116","0.1145","","","","","","1.112","","","","has coordinates","198108","2020-10-21","18:00:00",""
"7056355","12.7324","0.0009","16.9061","0.0011","16.9308","0.0012","90","","102.417","0.001","90","","3559.2","0.4","293","2","293.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H51 N4 O Si4 Sm -","- C24 H51 N4 O Si4 Sm -","- C96 H204 N16 O4 Si16 Sm4 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0363","0.028","","","0.0616","0.0671","","","","","","1.009","","","","has coordinates,has disorder","198108","2020-10-21","18:00:00",""
"7056356","10.9219","0.001","18.945","0.0017","16.7845","0.0015","90","","93.955","0.001","90","","3464.7","0.5","293","2","293.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H51 N4 O Si4 Y -","- C24 H51 N4 O Si4 Y -","- C96 H204 N16 O4 Si16 Y4 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0989","0.0449","","","0.0859","0.1022","","","","","","1.001","","","","has coordinates","198108","2020-10-21","18:00:00",""
"7056357","9.5144","0.0008","19.1019","0.0016","19.2125","0.0016","90","","90","","90","","3491.7","0.5","293","2","293.15","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H51 Er N4 O Si4 -","- C24 H51 Er N4 O Si4 -","- C96 H204 Er4 N16 O4 Si16 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0302","0.0255","","","0.0558","0.0576","","","","","","1.037","","","","has coordinates","198108","2020-10-21","18:00:00",""
"7056358","16.8027","0.0016","12.4348","0.0012","17.2821","0.0016","90","","101.284","0.001","90","","3541.1","0.6","293","2","293.15","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C24 H51 Gd N4 O Si4 -","- C24 H51 Gd N4 O Si4 -","- C96 H204 Gd4 N16 O4 Si16 -","4","1","","Gu, Xiaoxia; Wang, Shaowu; Wei, Yun; Zhu, Xiancui; Zhou, Shuangliu; Huang, Zeming; Mu, Xiaolong","Rare earth metal bisamido complexes with a NNO tridentate ligand and catalytic activity for selective polymerization of isoprene","New J. Chem.","2017","","","","","10.1039/C7NJ01454F","","","0.71073","MoKα","","0.0343","0.0245","","","0.0557","0.0593","","","","","","1.052","","","","has coordinates,has disorder","198108","2020-10-21","18:00:00",""
"7056359","15.7192","0.0013","15.7192","0.0013","15.4669","0.0019","90","","90","","120","","3309.7","0.6","173","2","173","2","","","","","","","","6","P 63","P 6c","173","","","","- C71 H51 Cu4 I4 N7 O6 -","- C71 H50.9997 Cu4 I4 N7 O6 -","- C142 H101.999 Cu8 I8 N14 O12 -","2","0.333333","","razali, mohd rizal; Zhan, Shun-Ze; Tai Wei, Chan","Solvent-mediated single-crystal-to-single-crystal transformation from dimeric to tetrameric copper(I) complex based on a substituted pyridine derived from the Diels-Alder adduct","New J. Chem.","2017","","","","","10.1039/C7NJ01552F","","","0.71073","MoKα","","0.0808","0.0579","","","0.1061","0.1165","","","","","","1.031","","","","has coordinates","198109","2020-10-21","18:00:00",""
"7056360","17.5818","0.0006","12.0417","0.0004","8.0384","0.0003","90","","99.013","0.001","90","","1680.83","0.1","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 N2 O2 -","- C23 H16 N2 O2 -","- C92 H64 N8 O8 -","4","1","","razali, mohd rizal; Zhan, Shun-Ze; Tai Wei, Chan","Solvent-mediated single-crystal-to-single-crystal transformation from dimeric to tetrameric copper(I) complex based on a substituted pyridine derived from the Diels-Alder adduct","New J. Chem.","2017","","","","","10.1039/C7NJ01552F","","","0.71073","MoKα","","0.055","0.0449","","","0.1182","0.1297","","","","","","1.038","","","","has coordinates","198109","2020-10-21","18:00:00",""
"7056361","16.5376","0.0018","7.735","0.0007","34.802","0.003","90","","97.83","0.003","90","","4410.3","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C50 H38 Cu2 I2 N6 O4 -","- C50 H38 Cu2 I2 N6 O4 -","- C200 H152 Cu8 I8 N24 O16 -","4","0.5","","razali, mohd rizal; Zhan, Shun-Ze; Tai Wei, Chan","Solvent-mediated single-crystal-to-single-crystal transformation from dimeric to tetrameric copper(I) complex based on a substituted pyridine derived from the Diels-Alder adduct","New J. Chem.","2017","","","","","10.1039/C7NJ01552F","","","0.71073","MoKα","","0.0595","0.0534","","","0.1092","0.1116","","","","","","1.195","","","","has coordinates","198109","2020-10-21","18:00:00",""
"7056362","15.086","0.004","17.048","0.004","17.876","0.008","103.16","0.005","110.463","0.006","107.684","0.004","3806","2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C55 H88 Ca2 Cl4 N20 O21 -","- C55 H70 Ca2 Cl4 N20 O21 -","- C110 H140 Ca4 Cl8 N40 O42 -","2","1","","Wu, Yufan; Xu, Lixi; Shen, Yenan; Wang, Yang; Wang, Qiaochun","Helianthus-like Cucurbit[4]uril and Cucurbit[5]uril analogues","New J. Chem.","2017","","","","","10.1039/C7NJ01595J","","","0.71073","MoKα","","0.1471","0.1187","","","0.3621","0.3927","","","","","","1.483","","","","has coordinates","198110","2020-10-21","18:00:00",""
"7056363","12.666","0.001","20.7418","0.0016","11.672","0.0009","90","","111.646","0.001","90","","2850.2","0.4","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H76 Ca2 Cl4 N16 O18 -","- C44 H76 Ca2 Cl4 N16 O18 -","- C88 H152 Ca4 Cl8 N32 O36 -","2","0.5","","Wu, Yufan; Xu, Lixi; Shen, Yenan; Wang, Yang; Wang, Qiaochun","Helianthus-like Cucurbit[4]uril and Cucurbit[5]uril analogues","New J. Chem.","2017","","","","","10.1039/C7NJ01595J","","","0.71073","MoKα","","0.0533","0.0437","","","0.1323","0.1461","","","","","","1.068","","","","has coordinates,has disorder","198110","2020-10-21","18:00:00",""
"7056364","9.5043","0.0011","11.142","0.0011","12.986","0.0014","109.453","0.007","103.185","0.009","92.637","0.008","1251.3","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H32 N4 O4 -","- C28 H32 N4 O4 -","- C56 H64 N8 O8 -","2","1","","Chattopadhyay, Pabitra; Maji, Abhishek; Pal, Siddhartha; Lohar, Somenath; Mukhopadhyay, Subhra Kanti","A new turn-on benzimidazole based greenish-yellow fluorescent sensor for Zn2+ ion at biological pH applicable in cell imaging","New J. Chem.","2017","","","","","10.1039/C7NJ01821E","","","0.71073","MoKα","","0.1391","0.0608","","","0.1507","0.2166","","","","","","1","","","","has coordinates","198111","2020-10-21","18:00:00",""
"7056365","18.5957","0.0005","14.4379","0.0004","8.6771","0.0002","90","","112.451","0.001","90","","2153.08","0.1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H14 N8 O11 Ru2 -","- C12 H14 N8 O11 Ru2 -","- C48 H56 N32 O44 Ru8 -","4","0.5","","Kostin, Gennadiy; Mikhailov, Artem Alexandrovich; Kuratieva, Natalia; Pishchur, Denis P.; Zharkov, Dmitry O.; Grin, Inga Rostislavovna","Influence of pyridine-like ligands on the structure, photochemical and biological properties of nitro-nitrosyl ruthenium complexes.","New J. Chem.","2017","","","","","10.1039/C7NJ01602F","","","0.71073","MoKα","","0.0327","0.023","","","0.0492","0.0511","","","","","","1.025","","","","has coordinates","198112","2020-10-21","18:00:00",""
"7056366","9.4624","0.0003","9.9201","0.0003","17.3772","0.0005","90","","94.292","0.001","90","","1626.59","0.09","80","2","80","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H15 N5 O6 Ru -","- C12 H15 N5 O6 Ru -","- C48 H60 N20 O24 Ru4 -","4","1","","Kostin, Gennadiy; Mikhailov, Artem Alexandrovich; Kuratieva, Natalia; Pishchur, Denis P.; Zharkov, Dmitry O.; Grin, Inga Rostislavovna","Influence of pyridine-like ligands on the structure, photochemical and biological properties of nitro-nitrosyl ruthenium complexes.","New J. Chem.","2017","","","","","10.1039/C7NJ01602F","","","0.71073","MoKα","","0.0194","0.0184","","","0.0465","0.047","","","","","","1.073","","","","has coordinates,has disorder","198112","2020-10-21","18:00:00",""
"7056367","28.1411","0.001","9.5372","0.0003","13.4951","0.0005","90","","116.104","0.001","90","","3252.5","0.2","150","2","150","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C12 H15 N5 O6 Ru -","- C12 H15 N5 O6 Ru -","- C96 H120 N40 O48 Ru8 -","8","2","","Kostin, Gennadiy; Mikhailov, Artem Alexandrovich; Kuratieva, Natalia; Pishchur, Denis P.; Zharkov, Dmitry O.; Grin, Inga Rostislavovna","Influence of pyridine-like ligands on the structure, photochemical and biological properties of nitro-nitrosyl ruthenium complexes.","New J. Chem.","2017","","","","","10.1039/C7NJ01602F","","","0.71073","MoKα","","0.0263","0.0253","","","0.0647","0.0652","","","","","","1.037","","","","has coordinates","198112","2020-10-21","18:00:00",""
"7056368","9.459","0.0002","9.9164","0.0003","17.3619","0.0005","90","","94.27","0.001","90","","1624.01","0.08","80","2","80","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H15 N5 O6 Ru -","- C12 H15 N5 O6 Ru -","- C48 H60 N20 O24 Ru4 -","4","1","","Kostin, Gennadiy; Mikhailov, Artem Alexandrovich; Kuratieva, Natalia; Pishchur, Denis P.; Zharkov, Dmitry O.; Grin, Inga Rostislavovna","Influence of pyridine-like ligands on the structure, photochemical and biological properties of nitro-nitrosyl ruthenium complexes.","New J. Chem.","2017","","","","","10.1039/C7NJ01602F","","","0.71073","MoKα","","0.0192","0.0182","","","0.0457","0.0462","","","","","","1.041","","","","has coordinates","198112","2020-10-21","18:00:00",""
"7056369","9.7379","0.001","10.3204","0.0012","20.607","0.002","90","","90.386","0.003","90","","2070.9","0.4","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 Cl2 N5 O6 Ru -","- C13 H17 Cl2 N5 O6 Ru -","- C52 H68 Cl8 N20 O24 Ru4 -","4","1","","Kostin, Gennadiy; Mikhailov, Artem Alexandrovich; Kuratieva, Natalia; Pishchur, Denis P.; Zharkov, Dmitry O.; Grin, Inga Rostislavovna","Influence of pyridine-like ligands on the structure, photochemical and biological properties of nitro-nitrosyl ruthenium complexes.","New J. Chem.","2017","","","","","10.1039/C7NJ01602F","","","0.71073","MoKα","","0.0541","0.0461","","","0.1438","0.1544","","","","","","1.192","","","","has coordinates,has disorder","198112","2020-10-21","18:00:00",""
"7056370","16.2703","0.0006","10.6913","0.0004","16.8761","0.0005","90","","90","","90","","2935.61","0.18","150","2","150","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C24 H22 Cl2 N12 O4 Pd2 -","- C24 H22 Cl2 N12 O4 Pd2 -","- C96 H88 Cl8 N48 O16 Pd8 -","4","0.5","","Patra, Shanti G.; Shee, Nirmal K.; Drew, Michael G. B.; Datta, Dipankar","Palladium(II)-palladium(II) bonding in two open clamshell dinuclear complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01604B","","","0.71073","MoKα","","0.0778","0.0432","","","0.079","0.0933","","","","","","1.019","","","","has coordinates","198130","2020-10-21","18:00:00",""
"7056371","10.5484","0.0016","11.4088","0.0014","13.033","0.002","66.797","0.015","67.828","0.015","89.922","0.011","1314.8","0.4","150","2","150","2","","","","","","","","6","P 1","P 1","1","","","","- C52 H44 Cl2 N14 O8 Pd2 -","- C52 H44 Cl2 N14 O8 Pd2 -","- C52 H44 Cl2 N14 O8 Pd2 -","1","1","","Patra, Shanti G.; Shee, Nirmal K.; Drew, Michael G. B.; Datta, Dipankar","Palladium(II)-palladium(II) bonding in two open clamshell dinuclear complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01604B","","","0.71073","MoKα","","0.0275","0.0258","","","0.0589","0.0605","","","","","","1.026","","","","has coordinates","198130","2020-10-21","18:00:00",""
"7056372","5.8417","0.0003","8.906","0.0005","12.8197","0.0007","86.18","0.002","88.587","0.002","72.272","0.002","633.87","0.06","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H8 F3 N2 O2 S -","- C12 H8 F3 N2 O2 S -","- C24 H16 F6 N4 O4 S2 -","2","1","","S. Chourasiya, Sumit; Patel, Dhara; Nagaraja, C. M.; Chakraborti, Asit Kumar; Bharatam, Prasad. V.","Sulfonamide vs.Sulfonimide: Tautomerism and Electronic Structure Analysis of N-Heterocyclic Arenesulfonamides","New J. Chem.","2017","","","","","10.1039/C7NJ01353A","","","0.71073","MoKα","","0.0708","0.0668","","","0.1973","0.2019","","","","","","1.086","","","","has coordinates","198157","2020-10-21","18:00:00",""
"7056373","10.9279","0.0004","18.813","0.0006","21.313","0.0008","90","","93.944","0.002","90","","4371.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H20 N6 O8 Zn2 -","- C36 H20 N6 O8 Zn2 -","- C144 H80 N24 O32 Zn8 -","4","1","","Zhang, Jinfang; Gong, Linpei; Feng, Jiaoyang; Wu, Junjie; Zhang, Chi","Two Luminescent Zn(II)/Cd(II) Metal-Organic Frameworks as Rare Multifunctional Sensors","New J. Chem.","2017","","","","","10.1039/C7NJ01072A","","","0.71073","MoKα","","0.0872","0.0623","","","0.1652","0.1753","","","","","","1.048","","","","has coordinates","198229","2020-10-21","18:00:00",""
"7056374","10.9463","0.0003","17.965","0.0005","13.4705","0.0003","90","","122.026","0.002","90","","2245.82","0.11","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 Cd N8 O5 -","- C22 H18 Cd N8 O5 -","- C88 H72 Cd4 N32 O20 -","4","1","","Zhang, Jinfang; Gong, Linpei; Feng, Jiaoyang; Wu, Junjie; Zhang, Chi","Two Luminescent Zn(II)/Cd(II) Metal-Organic Frameworks as Rare Multifunctional Sensors","New J. Chem.","2017","","","","","10.1039/C7NJ01072A","","","0.71073","MoKα","","0.0359","0.0289","","","0.0768","0.0796","","","","","","1.034","","","","has coordinates","198229","2020-10-21","18:00:00",""
"7056375","9.9381","0.0006","9.8","0.0006","31.5878","0.0019","90","","98.325","0.003","90","","3044","0.3","100","2","100","2","","","","","","","synthesis as described","8","P 1 21/n 1","-P 2yn","14","","","","- C27 H23 Br Cl2 F6 N6 P Ru -","- C27 H23 Br Cl2 F6 N6 P Ru -","- C108 H92 Br4 Cl8 F24 N24 P4 Ru4 -","4","1","","Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle","Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines","New J. Chem.","2017","","","","","10.1039/C7NJ00866J","","x-ray","0.71073","MoKα","","0.0417","0.0326","","","0.0668","0.0694","","","","","","1.145","","","","has coordinates,has disorder","198274","2020-10-21","18:00:00",""
"7056376","28.016","0.0014","8.6148","0.0005","20.3292","0.001","90","","90","","90","","4906.5","0.4","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C21 H17 Cl3 N4 O2 Ru -","- C21 H17 Cl3 N4 O2 Ru -","- C168 H136 Cl24 N32 O16 Ru8 -","8","1","","Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle","Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines","New J. Chem.","2017","","","","","10.1039/C7NJ00866J","","x-ray","0.71073","MoKα","","0.0761","0.0386","","","0.0715","0.0844","","","","","","0.993","","","","has coordinates","198274","2020-10-21","18:00:00",""
"7056377","14.023","0.006","7.125","0.004","25.62","0.012","90","","105.62","0.017","90","","2465","2","100","2","100","2","","","","","","","synthesis as described","8","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 Cl2 F6 N4 O P Ru -","- C21 H15 Cl2 F6 N4 O P Ru -","- C84 H60 Cl8 F24 N16 O4 P4 Ru4 -","4","1","","Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle","Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines","New J. Chem.","2017","","","","","10.1039/C7NJ00866J","","x-ray","0.71073","MoKα","","0.0557","0.0346","","","0.0701","0.0779","","","","","","1.044","","","","has coordinates","198274","2020-10-21","18:00:00",""
"7056378","6.9624","0.0006","14.2674","0.001","14.4225","0.0011","88.839","0.002","80.54","0.002","83.493","0.002","1404.07","0.19","100","2","100","2","","","","","","","synthesis as described","8","P -1","-P 1","2","","","","- C25 H23 Cl2 F6 N4 O3 P Ru -","- C25 H23 Cl2 F6 N4 O3 P Ru -","- C50 H46 Cl4 F12 N8 O6 P2 Ru2 -","2","1","","Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle","Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines","New J. Chem.","2017","","","","","10.1039/C7NJ00866J","","x-ray","0.71073","MoKα","","0.0386","0.0293","","","0.0652","0.0695","","","","","","1.043","","","","has coordinates","198274","2020-10-21","18:00:00",""
"7056379","7.6187","0.0008","25.999","0.003","13.6071","0.0012","90","","103.433","0.011","90","","2621.5","0.5","180","2","180","2","","","","","","","synthesis as described","8","P 1 21/c 1","-P 2ybc","14","","","","- C24 H20 Cl2 F6 N4 O P Ru -","- C24 H20 Cl2 F6 N4 O P Ru -","- C96 H80 Cl8 F24 N16 O4 P4 Ru4 -","4","1","","Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle","Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines","New J. Chem.","2017","","","","","10.1039/C7NJ00866J","","x-ray","0.71073","MoKα","","0.1127","0.0766","","","0.1336","0.147","","","","","","1.091","","","","has coordinates,has disorder","296814","2024-12-10","08:46:16",""
"7056380","10.8897","0.0009","17.2969","0.0013","13.3346","0.001","90","","105.353","0.003","90","","2422","0.3","100","2","100","2","","","","","","","synthesis as described","9","P 1 21/n 1","-P 2yn","14","","","","- C21 H14 Br Cl2 F6 N4 O P Ru -","- C21 H14 Br Cl2 F6 N4 O P Ru -","- C84 H56 Br4 Cl8 F24 N16 O4 P4 Ru4 -","4","1","","Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle","Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines","New J. Chem.","2017","","","","","10.1039/C7NJ00866J","","x-ray","0.71073","MoKα","","0.0494","0.0346","","","0.0772","0.0837","","","","","","1.051","","","","has coordinates,has disorder","198274","2020-10-21","18:00:00",""
"7056381","21.673","0.002","25.105","0.003","11.5618","0.0012","90","","97.922","0.003","90","","6230.7","1.1","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C50 H47 Cl4 F12 N9 O5 P2 Ru2 -","- C50 H47 Cl4 F12 N9 O5 P2 Ru2 -","- C200 H188 Cl16 F48 N36 O20 P8 Ru8 -","4","1","","Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle","Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines","New J. Chem.","2017","","","","","10.1039/C7NJ00866J","","","0.71073","MoKα","","0.1272","0.0947","","","0.2264","0.2447","","","","","","1.021","","","","has coordinates,has disorder","198274","2020-10-21","18:00:00",""
"7056382","14.1159","0.0006","15.3254","0.0007","18.2305","0.0009","90","","112.383","0.003","90","","3646.7","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 N3 O -","- C24 H19 N3 O -","- C192 H152 N24 O8 -","8","2","","Murali, Karunanidhi; Sparkes, Hazel Anne; Pandiyan, B.Vijaya; Prasad, Rajendra","Synthesis, Photophysical Properties and DFT analysis of Highly substituted Pyrido Carbazole-based “push pull” chromophores","New J. Chem.","2017","","","","","10.1039/C7NJ00643H","","","0.71073","MoKα","","0.1235","0.0801","","","0.1874","0.2063","","","","","","1.083","","","","has coordinates","198275","2020-10-21","18:00:00",""
"7056383","10.0881","0.0004","15.1974","0.0006","12.209","0.0005","90","","98.801","0.003","90","","1849.76","0.13","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H19 N3 O -","- C24 H19 N3 O -","- C96 H76 N12 O4 -","4","1","","Murali, Karunanidhi; Sparkes, Hazel Anne; Pandiyan, B.Vijaya; Prasad, Rajendra","Synthesis, Photophysical Properties and DFT analysis of Highly substituted Pyrido Carbazole-based “push pull” chromophores","New J. Chem.","2017","","","","","10.1039/C7NJ00643H","","","0.71073","MoKα","","0.0537","0.0408","","","0.0998","0.1072","","","","","","1.04","","","","has coordinates","198275","2020-10-21","18:00:00",""
"7056384","10.7239","0.0011","15.4965","0.0015","10.3257","0.001","90","","91.507","0.008","90","","1715.4","0.3","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 N3 O S -","- C21 H15 N3 O S -","- C84 H60 N12 O4 S4 -","4","1","","Murali, Karunanidhi; Sparkes, Hazel Anne; Pandiyan, B.Vijaya; Prasad, Rajendra","Synthesis, Photophysical Properties and DFT analysis of Highly substituted Pyrido Carbazole-based “push pull” chromophores","New J. Chem.","2017","","","","","10.1039/C7NJ00643H","","","0.71073","MoKα","","0.1173","0.0857","","","0.2348","0.2495","","","","","","1.161","","","","has coordinates","198275","2020-10-21","18:00:00",""
"7056385","9.9044","0.0006","16.2434","0.0009","12.9264","0.0008","90","","106.592","0.004","90","","1993","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H21 N3 O -","- C25 H21 N3 O -","- C100 H84 N12 O4 -","4","1","","Murali, Karunanidhi; Sparkes, Hazel Anne; Pandiyan, B.Vijaya; Prasad, Rajendra","Synthesis, Photophysical Properties and DFT analysis of Highly substituted Pyrido Carbazole-based “push pull” chromophores","New J. Chem.","2017","","","","","10.1039/C7NJ00643H","","","0.71073","MoKα","","0.0594","0.0449","","","0.1123","0.122","","","","","","1.031","","","","has coordinates","198275","2020-10-21","18:00:00",""
"7056386","13.4283","0.001","15.7465","0.0011","16.5327","0.0011","90","","92.893","0.006","90","","3491.4","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H17 N3 O -","- C23 H17 N3 O -","- C184 H136 N24 O8 -","8","4","","Murali, Karunanidhi; Sparkes, Hazel Anne; Pandiyan, B.Vijaya; Prasad, Rajendra","Synthesis, Photophysical Properties and DFT analysis of Highly substituted Pyrido Carbazole-based “push pull” chromophores","New J. Chem.","2017","","","","","10.1039/C7NJ00643H","","","0.71073","MoKα","","0.1143","0.0592","","","0.0966","0.116","","","","","","0.993","","","","has coordinates","198275","2020-10-21","18:00:00",""
"7056387","6.7125","0.0003","9.9947","0.0003","15.6535","0.0003","88.139","0.002","87.315","0.002","80.902","0.003","1035.5","0.06","100","0.1","100","0.1","","","","","","","","3","P -1","-P 1","2","4-(3-phenylprop-2-ynoyl)phenyl 4-tert-butylbenzoate (4aj)","4-(3-phenylpropioloyl)phenyl benzoate","","- C26 H22 O3 -","- C26 H22 O3 -","- C52 H44 O6 -","2","1","","Levashov, Andrey; Aksenov, Nicolai A.; Aksenova, Inna V.; Konshin, Valeriy V.","Oxidative coupling of tetraalkynyltin with aldehydes leading to alkynyl ketones","New J. Chem.","2017","","","","","10.1039/C7NJ01376K","","x-ray","1.54184","CuKα","","0.0413","0.0374","","","0.1","0.1038","","","","","","1.037","","","","has coordinates","198303","2020-10-21","18:00:00",""
"7056388","4.6091","0.0005","14.1634","0.0017","24.427","0.003","90","","97.974","0.003","90","","1579.2","0.3","223.1","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H18 N2 O5 -","- C17 H18 N2 O5 -","- C68 H72 N8 O20 -","4","1","","Kulikov, Oleg V.; Sevryugina, Yulia V.; Mehmood, Arshad; Saraogi, Ishu","Characterization of aggregated morphologies derived from mono- and bis-arylbenzamides ‒ potential alpha-helix mimetics","New J. Chem.","2017","","","","","10.1039/C6NJ03775E","","","0.71075","MoKα","","","0.0688","","","","0.1614","","","","","","1.051","","","","has coordinates","198304","2020-10-21","18:00:00",""
"7056389","7.7375","0.0015","8.0667","0.0016","12.449","0.003","86.51","0.03","88.96","0.03","64.82","0.03","701.9","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H18 N2 O5 -","- C13 H18 N2 O5 -","- C26 H36 N4 O10 -","2","1","","Kulikov, Oleg V.; Sevryugina, Yulia V.; Mehmood, Arshad; Saraogi, Ishu","Characterization of aggregated morphologies derived from mono- and bis-arylbenzamides ‒ potential alpha-helix mimetics","New J. Chem.","2017","","","","","10.1039/C6NJ03775E","","","0.71073","MoKα","","0.0941","0.0504","","","0.1197","0.136","","","","","","1.032","","","","has coordinates","198304","2020-10-21","18:00:00",""
"7056390","10.0873","0.0013","16.344","0.002","41.016","0.005","80.339","0.004","83.426","0.004","72.997","0.004","6359.5","1.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C69 H85 N4 O14.5 -","- C69 H85 N4 O14.5 -","- C276 H340 N16 O58 -","4","2","","Kulikov, Oleg V.; Sevryugina, Yulia V.; Mehmood, Arshad; Saraogi, Ishu","Characterization of aggregated morphologies derived from mono- and bis-arylbenzamides ‒ potential alpha-helix mimetics","New J. Chem.","2017","","","","","10.1039/C6NJ03775E","","","0.71073","MoKα","","0.126","0.1055","","","0.2567","0.2745","","","","","","1.073","","","","has coordinates,has disorder","198304","2020-10-21","18:00:00",""
"7056391","8.4076","0.0003","37.3169","0.0017","21.4037","0.001","90","","95.689","0.001","90","","6682.2","0.5","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","none","dimethyl 4,4'-((4,4'-((2,7-di-tert-butyl-9,9-dimethyl-9H- xanthene-4,5-dicarbonyl)bis(azanediyl)) bis(3-isobutoxybenzoyl))bis(azanediyl)) bis(3-isobutoxybenzoate)","","- C71 H86 N4 O13 -","- C71 H86 N4 O13 -","- C284 H344 N16 O52 -","4","1","","Kulikov, Oleg V.; Sevryugina, Yulia V.; Mehmood, Arshad; Saraogi, Ishu","Characterization of aggregated morphologies derived from mono- and bis-arylbenzamides ‒ potential alpha-helix mimetics","New J. Chem.","2017","","","","","10.1039/C6NJ03775E","","","0.71073","MoKα","","0.0584","0.0514","","","0.1257","0.1325","","","","","","1.061","","","","has coordinates,has disorder","198304","2020-10-21","18:00:00",""
"7056392","15.5078","0.0006","8.1447","0.0003","29.4236","0.001","90","","93.075","0.003","90","","3711","0.2","293","","293","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 Cl7 N3 P Ru S -","- C30 H32 Cl7 N3 P Ru S -","- C120 H128 Cl28 N12 P4 Ru4 S4 -","4","1","","Devagi, Ganesan; Reyhaneh, Farghadani; Dallemer, Frederic; Jayakumar, Rajarajeswaran; Palaniappan, kalaivani; Prabhakaran, Rathinasabapathi","Morphological and in vitro evaluation of programmed cell death in MCF-7 cells by new organoruthenium(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01707C","","x-ray","0.71073","MoKα","","0.0899","0.0598","","","0.1104","0.12","","","","","","1.07","","","","has coordinates,has disorder","198357","2020-10-21","18:00:00",""
"7056393","35.076","0.003","10.0258","0.0006","8.8087","0.0005","90","","94.027","0.006","90","","3090.1","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H13 F3 N4 O3 -","- C15 H13 F3 N4 O3 -","- C120 H104 F24 N32 O24 -","8","1","","Chen, Mimi; Zhou, Zhengwei; Suo, Yaxiong; Li, Mengyao; Yao, Jianhua; Peng, Ling; Xia, Yi","Acyclonucleosides Bearing Coplanar Arylethynyltriazole Nucleobases: Synthesis, Structural Analysis and Biological Evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ01406F","","","0.71073","MoKα","","0.0693","0.0545","","","0.1397","0.1516","","","","","","1.07","","","","has coordinates,has disorder","198449","2020-10-21","18:00:00",""
"7056394","17.568","0.0009","9.9977","0.0005","8.8328","0.0005","90","","104.264","0.006","90","","1503.56","0.14","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 N4 O4 -","- C15 H16 N4 O4 -","- C60 H64 N16 O16 -","4","1","","Chen, Mimi; Zhou, Zhengwei; Suo, Yaxiong; Li, Mengyao; Yao, Jianhua; Peng, Ling; Xia, Yi","Acyclonucleosides Bearing Coplanar Arylethynyltriazole Nucleobases: Synthesis, Structural Analysis and Biological Evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ01406F","","","0.71073","MoKα","","0.0803","0.0518","","","0.1228","0.1418","","","","","","1.052","","","","has coordinates","198449","2020-10-21","18:00:00",""
"7056395","11.4857","0.0007","6.9956","0.0004","33.95","0.003","90","","90","","90","","2727.9","0.3","175","2","175","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H14 N4 O3 -","- C14 H14 N4 O3 -","- C112 H112 N32 O24 -","8","1","","Chen, Mimi; Zhou, Zhengwei; Suo, Yaxiong; Li, Mengyao; Yao, Jianhua; Peng, Ling; Xia, Yi","Acyclonucleosides Bearing Coplanar Arylethynyltriazole Nucleobases: Synthesis, Structural Analysis and Biological Evaluation","New J. Chem.","2017","","","","","10.1039/C7NJ01406F","","","0.71073","MoKα","","0.0596","0.0487","","","0.1321","0.1368","","","","","","1.165","","","","has coordinates","198449","2020-10-21","18:00:00",""
"7056396","11.311","0.0005","11.3185","0.0005","11.4135","0.0005","61.842","0.002","67.726","0.002","78.709","0.002","1191.88","0.1","296","2","296","2","","","","","","","","5","P -1","-P 1","2","[Cu(L)(ac)]2(solv) (complex 3)","","","- C46 H66 Cu2 N2 O12 -","- C46 H66 Cu2 N2 O12 -","- C46 H66 Cu2 N2 O12 -","1","0.5","","Sanyal, Ria; Ketkov, Sergey Yu.; Purkait, Suranjana; Mautner, Franz Andreas; Zhigulin, Grigory; Das, Debasis","Nuclearity dependent solvent contribution on the catechol oxidase activity of novel Copper(II) complexes derived from Mannich-base ligand platforms: synthesis, crystal structure and mechanism","New J. Chem.","2017","","","","","10.1039/C7NJ00425G","","","0.71073","MoKα","","0.0392","0.0332","","","0.1016","0.1071","","","","","","1.073","","","","has coordinates","198450","2020-10-21","18:00:00",""
"7056397","15.8284","0.0004","12.343","0.0003","16.6575","0.0004","90","","90","","90","","3254.37","0.14","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","[Cu(L)Br]2 (complex 4)","","","- C28 H44 Br2 Cu2 N2 O6 -","- C28 H44 Br2 Cu2 N2 O6 -","- C112 H176 Br8 Cu8 N8 O24 -","4","0.5","","Sanyal, Ria; Ketkov, Sergey Yu.; Purkait, Suranjana; Mautner, Franz Andreas; Zhigulin, Grigory; Das, Debasis","Nuclearity dependent solvent contribution on the catechol oxidase activity of novel Copper(II) complexes derived from Mannich-base ligand platforms: synthesis, crystal structure and mechanism","New J. Chem.","2017","","","","","10.1039/C7NJ00425G","","","0.71073","MoKα","","0.0811","0.0437","","","0.0782","0.0931","","","","","","1.038","","","","has coordinates","198450","2020-10-21","18:00:00",""
"7056398","9.2173","0.0006","15.4782","0.001","11.0439","0.0007","90","","95.457","0.002","90","","1568.46","0.17","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Cu(L)Cl]2 (complex 5)","","","- C28 H44 Cl2 Cu2 N2 O6 -","- C28 H44 Cl2 Cu2 N2 O6 -","- C56 H88 Cl4 Cu4 N4 O12 -","2","0.5","","Sanyal, Ria; Ketkov, Sergey Yu.; Purkait, Suranjana; Mautner, Franz Andreas; Zhigulin, Grigory; Das, Debasis","Nuclearity dependent solvent contribution on the catechol oxidase activity of novel Copper(II) complexes derived from Mannich-base ligand platforms: synthesis, crystal structure and mechanism","New J. Chem.","2017","","","","","10.1039/C7NJ00425G","","","0.71073","MoKα","","0.0784","0.0511","","","0.1302","0.1537","","","","","","1.068","","","","has coordinates","198450","2020-10-21","18:00:00",""
"7056399","12.548","0.0016","12.7661","0.0016","22.424","0.003","92.579","0.006","93.385","0.006","117.938","0.005","3157.1","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","(Cu4-Complex 1)","","","- C101 H176 Cu8 N8 O39 -","- C101 H176 Cu8 N8 O39 -","- C101 H176 Cu8 N8 O39 -","1","0.5","","Sanyal, Ria; Ketkov, Sergey Yu.; Purkait, Suranjana; Mautner, Franz Andreas; Zhigulin, Grigory; Das, Debasis","Nuclearity dependent solvent contribution on the catechol oxidase activity of novel Copper(II) complexes derived from Mannich-base ligand platforms: synthesis, crystal structure and mechanism","New J. Chem.","2017","","","","","10.1039/C7NJ00425G","","","0.71073","MoKα","","0.1814","0.1117","","","0.2889","0.3432","","","","","","1.021","","","","has coordinates,has disorder","198450","2020-10-21","18:00:00",""
"7056400","9.1226","0.0007","11.7431","0.0008","29.958","0.002","90","","90","","90","","3209.3","0.4","296","2","296","2","","","","","","","","6","P n c a","-P 2a 2n","60","(complex 2)","","","- C21 H40 Cl2 Cu2 N2 O15 -","- C21 H40 Cl2 Cu2 N2 O14.9 -","- C84 H160 Cl8 Cu8 N8 O59.6 -","4","0.5","","Sanyal, Ria; Ketkov, Sergey Yu.; Purkait, Suranjana; Mautner, Franz Andreas; Zhigulin, Grigory; Das, Debasis","Nuclearity dependent solvent contribution on the catechol oxidase activity of novel Copper(II) complexes derived from Mannich-base ligand platforms: synthesis, crystal structure and mechanism","New J. Chem.","2017","","","","","10.1039/C7NJ00425G","","","0.71073","MoKα","","0.128","0.1038","","","0.2923","0.3141","","","","","","1.109","","","","has coordinates,has disorder","198450","2020-10-21","18:00:00",""
"7056401","10.2706","0.0002","11.8221","0.0003","17.2366","0.0003","104.385","0.0014","95.617","0.0014","109.568","0.0013","1872.19","0.07","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H52 Cu N2 O6 -","- C38 H50 Cu N2 O6 -","- C76 H100 Cu2 N4 O12 -","2","1","","Kumar, Santosh; Garg, Shipra; Sharma, Raj Pal; Venugoplan, Paloth; Tenti, Lorenzo; Ferretti, Valeria; Nivelle, Laetitia; Tarpin, Michel; Guillon, Emmanuel","Four monomeric copper(II) complexes of non-steroidal anti-inflammatory drug Ibuprofen and N-donor ligands: Syntheses, characterization, crystal structures and cytotoxicity studies.","New J. Chem.","2017","","","","","10.1039/C7NJ00247E","","","0.71073","MoKα","","0.0647","0.049","","","0.1351","0.1452","","","","","","1.042","","","","has coordinates","198501","2020-10-21","18:00:00",""
"7056402","16.5388","0.0004","6.1918","0.0001","17.4653","0.0004","90","","94.803","0.0014","90","","1782.25","0.07","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H56 Cu N2 O6 -","- C34 H56 Cu N2 O6 -","- C68 H112 Cu2 N4 O12 -","2","0.5","","Kumar, Santosh; Garg, Shipra; Sharma, Raj Pal; Venugoplan, Paloth; Tenti, Lorenzo; Ferretti, Valeria; Nivelle, Laetitia; Tarpin, Michel; Guillon, Emmanuel","Four monomeric copper(II) complexes of non-steroidal anti-inflammatory drug Ibuprofen and N-donor ligands: Syntheses, characterization, crystal structures and cytotoxicity studies.","New J. Chem.","2017","","","","","10.1039/C7NJ00247E","","","0.71073","MoKα","","0.0711","0.0548","","","0.1423","0.1572","","","","","","1.064","","","","has coordinates,has disorder","198501","2020-10-21","18:00:00",""
"7056403","9.4147","0.0002","11.8811","0.0003","17.5005","0.0004","95.564","0.001","103.187","0.001","103.464","0.001","1830.12","0.07","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H50 Cu N2 O5 -","- C38 H50 Cu N2 O5 -","- C76 H100 Cu2 N4 O10 -","2","1","","Kumar, Santosh; Garg, Shipra; Sharma, Raj Pal; Venugoplan, Paloth; Tenti, Lorenzo; Ferretti, Valeria; Nivelle, Laetitia; Tarpin, Michel; Guillon, Emmanuel","Four monomeric copper(II) complexes of non-steroidal anti-inflammatory drug Ibuprofen and N-donor ligands: Syntheses, characterization, crystal structures and cytotoxicity studies.","New J. Chem.","2017","","","","","10.1039/C7NJ00247E","","","0.71073","MoKα","","0.0715","0.056","","","0.1586","0.169","","","","","","1.079","","","","has coordinates","198501","2020-10-21","18:00:00",""
"7056404","9.4147","0.0002","11.8811","0.0003","17.5005","0.0004","95.564","0.001","103.187","0.001","103.464","0.001","1830.12","0.07","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H50 Cu N2 O5 -","- C38 H50 Cu N2 O5 -","- C76 H100 Cu2 N4 O10 -","2","1","","Kumar, Santosh; Garg, Shipra; Sharma, Raj Pal; Venugoplan, Paloth; Tenti, Lorenzo; Ferretti, Valeria; Nivelle, Laetitia; Tarpin, Michel; Guillon, Emmanuel","Four monomeric copper(II) complexes of non-steroidal anti-inflammatory drug Ibuprofen and N-donor ligands: Syntheses, characterization, crystal structures and cytotoxicity studies.","New J. Chem.","2017","","","","","10.1039/C7NJ00247E","","","0.71073","MoKα","","0.0712","0.0558","","","0.1587","0.1695","","","","","","1.065","","","","has coordinates","198501","2020-10-21","18:00:00",""
"7056405","10.1145","0.0008","12.2682","0.001","12.3933","0.0009","72.208","0.002","75.931","0.002","83.695","0.002","1419.32","0.19","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H20 Gd2 N4 O14 S3 -","- C24 H20 Gd2 N4 O14 S3 -","- C48 H40 Gd4 N8 O28 S6 -","2","1","","Zheng, Teng-Fei; Yao, Shu-Li; Cao, Chen; Liu, Sui-Jun; Hu, Hui-Kang; Zhang, Tao; Huang, Hai-Ping; Liao, Jin-Sheng; Chen, Jing-Lin; Wen, He-Rui","Large magnetic entropy changes in three GdIII coordination polymers containing GdIII chains","New J. Chem.","2017","","","","","10.1039/C7NJ01463E","","","0.71073","MoKα","","0.0742","0.0522","","","0.1315","0.1382","","","","","","1.09","","","","has coordinates","198502","2020-10-21","18:00:00",""
"7056406","7.963","0.0009","14.9838","0.0016","19.642","0.002","90","","94.281","0.002","90","","2337.1","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H30 Gd2 O18 -","- C15 H30 Gd2 O18 -","- C60 H120 Gd8 O72 -","4","0.5","","Zheng, Teng-Fei; Yao, Shu-Li; Cao, Chen; Liu, Sui-Jun; Hu, Hui-Kang; Zhang, Tao; Huang, Hai-Ping; Liao, Jin-Sheng; Chen, Jing-Lin; Wen, He-Rui","Large magnetic entropy changes in three GdIII coordination polymers containing GdIII chains","New J. Chem.","2017","","","","","10.1039/C7NJ01463E","","","0.71073","MoKα","","0.024","0.0219","","","0.042","0.0425","","","","","","1.228","","","","has coordinates,has disorder","198502","2020-10-21","18:00:00",""
"7056407","36.202","0.007","15.391","0.003","29.655","0.006","90","","90","","90","","16523","6","273","2","273","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C42 H31 Eu N O8 P -","- C42 H31 Eu N O8 P -","- C336 H248 Eu8 N8 O64 P8 -","8","1","","Katagiri, Kosuke; Matsuo, Naoya; Kawahata, Masatoshi; Masu, Hyuma; Yamaguchi, Kentaro","Aqua Coordination to Attenuate the Luminescence Properties of Europium(III)-Phosphine Oxide Porous Coordination Polymers","New J. Chem.","2017","","","","","10.1039/C7NJ00637C","","","0.8","Synchrotron","","0.0661","0.0515","","","0.1599","0.1798","","","","","","0.718","","","","has coordinates","198586","2020-10-21","18:00:00",""
"7056408","36.205","0.007","15.379","0.003","29.692","0.006","90","","90","","90","","16532","6","273","2","273","2","","","","","","","","6","P c c a","-P 2a 2ac","54","","","","- C41.28 H29.31 Eu N0.76 O8 P -","- C41.274 H29.306 Eu N0.758 O8 P -","- C330.192 H234.448 Eu8 N6.064 O64 P8 -","8","1","","Katagiri, Kosuke; Matsuo, Naoya; Kawahata, Masatoshi; Masu, Hyuma; Yamaguchi, Kentaro","Aqua Coordination to Attenuate the Luminescence Properties of Europium(III)-Phosphine Oxide Porous Coordination Polymers","New J. Chem.","2017","","","","","10.1039/C7NJ00637C","","","0.8","Synchrotron","","0.0515","0.0428","","","0.1318","0.1378","","","","","","1.094","","","","has coordinates,has disorder","198586","2020-10-21","18:00:00",""
"7056409","7.484","0.0004","7.8907","0.0004","10.2465","0.0005","90","","93.122","0.003","90","","604.2","0.05","296","","296","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C3 H5 N9 O12 -","- C3 H5 N9 O12 -","- C6 H10 N18 O24 -","2","1","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.0379","0.0314","","","0.0867","0.1263","","","","","","1.261","","","","has coordinates","198662","2020-10-21","18:00:00",""
"7056410","23.003","0.002","6.749","0.0007","19.422","0.002","90","","90","","90","","3015.2","0.5","296.15","","296.15","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C5 H5 N13 O10 -","- C5 H5 N13 O10 -","- C40 H40 N104 O80 -","8","2","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.1222","0.0602","","","0.1454","0.1774","","","","","","1.006","","","","has coordinates","198662","2020-10-21","18:00:00",""
"7056411","12.264","0.005","20.048","0.007","12.605","0.005","90","","98.056","0.017","90","","3069","2","296.15","","296.15","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 N14 O10 -","- C4 H4 N14 O10 -","- C32 H32 N112 O80 -","8","1","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.1142","0.0534","","","0.1195","0.1469","","","","","","1.001","","","","has coordinates,has disorder","198662","2020-10-21","18:00:00",""
"7056412","9.2722","0.0011","13.486","0.0016","12.5676","0.0015","90","","90","","90","","1571.5","0.3","296.15","","296.15","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C5 H6 N14 O10 -","- C5 H6 N14 O10 -","- C20 H24 N56 O40 -","4","1","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.0726","0.0432","","","0.0818","0.0927","","","","","","1.008","","","","has coordinates","198662","2020-10-21","18:00:00",""
"7056413","8.228","0.0004","7.3357","0.0003","11.3167","0.0005","90","","94.923","0.003","90","","680.54","0.05","296","2","296.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C3 H7 N11 O11 -","- C3 H7 N11 O11 -","- C6 H14 N22 O22 -","2","1","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.0505","0.0369","","","0.0735","0.0776","","","","","","0.956","","","","has coordinates,has disorder","198662","2020-10-21","18:00:00",""
"7056414","7.8388","0.0015","7.873","0.0015","10.987","0.002","90","","90.413","0.011","90","","678","0.2","296","2","296.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C3 H6 N10 O12 -","- C3 H6 N10 O12 -","- C6 H12 N20 O24 -","2","1","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.0669","0.0426","","","0.1068","0.121","","","","","","1.006","","","","has coordinates,has disorder","198662","2020-10-21","18:00:00",""
"7056415","7.4594","0.0001","7.8789","0.0002","10.4774","0.0002","90","","90.745","0.001","90","","615.72","0.02","170","","170","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C3 H2 K N9 O11 -","- C3 H2 K N9 O11 -","- C6 H4 K2 N18 O22 -","2","1","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.0298","0.0257","","","0.0543","0.0562","","","","","","1.033","","","","has coordinates,has disorder","198662","2020-10-21","18:00:00",""
"7056416","7.5643","0.0007","8.0022","0.0007","10.6515","0.001","90","","91.239","0.002","90","","644.6","0.1","296.15","","296.15","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C3 H6 N10 O11 -","- C3 H6 N10 O11 -","- C6 H12 N20 O22 -","2","1","","Liu, Tianlin; Qi, Xiujuan; Wang, Kangcai; Zhang, Jiaheng; Zhang, Wenquan; Zhang, Qinghua","Green primary energetic materials based on N-(3-nitro-1-(trinitromethyl)-1H-1,2,4-triazol-5-yl)nitramide","New J. Chem.","2017","","","","","10.1039/C7NJ01917C","","","0.71073","MoKα","","0.0482","0.0355","","","0.0739","0.0796","","","","","","1.023","","","","has coordinates,has disorder","198662","2020-10-21","18:00:00",""
"7056417","6.559","0.005","8.777","0.005","15.493","0.005","94.087","0.005","91.473","0.005","92.143","0.005","888.7","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H17 N O4 S -","- C19 H17 N O4 S -","- C38 H34 N2 O8 S2 -","2","1","","Laha, Joydev K.; Sharma, Shubhra; Bhimpuria, Rohan A.; Dayal, Neetu; Dubey, Gurudutt; Bharatam, Prasad. V.","Integration of Oxidative Arylation with Sulfonyl Migration: One-Pot Tandem Synthesis of Densely Functionalized (NH)-Pyrroles","New J. Chem.","2017","","","","","10.1039/C7NJ01709J","","","0.71073","MoKα","","0.0935","0.0529","","","0.1151","0.1314","","","","","","1.036","","","","has coordinates","198663","2020-10-21","18:00:00",""
"7056418","14.953","0.002","13.6358","0.0018","11.0501","0.0015","90","","95.389","0.002","90","","2243.1","0.5","223","2","223","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C28 H50 Ca2 Cl4 N16 O17 -","- C28 H44 Ca2 Cl4 N16 O17 -","- C56 H88 Ca4 Cl8 N32 O34 -","2","0.25","","Shen, Yenan; Zou, Lei; Wang, Qiaochun","Template-directed synthesis of cucurbituril analogues using propanediurea as building block","New J. Chem.","2017","","","","","10.1039/C7NJ01669G","","","0.71073","MoKα","","0.0607","0.0554","","","0.1923","0.2019","","","","","","1.099","","","","has coordinates,has disorder","198664","2020-10-21","18:00:00",""
"7056419","19.356","0.003","11.1923","0.0016","26.552","0.004","90","","90","","90","","5752.2","1.5","223","2","223","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C35 H68 Ba2 Cl4 N20 O24 -","- C35 H40 Ba2 Cl4 N20 O24 -","- C140 H160 Ba8 Cl16 N80 O96 -","4","0.5","","Shen, Yenan; Zou, Lei; Wang, Qiaochun","Template-directed synthesis of cucurbituril analogues using propanediurea as building block","New J. Chem.","2017","","","","","10.1039/C7NJ01669G","","","0.71073","MoKα","","0.0647","0.0563","","","0.1527","0.1577","","","","","","1.199","","","","has coordinates","198664","2020-10-21","18:00:00",""
"7056420","17.3533","0.0006","9.0977","0.0003","17.7828","0.0006","90","","118.702","0.001","90","","2462.51","0.15","100","2","100","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 Cl4 Cu2 N6 S2 -","- C18 H26 Cl4 Cu2 N6 S2 -","- C72 H104 Cl16 Cu8 N24 S8 -","4","0.5","","Torres-García, Pablo; Luna-Giles, Francisco; Garcia, Bernalte; Platas-Iglesias, Carlos; Esteban-Gómez, David; Vinuelas-Zahinos, E.","Effects of the substituents of pyrazole/thiazine ligands on the magnetic properties of chloro-bridged Cu(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01581J","","x-ray","0.71073","MoKα","","0.0285","0.0228","","","0.0517","0.0536","","","","","","1.022","","","","has coordinates","198688","2020-10-21","18:00:00",""
"7056421","7.5613","0.0003","17.6501","0.0007","18.5075","0.0007","90","","90","","90","","2469.97","0.17","100","2","100","2","","","","","","","synthesis as described","6","P b c a","-P 2ac 2ab","61","","","","- C9 H13 Cl2 Cu N3 S -","- C9 H13 Cl2 Cu N3 S -","- C72 H104 Cl16 Cu8 N24 S8 -","8","1","","Torres-García, Pablo; Luna-Giles, Francisco; Garcia, Bernalte; Platas-Iglesias, Carlos; Esteban-Gómez, David; Vinuelas-Zahinos, E.","Effects of the substituents of pyrazole/thiazine ligands on the magnetic properties of chloro-bridged Cu(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01581J","","x-ray","0.71073","MoKα","","0.0227","0.0204","","","0.0535","0.0545","","","","","","1.169","","","","has coordinates","198688","2020-10-21","18:00:00",""
"7056422","17.2598","0.0014","8.9759","0.0007","14.2902","0.0012","90","","106.6","0.001","90","","2121.6","0.3","298","2","298","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H18 Cl4 Cu2 N6 S2 -","- C14 H18 Cl4 Cu2 N6 S2 -","- C56 H72 Cl16 Cu8 N24 S8 -","4","0.5","","Torres-García, Pablo; Luna-Giles, Francisco; Garcia, Bernalte; Platas-Iglesias, Carlos; Esteban-Gómez, David; Vinuelas-Zahinos, E.","Effects of the substituents of pyrazole/thiazine ligands on the magnetic properties of chloro-bridged Cu(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01581J","","x-ray","0.71073","MoKα","","0.0429","0.0396","","","0.1001","0.1021","","","","","","1.111","","","","has coordinates","198688","2020-10-21","18:00:00",""
"7056423","6.34","0.005","15.756","0.005","19.015","0.005","90","0.005","98.637","0.005","90","0.005","1877.9","1.7","110","2","110","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H34 Cl4 Cu2 N6 S2 -","- C38 H34 Cl4 Cu2 N6 S2 -","- C76 H68 Cl8 Cu4 N12 S4 -","2","0.5","","Torres-García, Pablo; Luna-Giles, Francisco; Garcia, Bernalte; Platas-Iglesias, Carlos; Esteban-Gómez, David; Vinuelas-Zahinos, E.","Effects of the substituents of pyrazole/thiazine ligands on the magnetic properties of chloro-bridged Cu(II) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ01581J","","x-ray","0.71073","MoKα","","0.0656","0.0504","","","0.138","0.1477","","","","","","1.133","","","","has coordinates","198688","2020-10-21","18:00:00",""
"7056424","17.9439","0.0013","9.4204","0.0007","9.7121","0.0007","90","","96.528","0.001","90","","1631.1","0.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Cd5 H10 O20 P4 -","- Cd5 H10 O20 P4 -","- Cd20 H40 O80 P16 -","4","0.5","","Zhang, Jun; Su, Jian; Zhao, Meng; Xie, Wenjie; Jin, Jie; Xie, Fazhi; Song, Xiaojie; Zhang, Sheng-Yi; Wu, Jieying; Tian, Yupeng","A series of novel Cadmium(II) coordination polymers with photoluminescence and ferroelectric properties based on zwitterionic ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00524E","","","0.71073","MoKα","","0.0241","0.0204","","","0.0461","0.0473","","","","","","1.091","","","","has coordinates","198689","2020-10-21","18:00:00",""
"7056425","10.5785","0.0005","11.2277","0.0005","15.2628","0.0007","97.333","0.001","93.227","0.001","108.16","0.001","1699.51","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H36 Cd N3 O14 -","- C35 H36 Cd N3 O14 -","- C70 H72 Cd2 N6 O28 -","2","1","","Zhang, Jun; Su, Jian; Zhao, Meng; Xie, Wenjie; Jin, Jie; Xie, Fazhi; Song, Xiaojie; Zhang, Sheng-Yi; Wu, Jieying; Tian, Yupeng","A series of novel Cadmium(II) coordination polymers with photoluminescence and ferroelectric properties based on zwitterionic ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00524E","","","0.71073","MoKα","","0.0367","0.0336","","","0.0839","0.086","","","","","","1.049","","","","has coordinates,has disorder","198689","2020-10-21","18:00:00",""
"7056426","28.471","0.0014","16.1958","0.0008","11.4266","0.0005","90","","104.318","0.001","90","","5105.3","0.4","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C96 H89.4 Cd5 N8 O45.7 -","- C96 H89.4 Cd5 N8 O45.71 -","- C192 H178.8 Cd10 N16 O91.42 -","2","0.5","","Zhang, Jun; Su, Jian; Zhao, Meng; Xie, Wenjie; Jin, Jie; Xie, Fazhi; Song, Xiaojie; Zhang, Sheng-Yi; Wu, Jieying; Tian, Yupeng","A series of novel Cadmium(II) coordination polymers with photoluminescence and ferroelectric properties based on zwitterionic ligand","New J. Chem.","2017","","","","","10.1039/C7NJ00524E","","","0.71073","MoKα","","0.0637","0.0591","","","0.1648","0.1694","","","","","","1.042","","","","has coordinates,has disorder","198689","2020-10-21","18:00:00",""
"7056427","8.1048","0.0003","16.4602","0.0007","24.4695","0.0012","90","","95.214","0.004","90","","3250.9","0.2","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H37 Cu N7 O8 -","- C31 H37 Cu N7 O8 -","- C124 H148 Cu4 N28 O32 -","4","1","","Yilmaz, Veysel T.; Icsel, Ceyda; Suyunova, Feruza; Aygün, Muhittin; Cevatemre, Buse; Ulukaya, Engin","Synthesis, structures, DNA/protein binding, molecular docking, anticancer activity and ROS generation of Ni(II), Cu(II) and Zn(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine","New J. Chem.","2017","","","","","10.1039/C7NJ00887B","","","0.71073","MoKα","","0.0803","0.0484","","","0.1059","0.1179","","","","","","1.028","","","","has coordinates","198690","2020-10-21","18:00:00",""
"7056428","11.955","0.0003","13.1256","0.0004","19.5245","0.0005","90","","98.522","0.003","90","","3029.89","0.14","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H37 Cu N7 O7 -","- C28 H37 Cu N7 O7 -","- C112 H148 Cu4 N28 O28 -","4","1","","Yilmaz, Veysel T.; Icsel, Ceyda; Suyunova, Feruza; Aygün, Muhittin; Cevatemre, Buse; Ulukaya, Engin","Synthesis, structures, DNA/protein binding, molecular docking, anticancer activity and ROS generation of Ni(II), Cu(II) and Zn(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine","New J. Chem.","2017","","","","","10.1039/C7NJ00887B","","x-ray","0.71073","MoKα","","0.0527","0.0402","","","0.0982","0.1049","","","","","","1.051","","","","has coordinates,has disorder","198690","2020-10-21","18:00:00",""
"7056429","12.6201","0.0007","12.9945","0.0007","19.5366","0.001","90","","96.576","0.005","90","","3182.8","0.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H35 Cu N7 O7 -","- C31 H35 Cu N7 O7 -","- C124 H140 Cu4 N28 O28 -","4","1","","Yilmaz, Veysel T.; Icsel, Ceyda; Suyunova, Feruza; Aygün, Muhittin; Cevatemre, Buse; Ulukaya, Engin","Synthesis, structures, DNA/protein binding, molecular docking, anticancer activity and ROS generation of Ni(II), Cu(II) and Zn(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine","New J. Chem.","2017","","","","","10.1039/C7NJ00887B","","x-ray","0.71073","MoKα","","0.0572","0.0378","","","0.0873","0.0959","","","","","","1.011","","","","has coordinates","198690","2020-10-21","18:00:00",""
"7056430","12.0293","0.0005","13.1743","0.0006","19.3947","0.0008","90","","97.84","0.004","90","","3044.9","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H37 N7 O7 Zn -","- C28 H37 N7 O7 Zn -","- C112 H148 N28 O28 Zn4 -","4","1","","Yilmaz, Veysel T.; Icsel, Ceyda; Suyunova, Feruza; Aygün, Muhittin; Cevatemre, Buse; Ulukaya, Engin","Synthesis, structures, DNA/protein binding, molecular docking, anticancer activity and ROS generation of Ni(II), Cu(II) and Zn(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine","New J. Chem.","2017","","","","","10.1039/C7NJ00887B","","x-ray","0.71073","MoKα","","0.0725","0.0445","","","0.0917","0.1043","","","","","","1.034","","","","has coordinates,has disorder","198690","2020-10-21","18:00:00",""
"7056431","12.5914","0.0007","13.0083","0.0007","19.7972","0.0008","90","","97.786","0.005","90","","3212.7","0.3","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H35 N7 Ni O7 -","- C31 H35 N7 Ni O7 -","- C124 H140 N28 Ni4 O28 -","4","1","","Yilmaz, Veysel T.; Icsel, Ceyda; Suyunova, Feruza; Aygün, Muhittin; Cevatemre, Buse; Ulukaya, Engin","Synthesis, structures, DNA/protein binding, molecular docking, anticancer activity and ROS generation of Ni(II), Cu(II) and Zn(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine","New J. Chem.","2017","","","","","10.1039/C7NJ00887B","","x-ray","0.71073","MoKα","","0.0684","0.0411","","","0.0875","0.0984","","","","","","1.01","","","","has coordinates","198690","2020-10-21","18:00:00",""
"7056432","12.6345","0.0005","13.0965","0.0006","19.4378","0.001","90","","95.957","0.004","90","","3199","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H35 N7 O7 Zn -","- C31 H35 N7 O7 Zn -","- C124 H140 N28 O28 Zn4 -","4","1","","Yilmaz, Veysel T.; Icsel, Ceyda; Suyunova, Feruza; Aygün, Muhittin; Cevatemre, Buse; Ulukaya, Engin","Synthesis, structures, DNA/protein binding, molecular docking, anticancer activity and ROS generation of Ni(II), Cu(II) and Zn(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine","New J. Chem.","2017","","","","","10.1039/C7NJ00887B","","x-ray","0.71073","MoKα","","0.0527","0.0361","","","0.0805","0.0872","","","","","","1.03","","","","has coordinates","198690","2020-10-21","18:00:00",""
"7056433","10.6756","0.0003","12.8419","0.0004","19.8099","0.0007","101.496","0.003","96.128","0.003","101.12","0.003","2581.45","0.15","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H63 N11 Ni O14 -","- C44 H63 N11 Ni O14 -","- C88 H126 N22 Ni2 O28 -","2","1","","Yilmaz, Veysel T.; Icsel, Ceyda; Suyunova, Feruza; Aygün, Muhittin; Cevatemre, Buse; Ulukaya, Engin","Synthesis, structures, DNA/protein binding, molecular docking, anticancer activity and ROS generation of Ni(II), Cu(II) and Zn(II) 5,5-diethylbarbiturate complexes with bis(2-pyridylmethyl)amine and terpyridine","New J. Chem.","2017","","","","","10.1039/C7NJ00887B","","x-ray","0.71073","MoKα","","0.0744","0.0581","","","0.1527","0.165","","","","","","1.021","","","","has coordinates","198690","2020-10-21","18:00:00",""
"7056434","10.6","0.0002","12.5286","0.0003","14.5861","0.0003","65.447","0.002","78.817","0.002","76.648","0.002","1703.76","0.07","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","bis(N(4)-ortho-chlorophenyl-2-acetylpyridinethiosemicarbazonato)Indium(III)nitrate methanol and water solvate","","- C30 H34 Cl2 In N9 O6 S2 -","- C30 H29 Cl2 In N9 O6 S2 -","- C60 H58 Cl4 In2 N18 O12 S4 -","2","1","","Oliveira, Alexandre Almeida; Franco, Lucas Lopardi; Dos Santos, Raquel Gouvea; Perdigão, Gabriele de Matos Cardoso; Da Silva, Jeferson G.; Souza-Fagundes, Elaine; Beraldo, Heloisa","Neutron activation of In(III) complexes with thiosemicarbazones leads to the production of potential radiopharmaceuticals for the treatment of breast cancer","New J. Chem.","2017","","","","","10.1039/C7NJ01547J","","","0.71073","MoKα","","0.047","0.0404","","","0.1005","0.1056","","","","","","1.151","","","","has coordinates","198713","2020-10-21","18:00:00",""
"7056435","8.814","0.003","9.208","0.003","14.261","0.004","90","","90","","90","","1157.4","0.6","153","2","153","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C3 H2 Cl2 N4 -","- C3 Cl2 N4 -","- C24 Cl16 N32 -","8","1","","Du, Yao; Zhang, Ji-Chuan; peng, Panpan; Su, Hui; Li, Sheng-Hua; Pang, Si-Ping","Synthesis and characterization of three pyrazolate inner diazonium salts: green, powerful and stable primary explosives","New J. Chem.","2017","","","","","10.1039/C7NJ00876G","","","0.71073","MoKα","","0.0396","0.037","","","0.0997","0.1023","","","","","","1.002","","","","has coordinates","198714","2020-10-21","18:00:00",""
"7056436","11.382","0.003","10.234","0.002","12.054","0.003","90","","109.625","0.003","90","","1322.5","0.5","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-diazo-3,5-dinitropyrazole","","- C3 H0 N6 O4 -","- C3 N6 O4 -","- C24 N48 O32 -","8","2","","Du, Yao; Zhang, Ji-Chuan; peng, Panpan; Su, Hui; Li, Sheng-Hua; Pang, Si-Ping","Synthesis and characterization of three pyrazolate inner diazonium salts: green, powerful and stable primary explosives","New J. Chem.","2017","","","","","10.1039/C7NJ00876G","","","0.71073","MoKα","","0.0463","0.0368","","","0.0949","0.1018","","","","","","1.001","","","","has coordinates","198714","2020-10-21","18:00:00",""
"7056437","5.5357","0.0004","9.1337","0.0007","11.5261","0.0008","90","","91.852","0.006","90","","582.47","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","NCDAP","3-nitro-5-carbonyl-4-diazopyrazolate zwitterion","","- C3 H N5 O3 -","- C3 H N5 O3 -","- C12 H4 N20 O12 -","4","1","","Du, Yao; Zhang, Ji-Chuan; peng, Panpan; Su, Hui; Li, Sheng-Hua; Pang, Si-Ping","Synthesis and characterization of three pyrazolate inner diazonium salts: green, powerful and stable primary explosives","New J. Chem.","2017","","","","","10.1039/C7NJ00876G","","x-ray","0.71073","MoKα","","0.0749","0.0456","","","0.0985","0.1135","","","","","","1.085","","","","has coordinates","198714","2020-10-21","18:00:00",""
"7056438","20.047","0.004","11.357","0.002","18.677","0.004","90","","118.51","0.03","90","","3736.6","1.7","170","2","170","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C15 H26 La2 O22 P3 S3 -","- C15 H15 La2 O22 P3 S3 -","- C60 H60 La8 O88 P12 S12 -","4","0.5","","Beyer, Ole; Homburg, Thomas; Albat, Martin; Stock, Norbert; Luening, Ulrich","Synthesis of phosphonosulfonic acid building blocks as linkers for coordination polymers","New J. Chem.","2017","","","","","10.1039/C7NJ01697B","","","0.71073","MoKα","","0.0724","0.0667","","","0.1654","0.1685","","","","","","1.004","","","","has coordinates,has disorder","198715","2020-10-21","18:00:00",""
"7056439","10.498","0.002","11.412","0.003","17.061","0.003","90","","114.079","0.01","90","","1866.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(E)-2-cyano-3-phenylacrylamide","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C80 H64 N16 O8 -","8","2","","Narendar Reddy, Thatikonda; raktani, bikshapathi; Perla, Ramesh; Ravinder, Mettu; Vaidya, Jayathirtha Rao; Nanubolu, Jagadeesh Babu","An efficient catalyst-free one-pot synthesis of primary amides from aldehydes of Baylis-Hillman Reaction","New J. Chem.","2017","","","","","10.1039/C7NJ01965C","","","0.71073","MoKα","","0.1121","0.0692","","","0.1715","0.2091","","","","","","1.099","","","","has coordinates","198751","2020-10-21","18:00:00",""
"7056440","10.0312","0.0007","15.7314","0.0008","11.0525","0.0005","90","","96.436","0.005","90","","1733.15","0.17","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H17 Cl N10 O -","- C14 H17 Cl N10 O -","- C56 H68 Cl4 N40 O4 -","4","1","","Safin, Damir A.; Babashkina, Maria G.; Robeyns, Koen; Garcia, Yann","Organic matrix-induced formation of a discrete cyclic [Cl2(H2O)2]2− cluster","New J. Chem.","2017","","","","","10.1039/C7NJ00700K","","","0.71073","MoKα","","0.1028","0.0538","","","0.1166","0.1462","","","","","","1.059","","","","has coordinates","198777","2020-10-21","18:00:00",""
"7056441","10.9906","0.0005","12.1122","0.0005","13.7302","0.0009","90","","91.889","0.007","90","","1826.78","0.16","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 Cd2 Cl2 N10 O6 -","- C28 H40 Cd2 Cl2 N10 O6 -","- C56 H80 Cd4 Cl4 N20 O12 -","2","0.5","","Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann","Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01714F","","","0.71075","MoKα","","0.0698","0.0345","","","0.0692","0.0919","","","","","","1.168","","","","has coordinates","198778","2020-10-21","18:00:00",""
"7056442","15.1068","0.0006","9.9563","0.0005","17.5608","0.0012","90","","90","","90","","2641.3","0.2","293","","293","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C20 H32 Co N6 O7 -","- C20 H34 Co N6 O9 -","- C80 H136 Co4 N24 O36 -","4","0.5","","Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann","Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01714F","","","0.71075","MoKα","","0.17","0.0791","","","0.2068","0.2958","","","","","","1.118","","","","has coordinates","198778","2020-10-21","18:00:00",""
"7056443","8.9476","","9.2599","0.0001","10.2507","0.0002","88.279","0.005","74.957","0.005","72.294","0.004","780.25","0.03","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H18 Cu N4 O7 -","- C12 H18 Cu N4 O7 -","- C24 H36 Cu2 N8 O14 -","2","1","","Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann","Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01714F","","","0.71075","MoKα","","0.0441","0.0422","","","0.1148","0.1189","","","","","","1.103","","","","has coordinates","198778","2020-10-21","18:00:00",""
"7056444","8.7238","0.0009","8.907","0.0008","9.5349","0.0009","92.976","0.007","106.274","0.008","111.903","0.008","649.61","0.12","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H34 Co N6 O10 -","- C20 H34 Co N6 O10 -","- C20 H34 Co N6 O10 -","1","0.5","","Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann","Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01714F","","","0.71075","MoKα","","0.1437","0.0806","","","0.1787","0.2505","","","","","","1.094","","","","has coordinates","198778","2020-10-21","18:00:00",""
"7056445","17.7066","0.0005","11.8913","0.0003","19.4436","0.0013","90","","111.498","0.008","90","","3809.1","0.4","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 Cu2 N12 O14 -","- C28 H44 Cu2 N12 O14 -","- C112 H176 Cu8 N48 O56 -","4","1","","Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann","Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01714F","","","0.71075","MoKα","","0.0959","0.0468","","","0.1268","0.1768","","","","","","1.113","","","","has coordinates","198778","2020-10-21","18:00:00",""
"7056446","9.562","0.0019","6.653","0.0013","17.748","0.004","90","","93.05","0.03","90","","1127.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 Cl I N4 -","- C9 H8 Cl I N4 -","- C36 H32 Cl4 I4 N16 -","4","1","","Wang, Jin-Wen; Chen, Chen; Li, Yao-Jia; Luo, Yang-Hui; Sun, Baiwang","Halogen-bonding contacts determining the crystal structure and fluorescence properties of organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ02034A","","","0.71073","MoKα","","0.0588","0.0429","","","0.1028","0.1101","","","","","","1.008","","","","has coordinates","198879","2020-10-21","18:00:00",""
"7056447","4.281","0.0009","11.572","0.002","19.146","0.004","90","","93.49","0.03","90","","946.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Br N4 -","- C9 H7 Br N4 -","- C36 H28 Br4 N16 -","4","1","","Wang, Jin-Wen; Chen, Chen; Li, Yao-Jia; Luo, Yang-Hui; Sun, Baiwang","Halogen-bonding contacts determining the crystal structure and fluorescence properties of organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ02034A","","","0.71073","MoKα","","0.1221","0.0546","","","0.0903","0.1055","","","","","","1.006","","","","has coordinates","198879","2020-10-21","18:00:00",""
"7056448","4.472","0.0009","11.701","0.002","19.032","0.004","90","","95.38","0.03","90","","991.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 I N4 -","- C9 H7 I N4 -","- C36 H28 I4 N16 -","4","1","","Wang, Jin-Wen; Chen, Chen; Li, Yao-Jia; Luo, Yang-Hui; Sun, Baiwang","Halogen-bonding contacts determining the crystal structure and fluorescence properties of organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ02034A","","","0.71073","MoKα","","0.0797","0.0435","","","0.0935","0.1052","","","","","","1.002","","","","has coordinates","198879","2020-10-21","18:00:00",""
"7056449","8","0.0016","9.886","0.002","14.32","0.003","95.05","0.03","97.8","0.03","105.59","0.03","1071.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H15 Br2 Cl N8 O4 -","- C18 H15 Br2 Cl N8 O4 -","- C36 H30 Br4 Cl2 N16 O8 -","2","1","","Wang, Jin-Wen; Chen, Chen; Li, Yao-Jia; Luo, Yang-Hui; Sun, Baiwang","Halogen-bonding contacts determining the crystal structure and fluorescence properties of organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ02034A","","","0.71073","MoKα","","0.1625","0.0896","","","0.217","0.2495","","","","","","1.087","","","","has coordinates","198879","2020-10-21","18:00:00",""
"7056450","7.6676","0.0002","10.8399","0.0004","57.6299","0.0016","90","","90","","90","","4790","0.3","290","2","290","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H33 Fe N O3 S -","- C25 H33 Fe N O3 S -","- C200 H264 Fe8 N8 O24 S8 -","8","2","","Kamenova-Nacheva, Mariana; Schröder, Maria; Pasheva, Evdokia; Slavchev, Ivaylo; Dimitrov, Vladimir; Momekov, Georgi; Petrova, Rosica; Shivachev, Boris Lubomirov; Ugrinova, Iva; Dobrikov, Georgi","Synthesis of ferrocenylmethylidene and arylidene substituted camphane based compounds as potential anticancer agents","New J. Chem.","2017","","","","","10.1039/C7NJ00619E","","x-ray","0.71073","MoKα","","0.0829","0.0603","","","0.137","0.1523","","","","","","1.062","","","","has coordinates,has disorder","198880","2020-10-21","18:00:00",""
"7056451","8.8258","0.0002","6.0141","0.0002","30.3167","0.0008","90","","96.386","0.001","90","","1599.2","0.08","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C40 H44 N4 -","- C40 H44 N4 -","- C80 H88 N8 -","2","0.5","","Madhu, Suresh; Rashmi, E.; Gonnade, Rajesh G.; Sanjayan, G. J.","Exploring Gem-Dimethyl Effect in the Formation of Imine-Based Macrocycles and Cages","New J. Chem.","2017","","","","","10.1039/C7NJ02069D","","","0.71073","MoKα","","0.0562","0.0505","","","0.1179","0.1214","","","","","","1.112","","","","has coordinates","198882","2020-10-21","18:00:00",""
"7056452","24.2039","0.0009","14.9856","0.0006","19.4818","0.0008","90","","98.214","0.001","90","","6993.8","0.5","100","2","100","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C80 H80 Cl6 N8 -","- C80 H80 Cl6 N8 -","- C320 H320 Cl24 N32 -","4","1","","Madhu, Suresh; Rashmi, E.; Gonnade, Rajesh G.; Sanjayan, G. J.","Exploring Gem-Dimethyl Effect in the Formation of Imine-Based Macrocycles and Cages","New J. Chem.","2017","","","","","10.1039/C7NJ02069D","","","1.54178","CuKα","","0.1031","0.0592","","","0.1402","0.1615","","","","","","1.027","","","","has coordinates","198882","2020-10-21","18:00:00",""
"7056453","16.151","0.0004","17.5803","0.0005","8.6794","0.0002","90","","96.025","0.002","90","","2450.81","0.11","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C64 H60 N4 -","- C64 H60 N4 -","- C128 H120 N8 -","2","0.5","","Madhu, Suresh; Rashmi, E.; Gonnade, Rajesh G.; Sanjayan, G. J.","Exploring Gem-Dimethyl Effect in the Formation of Imine-Based Macrocycles and Cages","New J. Chem.","2017","","","","","10.1039/C7NJ02069D","","","0.71073","MoKα","","0.1032","0.0622","","","0.1133","0.1291","","","","","","1.076","","","","has coordinates","198882","2020-10-21","18:00:00",""
"7056454","9.966","0.0005","20.4442","0.0012","21.3571","0.0012","109.652","0.003","100.622","0.003","98.052","0.003","3930.6","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C90 H84 N6 -","- C90 H84 N6 -","- C180 H168 N12 -","2","1","","Madhu, Suresh; Rashmi, E.; Gonnade, Rajesh G.; Sanjayan, G. J.","Exploring Gem-Dimethyl Effect in the Formation of Imine-Based Macrocycles and Cages","New J. Chem.","2017","","","","","10.1039/C7NJ02069D","","","1.54178","CuKα","","0.111","0.0739","","","0.1935","0.2142","","","","","","1.016","","","","has coordinates","198882","2020-10-21","18:00:00",""
"7056455","16.593","0.002","17.657","0.002","17.872","0.003","102.17","0.005","92.478","0.007","98.25","0.004","5050.9","1.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C57 H64.5 N7.5 -","- C56 H63 N7 -","- C224 H252 N28 -","4","2","","Madhu, Suresh; Rashmi, E.; Gonnade, Rajesh G.; Sanjayan, G. J.","Exploring Gem-Dimethyl Effect in the Formation of Imine-Based Macrocycles and Cages","New J. Chem.","2017","","","","","10.1039/C7NJ02069D","","","0.71073","MoKα","","0.0519","0.0451","","","0.143","0.1484","","","","","","1.079","","","","has coordinates","202518","2020-10-21","18:00:00",""
"7056456","13.178","0.007","9.598","0.005","28.58","0.016","90","","90","","90","","3615","3","","","296.15","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C23 H15 F2 N3 O2 -","- C23 H15 F2 N3 O2 -","- C184 H120 F16 N24 O16 -","8","1","","Bharadwaj, S. Shashidhar; Poojary, Boja; Madan Kumar, S.; Byrappa, K.; Nagananda, Govinahalli Shivashankara; Chaitanya, Amajala Krishna; Zaveri, Kunal; Yarla, Nagendra Sastry; Shiralgi, Yallappa; Kudva, Avinash K.; Dhananjaya, B. L.","Design, synthesis and pharmacological studies of some new quinoline Schiff bases and 2,5-(disubstituted-[1,3,4])-oxadiazoles","New J. Chem.","2017","","","","","10.1039/C6NJ03913H","","","0.71075","MoKα","","0.1263","0.0844","","","0.1225","0.1441","","","","","","1.143","","","","has coordinates","198911","2020-10-21","18:00:00",""
"7056457","7.592","0.002","6.3812","0.0018","23.954","0.007","90","","95.07","0.004","90","","1155.9","0.6","296","2","296.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 Cu F N3 O3 -","- C9 H10 Cu F N3 O3 -","- C36 H40 Cu4 F4 N12 O12 -","4","1","","Ma, Xiaohui; Wu, Yuewei; Cen, Peipei; Ma, Shenru; Zhang, Chengcheng; Luo, Shuchang; Zhou, Huiliang; Song, Weiming; Liu, Xiangyu","Ferromagnetic ordering and slow magnetic relaxation observed in a triple-bridged azido-Cu(II) chain compound with mixed carboxylate/ethanol linkers","New J. Chem.","2017","","","","","10.1039/C7NJ01685A","","","0.71073","MoKα","","0.0625","0.0357","","","0.0779","0.0873","","","","","","1.032","","","","has coordinates,has disorder","199034","2020-10-21","18:00:00",""
"7056458","26.628","0.006","12.917","0.003","26.346","0.006","90","","90","","90","","9062","4","293","2","293","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C36 H5.75 I22 N12 O3 Pb5 -","- C36 H60 I22 N12 O3 Pb5 -","- C144 H240 I88 N48 O12 Pb20 -","4","0.5","","Yu, Hui; Wei, Zhenhong; Hao, Yanhuan; Liang, Zhiwen; Fu, Zhengjiang; Cai, Hu","Reversible solid-state thermochromism of a 2D organic-inorganic hybrid perovskite structure based on iodoplumbate and 2-aminomethyl-pyridine","New J. Chem.","2017","","","","","10.1039/C7NJ02229H","","","0.71073","MoKα","","0.0593","0.0446","","","0.1257","0.147","","","","","","1.058","","","","has coordinates","199337","2020-10-21","18:00:00",""
"7056459","10.5797","0.0014","11.7633","0.0015","30.267","0.004","90","","90","","90","","3766.8","0.9","160","2","160","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C24 H56 N7 O15 Tb -","- C24 H56 N7 O15 Tb -","- C96 H224 N28 O60 Tb4 -","4","0.5","","Zhang, Shi-Yong; Liao, Jin-Sheng; Xu, Wei-Jian; Liang, Fu-Yong; Peng, Guang-Huai; Liu, Sui-Jun; Wen, He-Rui; Du, Zi-Yi","Structural phase transitions, dielectric bistability and luminescence of two bulky ion-pair crystals [N(C3H7)4]2[Ln(NO3)5] (Ln = Tb, Dy)","New J. Chem.","2017","","","","","10.1039/C7NJ01597F","","","0.71073","MoKα","","0.0627","0.0581","","","0.1115","0.1129","","","","","","1.361","","","","has coordinates","199338","2020-10-21","18:00:00",""
"7056460","10.5239","0.0008","11.7488","0.0009","30.109","0.002","90","","90","","90","","3722.8","0.5","100","2","100","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C24 H56 Dy N7 O15 -","- C24 H56 Dy N7 O15 -","- C96 H224 Dy4 N28 O60 -","4","0.5","","Zhang, Shi-Yong; Liao, Jin-Sheng; Xu, Wei-Jian; Liang, Fu-Yong; Peng, Guang-Huai; Liu, Sui-Jun; Wen, He-Rui; Du, Zi-Yi","Structural phase transitions, dielectric bistability and luminescence of two bulky ion-pair crystals [N(C3H7)4]2[Ln(NO3)5] (Ln = Tb, Dy)","New J. Chem.","2017","","","","","10.1039/C7NJ01597F","","","0.71073","MoKα","","0.0509","0.0451","","","0.0831","0.0849","","","","","","1.256","","","","has coordinates","199338","2020-10-21","18:00:00",""
"7056461","10.415","0.0007","15.5947","0.0012","11.9725","0.001","90","","91.203","0.007","90","","1944.1","0.3","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 Cl Cu N5 S2 -","- C16 H12 Cl Cu N5 S2 -","- C64 H48 Cl4 Cu4 N20 S8 -","4","1","","Naveen, P.; Jain, Ruchi; Kalaivani, P.; Shankar, R.; Dallemer, F.; Prabhakaran, R.","Unpredicted formation of copper(ii) complexes containing 2-thiophen-2-yl-1-thiophen-2-ylmethyl-1H-benzoimidazole and their most promising in vitro cytotoxicity in MCF-7 and HeLa cell lines over cisplatin","New J. Chem.","2017","","","","","10.1039/C7NJ01273J","","x-ray","1.54184","CuKα","","0.1467","0.1049","","","0.3133","0.3486","","","","","","1.191","","","","has coordinates","199365","2020-10-21","18:00:00",""
"7056462","10.6994","0.0003","16.2816","0.0003","9.3721","0.0003","90","","108.915","0.003","90","","1544.49","0.08","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 Cl Cu0.5 N2 S2 -","- C16 H12 Cl Cu0.5 N2 S2 -","- C64 H48 Cl4 Cu2 N8 S8 -","4","1","","Naveen, P.; Jain, Ruchi; Kalaivani, P.; Shankar, R.; Dallemer, F.; Prabhakaran, R.","Unpredicted formation of copper(ii) complexes containing 2-thiophen-2-yl-1-thiophen-2-ylmethyl-1H-benzoimidazole and their most promising in vitro cytotoxicity in MCF-7 and HeLa cell lines over cisplatin","New J. Chem.","2017","","","","","10.1039/C7NJ01273J","","x-ray","1.54184","CuKα","","0.0497","0.0439","","","0.1242","0.1301","","","","","","1.057","","","","has coordinates,has disorder","199365","2020-10-21","18:00:00",""
"7056463","7.4948","0.0018","10.427","0.002","32.549","0.008","90","","90","","90","","2543.6","1","302","2","302","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H12 N3 O2.5 -","- C14 H12 N3 O2.5 -","- C112 H96 N24 O20 -","8","2","","Patil, Siddappa A.; Kandathil, Vishal; Fahlman, Bradley; S, Sasidhar B; Patil, Shivaputra","A Convenient, Efficient and Reusable N-Heterocyclic Carbene‒Palladium(II) Based Catalyst Supported on Magnetite for Suzuki‒Miyaura and Mizoroki‒Heck Cross-Coupling Reactions","New J. Chem.","2017","","","","","10.1039/C7NJ01876B","","","0.71073","MoKα","","0.0945","0.0541","","","0.1425","0.1605","","","","","","1.017","","","","has coordinates","202518","2020-10-21","18:00:00",""
"7056464","9.834","0.003","5.07","0.002","19.48","0.008","90","","96.32","0.03","90","","965.3","0.6","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 N2 O2 -","- C26 H24 N2 O2 -","- C52 H48 N4 O4 -","2","0.5","","Bikas, Rahman; Emami, Marzieh; Ślepokura, Katarzyna; Noshiranzadeh, Nader","Preparing Mn(III) salen-type Schiff base complexes using 1,3-oxazines obtained by Mannich condensation: Towards removing ortho-hydroxyaldehydes","New J. Chem.","2017","","","","","10.1039/C7NJ01562C","","","1.5418","CuKα","","0.1474","0.0727","","","0.1595","0.1756","","","","","","1.008","","","","has coordinates","199381","2020-10-21","18:00:00",""
"7056465","8.561","0.003","11.639","0.004","12.617","0.005","83.1","0.03","79.14","0.03","72.49","0.03","1174.7","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H26 F2 Mn N3 O7 -","- C22 H26 F2 Mn N3 O7 -","- C44 H52 F4 Mn2 N6 O14 -","2","1","","Bikas, Rahman; Emami, Marzieh; Ślepokura, Katarzyna; Noshiranzadeh, Nader","Preparing Mn(III) salen-type Schiff base complexes using 1,3-oxazines obtained by Mannich condensation: Towards removing ortho-hydroxyaldehydes","New J. Chem.","2017","","","","","10.1039/C7NJ01562C","","","0.71073","MoKα","","0.0547","0.041","","","0.0939","0.0994","","","","","","1.033","","","","has coordinates","199381","2020-10-21","18:00:00",""
"7056466","8.418","0.004","9.004","0.004","14.787","0.004","96.34","0.03","92.01","0.03","103.59","0.04","1080.6","0.8","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H28 Mn N3 O2 S -","- C25 H18 Mn N3 O2 S -","- C50 H36 Mn2 N6 O4 S2 -","2","1","","Bikas, Rahman; Emami, Marzieh; Ślepokura, Katarzyna; Noshiranzadeh, Nader","Preparing Mn(III) salen-type Schiff base complexes using 1,3-oxazines obtained by Mannich condensation: Towards removing ortho-hydroxyaldehydes","New J. Chem.","2017","","","","","10.1039/C7NJ01562C","","","0.71073","MoKα","","0.0912","0.0628","","","0.1481","0.1567","","","","","","1.007","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7056467","8.716","0.003","9.048","0.003","35.845","0.009","90","","95.1","0.03","90","","2815.6","1.5","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H32 Mn N3 O7 -","- C30 H32 Mn N3 O7 -","- C120 H128 Mn4 N12 O28 -","4","1","","Bikas, Rahman; Emami, Marzieh; Ślepokura, Katarzyna; Noshiranzadeh, Nader","Preparing Mn(III) salen-type Schiff base complexes using 1,3-oxazines obtained by Mannich condensation: Towards removing ortho-hydroxyaldehydes","New J. Chem.","2017","","","","","10.1039/C7NJ01562C","","","0.71073","MoKα","","0.0673","0.0514","","","0.1404","0.1463","","","","","","1.096","","","","has coordinates,has disorder","199381","2020-10-21","18:00:00",""
"7056468","10.088","0.003","11.208","0.003","34.421","0.009","90","","90","","90","","3891.9","1.9","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H18 Mn N5 O2 -","- C24 H18 Mn N5 O2 -","- C192 H144 Mn8 N40 O16 -","8","1","","Bikas, Rahman; Emami, Marzieh; Ślepokura, Katarzyna; Noshiranzadeh, Nader","Preparing Mn(III) salen-type Schiff base complexes using 1,3-oxazines obtained by Mannich condensation: Towards removing ortho-hydroxyaldehydes","New J. Chem.","2017","","","","","10.1039/C7NJ01562C","","","0.71073","MoKα","","0.1076","0.0597","","","0.114","0.1319","","","","","","1.027","","","","has coordinates","199381","2020-10-21","18:00:00",""
"7056469","14.4223","0.0006","18.043","0.0005","16.9397","0.0006","90","","113.726","0.005","90","","4035.5","0.3","295","2","295","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C89 H73 Cl2 N2 O9 P4 Ru2 S2 -","- C89 H73 Cl2 N2 O9 P4 Ru2 S2 -","- C178 H146 Cl4 N4 O18 P8 Ru4 S4 -","2","0.5","","Kumar, Ramasamy Raj; Ramesh, Rengan; Małecki, Jan Grzegorz","Versatile coordination ability of thioamide ligand in Ru(ii) complexes: synthesis, computational studies, in vitro anticancer activity and apoptosis induction","New J. Chem.","2017","","","","","10.1039/C7NJ01828B","","x-ray","0.71073","MoKα","","0.0639","0.0388","","","0.0772","0.0903","","","","","","1.056","","","","has coordinates","199395","2020-10-21","18:00:00",""
"7056470","10.8253","0.0006","10.6426","0.0006","10.4358","0.0006","90","","101.913","0.006","90","","1176.41","0.12","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H12 N2 O3 S -","- C11 H12 N2 O3 S -","- C44 H48 N8 O12 S4 -","4","1","","Kumar, Ramasamy Raj; Ramesh, Rengan; Małecki, Jan Grzegorz","Versatile coordination ability of thioamide ligand in Ru(ii) complexes: synthesis, computational studies, in vitro anticancer activity and apoptosis induction","New J. Chem.","2017","","","","","10.1039/C7NJ01828B","","x-ray","0.71073","MoKα","","0.0951","0.0577","","","0.1229","0.1419","","","","","","1.015","","","","has coordinates","199395","2020-10-21","18:00:00",""
"7056471","14.918","0.0006","15.6202","0.0006","18.34","0.0009","90","","92.113","0.004","90","","4270.7","0.3","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H42 N2 O4 P2 Ru S -","- C48 H42 N2 O4 P2 Ru S -","- C192 H168 N8 O16 P8 Ru4 S4 -","4","1","","Kumar, Ramasamy Raj; Ramesh, Rengan; Małecki, Jan Grzegorz","Versatile coordination ability of thioamide ligand in Ru(ii) complexes: synthesis, computational studies, in vitro anticancer activity and apoptosis induction","New J. Chem.","2017","","","","","10.1039/C7NJ01828B","","x-ray","0.71073","MoKα","","0.0684","0.0421","","","0.0834","0.0942","","","","","","1.026","","","","has coordinates","199395","2020-10-21","18:00:00",""
"7056472","8.3313","0.0009","12.5035","0.0013","19.8612","0.0018","90","","93.365","0.009","90","","2065.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H15 F3 N4 -","- C26 H15 F3 N4 -","- C104 H60 F12 N16 -","4","1","","Boddula, Rajamouli; Devi, Rachna; Mohanty, Abhijeet; Krishnan, Venkata; Vaidyanathan, Sivakumar","Effects of electron withdrawing groups in imidazole-phenanthroline ligands and their influence on photophysical properties of EuIII complexes for white light emitting diodes","New J. Chem.","2017","","","","","10.1039/C7NJ02291C","","x-ray","0.71073","MoKα","","0.0937","0.0738","","","0.2022","0.2224","","","","","","1.063","","","","has coordinates","199396","2020-10-21","18:00:00",""
"7056473","8.8714","0.0008","10.1323","0.001","11.8936","0.0011","100.266","0.008","110.428","0.008","102.53","0.008","939.56","0.18","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C25 H16 N4 -","- C25 H16 N4 -","- C50 H32 N8 -","2","1","","Boddula, Rajamouli; Devi, Rachna; Mohanty, Abhijeet; Krishnan, Venkata; Vaidyanathan, Sivakumar","Effects of electron withdrawing groups in imidazole-phenanthroline ligands and their influence on photophysical properties of EuIII complexes for white light emitting diodes","New J. Chem.","2017","","","","","10.1039/C7NJ02291C","","x-ray","0.71073","MoKα","","0.0879","0.0617","","","0.1559","0.1776","","","","","","1.09","","","","has coordinates","199396","2020-10-21","18:00:00",""
"7056474","9.913","0.0008","10.2709","0.0009","10.8021","0.0009","78.383","0.001","71.218","0.002","67.638","0.001","959.04","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H17 N O S -","- C25 H17 N O S -","- C50 H34 N2 O2 S2 -","2","1","","Niu , Yahui; Wang, Qin; Wu, Haoran; wang, Yuxiu; Zhang, Yanrong","Experimental and DFT studies of disubstituted 2-(2-hydroxyphenyl)benzothiazole-based fluorophores synthesized by Suzuki coupling","New J. Chem.","2017","","","","","10.1039/C7NJ01525A","","","0.71073","MoKα","","0.066","0.0426","","","0.098","0.1064","","","","","","1.047","","","","has coordinates","199427","2020-10-21","18:00:00",""
"7056475","20.7516","0.0016","28.169","0.002","7.3729","0.0006","90","","90","","90","","4309.8","0.6","298","2","298","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C18 H21.75 Cl3 Fe N3 O2.5 -","- C18 H22.5 Cl3 Fe N3 O2.5 -","- C144 H180 Cl24 Fe8 N24 O20 -","8","1","","Gomes, Clicia; Lube, Leonardo Munaldi; Fernandes, Christiane; Franco, Roberto W. A.; Lamounier Camargos Resende, Jackson Antonio; Horn, Adolfo","A new system for cyclohexane functionalization employing iron(III) catalysts and trichloroisocianuric acid","New J. Chem.","2017","","","","","10.1039/C7NJ01164D","","x-ray","0.71073","MoKα","","0.1436","0.1213","","","0.2878","0.2983","","","","","","1.205","","","","has coordinates","199428","2020-10-21","18:00:00",""
"7056476","17.662","0.003","10.529","0.002","22.676","0.004","90","","109.361","0.004","90","","3978.4","1.2","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C86 H64 N6 P4 S6 W -","- C86 H64 N6 P4 S6 W -","- C172 H128 N12 P8 S12 W2 -","2","0.5","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.0478","0.0363","","","0.0789","0.0842","","","","","","1.018","","","","has coordinates","199429","2020-10-21","18:00:00",""
"7056477","30.794","0.003","12.8406","0.001","14.2129","0.0011","90","","103.423","0.003","90","","5466.4","0.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H44 N4 O2 P2 S4 W -","- C62 H44 N4 O2 P2 S4 W -","- C248 H176 N16 O8 P8 S16 W4 -","4","0.5","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.0485","0.032","","","0.0549","0.0607","","","","","","1.006","","","","has coordinates","199429","2020-10-21","18:00:00",""
"7056478","8.533","0.0002","11.5039","0.0003","18.6464","0.0005","107.952","0.001","93.871","0.001","103.428","0.001","1674.43","0.08","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H24 Mo N4 P2 S4 -","- C34 H24 Mo N4 P2 S4 -","- C68 H48 Mo2 N8 P4 S8 -","2","1","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.0332","0.0261","","","0.0569","0.0601","","","","","","0.998","","","","has coordinates","199429","2020-10-21","18:00:00",""
"7056479","8.6214","0.001","11.5287","0.0014","18.619","0.002","107.697","0.002","93.475","0.002","102.941","0.002","1701.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H24 N4 P2 S4 W -","- C34 H24 N4 P2 S4 W -","- C68 H48 N8 P4 S8 W2 -","2","1","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.0367","0.0331","","","0.0871","0.0891","","","","","","1.029","","","","has coordinates","199429","2020-10-21","18:00:00",""
"7056480","30.763","0.006","12.851","0.002","14.243","0.002","90","","103.561","0.007","90","","5473.8","1.6","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C62 H44 Mo N4 O2 P2 S4 -","- C62 H44 Mo N4 O2 P2 S4 -","- C248 H176 Mo4 N16 O8 P8 S16 -","4","0.5","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.0714","0.0438","","","0.1068","0.1218","","","","","","1.062","","","","has coordinates","199429","2020-10-21","18:00:00",""
"7056481","10.404","0.003","18.184","0.005","22.548","0.006","109.721","0.006","90.165","0.007","90.075","0.006","4015.5","1.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C86 H64 Mo N6 O P4 S5 -","- C86 H64 Mo N6 O P4 S5 -","- C172 H128 Mo2 N12 O2 P8 S10 -","2","1","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.1304","0.0687","","","0.1883","0.2344","","","","","","0.93","","","","has coordinates,has disorder","199429","2020-10-21","18:00:00",""
"7056482","17.743","0.003","10.571","0.002","22.759","0.004","90","","109.368","0.005","90","","4027.1","1.2","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C86 H64 Mo N6 P4 S6 -","- C86 H64 Mo N6 P4 S6 -","- C172 H128 Mo2 N12 P8 S12 -","2","0.5","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.0939","0.0611","","","0.1445","0.1576","","","","","","1.036","","","","has coordinates","199429","2020-10-21","18:00:00",""
"7056483","13.598","0.004","14.966","0.006","17.006","0.007","76.159","0.013","66.478","0.007","63.077","0.007","2822.1","1.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C62 H44 N4 O P2 S5 W -","- C62 H44 N4 O P2 S5 W -","- C124 H88 N8 O2 P4 S10 W2 -","2","1","","Khatua, Suman; Naskar, Tilak; Nandi, Chandan; Majumdar, Amit","Mononuclear Bis(dithiolene) Mo(IV) and W(IV) Complexes with P, P; S, S; O, S and O, O Donor Ligands: A Comparative Reactivity Study","New J. Chem.","2017","","","","","10.1039/C7NJ01797A","","x-ray","0.71073","MoKα","","0.208","0.0947","","","0.2125","0.2751","","","","","","1","","","","has coordinates,has disorder","199429","2020-10-21","18:00:00",""
"7056484","9.1372","0.0005","10.2407","0.0004","10.3976","0.0005","69.466","0.002","80.191","0.002","70.859","0.002","859.05","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","ethyl 6-methoxy-4-(phenylselanyl)quinoline-2-carboxylate","","- C19 H17 N O3 Se -","- C19 H17 N O3 Se -","- C38 H34 N2 O6 Se2 -","2","1","","Stefani, Helio A.; Oliveira, Isadora M.; Vaconcelos, Stanley N. S.; Barbeiro, Cristiane S.; Carita Correra, Thiago; Shamim, Anwar; Pimenta, Daniel C.; Caracelli, Ignez; Zukerman-Schpector, Julio; Manarin, Flavia G.","Ytterbium(III)-Catalyzed Three-Component Reactions: Synthesis of 4-Organoselenium-quinolines and Application in Copper-free Sonogashira Cross-coupling Reactions","New J. Chem.","2017","","","","","10.1039/C7NJ01803G","","","0.71073","MoKα","","0.0404","0.0324","","","0.0774","0.0812","","","","","","1.047","","","","has coordinates","199453","2020-10-21","18:00:00",""
"7056485","8.2169","0.0005","9.1554","0.0005","11.7431","0.0007","94.646","0.002","108.461","0.002","96.454","0.002","826.25","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 4-(3-hydroxy-3-methylbut-1-yn-1-yl)-6-methoxyquinoline-2-carboxylate","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C36 H38 N2 O8 -","2","1","","Stefani, Helio A.; Oliveira, Isadora M.; Vaconcelos, Stanley N. S.; Barbeiro, Cristiane S.; Carita Correra, Thiago; Shamim, Anwar; Pimenta, Daniel C.; Caracelli, Ignez; Zukerman-Schpector, Julio; Manarin, Flavia G.","Ytterbium(III)-Catalyzed Three-Component Reactions: Synthesis of 4-Organoselenium-quinolines and Application in Copper-free Sonogashira Cross-coupling Reactions","New J. Chem.","2017","","","","","10.1039/C7NJ01803G","","","0.71073","MoKα","","0.0478","0.0432","","","0.1213","0.1261","","","","","","1.079","","","","has coordinates","199453","2020-10-21","18:00:00",""
"7056486","8.3219","0.0006","11.248","0.0009","18.4098","0.0014","90","","98.7126","0.0011","90","","1703.4","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","r4","","- C17 H19 N3 O3 Pd S -","- C17 H19 N3 O3 Pd S -","- C68 H76 N12 O12 Pd4 S4 -","4","1","","karami, kazem; Hosseini-Kharat, Mahboubeh; Saeidifar, Maryam; Rizzoli, Corrado; Zahedi-Nasab, Reza; Sohrabijam, Zahra; Sharifi, Tayebeh","Novel Pd(II) CNO pincer complex of MR (methyl red): synthesis, crystal structure, interaction with human serum albumin (HSA) in vitro and molecular docking","New J. Chem.","2017","","","","","10.1039/C7NJ01415E","","","0.71073","MoKα","","0.0307","0.0275","","","0.0766","0.0794","","","","","","1.067","","","","has coordinates","288505","2023-12-22","15:12:03",""
"7056487","11.242","0.003","21.784","0.006","19.117","0.004","90","","92.349","0.006","90","","4678","2","113","2","113","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H44 Cl2 F9 Gd N6 O10 -","- C38 H42 F9 Gd N6 O10 -","- C152 H168 F36 Gd4 N24 O40 -","4","1","","Li, Hongdao; Sun, Juan; Yang, Meng; Sun, Zan; Xie, Jing; Ma, Yue; Li, Licun","Functionalized nitronyl nitroxide biradical bridged one-dimensional lanthanide chains: slow magnetic relaxation in the Tb and Dy analogues","New J. Chem.","2017","","","","","10.1039/C7NJ02006F","","","0.71073","MoKα","","0.0454","0.0412","","","0.1171","0.1203","","","","","","1.053","","","","has coordinates,has disorder","199491","2020-10-21","18:00:00",""
"7056488","11.256","0.003","21.853","0.004","19.166","0.004","90","","91.882","0.005","90","","4711.9","1.8","113","2","113","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H44 Cl2 F9 N6 Nd O10 -","- C38 H42 F9 N6 Nd O10 -","- C152 H168 F36 N24 Nd4 O40 -","4","1","","Li, Hongdao; Sun, Juan; Yang, Meng; Sun, Zan; Xie, Jing; Ma, Yue; Li, Licun","Functionalized nitronyl nitroxide biradical bridged one-dimensional lanthanide chains: slow magnetic relaxation in the Tb and Dy analogues","New J. Chem.","2017","","","","","10.1039/C7NJ02006F","","","0.71073","MoKα","","0.0641","0.0484","","","0.1406","0.1552","","","","","","1.011","","","","has coordinates,has disorder","199491","2020-10-21","18:00:00",""
"7056489","11.3722","0.0001","21.8154","0.0002","19.077","0.0002","90","","92.333","0.001","90","","4728.87","0.08","113","2","113","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H44 Cl2 Dy F9 N6 O10 -","- C38 H41.5 Dy F9 N6 O10 -","- C152 H166 Dy4 F36 N24 O40 -","4","1","","Li, Hongdao; Sun, Juan; Yang, Meng; Sun, Zan; Xie, Jing; Ma, Yue; Li, Licun","Functionalized nitronyl nitroxide biradical bridged one-dimensional lanthanide chains: slow magnetic relaxation in the Tb and Dy analogues","New J. Chem.","2017","","","","","10.1039/C7NJ02006F","","","1.54178","CuKα","","0.0551","0.0513","","","0.1509","0.1538","","","","","","1.038","","","","has coordinates,has disorder","199491","2020-10-21","18:00:00",""
"7056490","11.3578","0.0003","21.8234","0.0004","19.0928","0.0003","90","","92.349","0.002","90","","4728.48","0.17","113","2","113","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C39 H44 Cl2 F9 N6 O10 Tb -","- C38 H42 F9 N6 O10 Tb -","- C152 H168 F36 N24 O40 Tb4 -","4","1","","Li, Hongdao; Sun, Juan; Yang, Meng; Sun, Zan; Xie, Jing; Ma, Yue; Li, Licun","Functionalized nitronyl nitroxide biradical bridged one-dimensional lanthanide chains: slow magnetic relaxation in the Tb and Dy analogues","New J. Chem.","2017","","","","","10.1039/C7NJ02006F","","","1.54178","CuKα","","0.0881","0.0679","","","0.1786","0.1946","","","","","","1.001","","","","has coordinates,has disorder","199491","2020-10-21","18:00:00",""
"7056491","13.2741","0.0003","14.1583","0.0003","15.4049","0.0004","116.5","0.002","92.908","0.002","114.528","0.002","2256.01","0.12","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H47 N9 O8 Pd3 S3 -","- C36.9999 H46.9997 N9 O8 Pd3 S3 -","- C73.9998 H93.9994 N18 O16 Pd6 S6 -","2","1","","Arumugam, Shanmugapriya; Jain, Ruchi; Devaraj, Sabarinathan; Giriraj, Kalaiarasi; Dallemer, Frederic; Prabhakaran, Rathinasabapathi","Structurally different mono, bi and trinuclear Pd(II) complexes and their DNA/Protein interaction, DNA cleavage, anti-oxidant, anti-microbial and cytotoxicity studies","New J. Chem.","2017","","","","","10.1039/C7NJ01556A","","x-ray","0.71073","MoKα","","0.0667","0.043","","","0.0893","0.1019","","","","","","1.052","","","","has coordinates,has disorder","204135","2020-10-21","18:00:00",""
"7056492","10.5318","0.0003","11.2368","0.0004","11.4307","0.0003","93.946","0.002","98.609","0.002","107.392","0.003","1267.08","0.07","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H21 N3 O2 P Pd S -","- C25 H21 N3 O2 P Pd S -","- C50 H42 N6 O4 P2 Pd2 S2 -","2","1","","Arumugam, Shanmugapriya; Jain, Ruchi; Devaraj, Sabarinathan; Giriraj, Kalaiarasi; Dallemer, Frederic; Prabhakaran, Rathinasabapathi","Structurally different mono, bi and trinuclear Pd(II) complexes and their DNA/Protein interaction, DNA cleavage, anti-oxidant, anti-microbial and cytotoxicity studies","New J. Chem.","2017","","","","","10.1039/C7NJ01556A","","x-ray","0.71073","MoKα","","0.0525","0.0391","","","0.0942","0.1018","","","","","","1.042","","","","has coordinates,has disorder","204135","2020-10-21","18:00:00",""
"7056493","10.5084","0.0002","17.0591","0.0004","16.5361","0.0003","90","","96.126","0.002","90","","2947.4","0.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H26 N6 O4 Pd S2 -","- C30 H26 N6 O4 Pd S2 -","- C120 H104 N24 O16 Pd4 S8 -","4","1","","Arumugam, Shanmugapriya; Jain, Ruchi; Devaraj, Sabarinathan; Giriraj, Kalaiarasi; Dallemer, Frederic; Prabhakaran, Rathinasabapathi","Structurally different mono, bi and trinuclear Pd(II) complexes and their DNA/Protein interaction, DNA cleavage, anti-oxidant, anti-microbial and cytotoxicity studies","New J. Chem.","2017","","","","","10.1039/C7NJ01556A","","x-ray","0.71073","MoKα","","0.0542","0.0351","","","0.0715","0.0797","","","","","","1.047","","","","has coordinates","204135","2020-10-21","18:00:00",""
"7056494","7.977","0.0012","27.642","0.004","9.1543","0.0013","90","","107.212","0.003","90","","1928.1","0.5","255","","255","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H21 N3 O3 -","- C25 H21 N3 O3 -","- C100 H84 N12 O12 -","4","1","","Wani, Manzoor Ahmad; Thakur, Neha; Pandey, Mrituanjay D.; Pandey, Rampal","A reusable multichannel anthraimidazoledione based receptor for Hg2+ and Cu2+ ions: Ultrasensitive, economical and facile detection of Hg2+ in real water sources through fluorescence readout","New J. Chem.","2017","","","","","10.1039/C7NJ02097J","","","0.71073","","","0.067393","0.056083","","","","0.178031","","","","","","1.20264","","","","has coordinates","199507","2020-10-21","18:00:00",""
"7056495","10.5031","0.0008","18.0711","0.0013","18.3906","0.0013","66.8","0.003","73.533","0.004","85.947","0.004","3073.4","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H58 Er2 N6 O8 -","- C84 H54 Er2 N6 O8 -","- C168 H108 Er4 N12 O16 -","2","1","","Gholizadeh Dogaheh, Samira; Khanmohammadi, Hamid; Sañudo, E. Carolina","Double decker luminescent Ytterbium and Erbium SMMs with symmetric and asymmetric Schiff base ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01842H","","","0.71073","MoKα","","0.0467","0.0329","","","0.0769","0.0835","","","","","","1.039","","","","has coordinates","199508","2020-10-21","18:00:00",""
"7056496","10.4575","0.0004","18.0686","0.0006","18.4181","0.0006","66.674","0.002","73.605","0.002","85.41","0.002","3063.77","0.19","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H58 N6 O8 Yb2 -","- C84 H54 N6 O8 Yb2 -","- C168 H108 N12 O16 Yb4 -","2","1","","Gholizadeh Dogaheh, Samira; Khanmohammadi, Hamid; Sañudo, E. Carolina","Double decker luminescent Ytterbium and Erbium SMMs with symmetric and asymmetric Schiff base ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01842H","","","0.71073","MoKα","","0.0786","0.0451","","","0.0867","0.0984","","","","","","0.953","","","","has coordinates","199508","2020-10-21","18:00:00",""
"7056497","13.6388","0.0008","25.3478","0.0013","31.3489","0.0016","90","","101.535","0.003","90","","10618.8","1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C256 H191 N35 O28 Yb6 -","- C256 H191 N35 O28 Yb6 -","- C512 H382 N70 O56 Yb12 -","2","0.5","","Gholizadeh Dogaheh, Samira; Khanmohammadi, Hamid; Sañudo, E. Carolina","Double decker luminescent Ytterbium and Erbium SMMs with symmetric and asymmetric Schiff base ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01842H","","","1.5478","","","0.1182","0.0614","","","0.1414","0.1673","","","","","","1.021","","","","has coordinates,has disorder","199508","2020-10-21","18:00:00",""
"7056498","13.5774","0.0017","25.425","0.003","30.838","0.004","90","","102.553","0.008","90","","10391","2","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C126 H91 Er3 N14 O16 -","- C126 H89 Er3 N14 O16 -","- C504 H356 Er12 N56 O64 -","4","1","","Gholizadeh Dogaheh, Samira; Khanmohammadi, Hamid; Sañudo, E. Carolina","Double decker luminescent Ytterbium and Erbium SMMs with symmetric and asymmetric Schiff base ligands","New J. Chem.","2017","","","","","10.1039/C7NJ01842H","","","0.71073","MoKα","","0.1453","0.0744","","","0.1723","0.213","","","","","","1.081","","","","has coordinates","199508","2020-10-21","18:00:00",""
"7056499","10.1601","0.0008","12.4693","0.0014","17.1951","0.0011","91.449","0.007","98.769","0.006","113.892","0.009","1959.3","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H68 Cu4 F8 N20 O12 -","- C80 H68 Cu4 F8 N20 O12 -","- C80 H68 Cu4 F8 N20 O12 -","1","0.5","","Parween, Arfa; Naskar, Sumita; Mota, Antonio J.; Espinosa, Arturo; Chattopadhyay, Shyamal Kumar; Riviere, Eric; Lewis, William; Naskar, Subhendu","Ci-symmetry, [2 ×2] grid, square copper complex with the N4,N5-bis(4-fluorophenyl)-1H-imidazole-4,5-dicarboxamide ligand: structure, catecholase activity, magnetic properties and DFT calculations","New J. Chem.","2017","","","","","10.1039/C7NJ01667K","","x-ray","1.54184","CuKα","","0.0433","0.0356","","","0.092","0.0972","","","","","","1.028","","","","has coordinates","199509","2020-10-21","18:00:00",""
"7056500","10.8289","0.0003","12.9518","0.0004","20.3412","0.0006","90","","90","","90","","2852.93","0.15","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-tert-Butyl 2-methyl 7-oxoazepane-1,2-dicarboxylate","","- C13 H21 N O5 -","- C13 H21 N O5 -","- C104 H168 N8 O40 -","8","1","","Weck, Christian; Obst, Franziska; Nauha, Elisa; Schofield, Christopher J.; Gruber, Tobias","Synthesis of a bicyclic oxo-γ-lactam from a simple caprolactam derivative","New J. Chem.","2017","","","","","10.1039/C7NJ02348K","","","1.54178","CuKα","","0.0395","0.0369","","","0.0956","0.0979","","","","","","1.046","","","","has coordinates","199550","2020-10-21","18:00:00",""
"7056501","6.1511","0.0006","6.3794","0.0007","17.526","0.0018","88.877","0.005","80.145","0.005","82.187","0.005","671.28","0.12","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","tert-Butyl 7,8-dioxo-6-azabicyclo[3.2.1]octane-6-carboxylate","","- C12 H19 N O5 -","- C12 H19 N O5 -","- C24 H38 N2 O10 -","2","1","","Weck, Christian; Obst, Franziska; Nauha, Elisa; Schofield, Christopher J.; Gruber, Tobias","Synthesis of a bicyclic oxo-γ-lactam from a simple caprolactam derivative","New J. Chem.","2017","","","","","10.1039/C7NJ02348K","","","1.54178","CuKα","","0.0738","0.0677","","","0.1764","0.1859","","","","","","1.061","","","","has coordinates","199550","2020-10-21","18:00:00",""
"7056502","23.4764","0.0007","23.4764","0.0007","12.156","0.0006","90","","90","","120","","5802.1","0.4","296","","296","","","","","","","","","8","P -3","-P 3","147","","","","- C36 H27 La8 N6 Nb9 O172 Si3 W27 -","- C36 H24 La8 N6 Nb9 O178 Si3 W27 -","- C36 H24 La8 N6 Nb9 O178 Si3 W27 -","1","0.166667","","Yang, Mei-Si; Chen, Wei-Chao; Qin, Chao; Yao, Wei; Yin, Ying-Xue; Su, Zhong-Min","An Unprecedented 3D Architecture Based on Nb/W Mixed-Addendum Polyoxometalate and Lanthanide-Organic Complex: Synthesis, Crystal Structure and Properties","New J. Chem.","2017","","","","","10.1039/C7NJ02011B","","x-ray","0.71073","MoKα","K-L~3~","0.0739","0.0615","","","0.1436","0.1497","","","","","","1.08","","","","has coordinates,has disorder","199551","2020-10-21","18:00:00",""
"7056503","14.094","0.005","15.243","0.005","22.026","0.005","80.802","0.005","87.439","0.005","70.886","0.005","4413","2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","3","3","","- C84 H100 Cu N28 O134 P4 W36 -","- C84 H66 Cu N28 O134 P4 W36 -","- C84 H66 Cu N28 O134 P4 W36 -","1","0.5","","Li, Shaobin; Zhang, Li; Chai, Dong Feng; Pang, Haijun; Ma, Huiyuan","Self-assembly of polyoxometalate-based hybrid aggregates: from monomer to dimer via changing pH value of reaction systems","New J. Chem.","2017","","","","","10.1039/C7NJ02475D","","","0.71069","MoKα","","0.0812","0.0579","","","0.1471","0.1639","","","","","","1.011","","","","has coordinates","199659","2020-10-21","18:00:00",""
"7056504","14.759","0.005","15.355","0.005","23.09","0.005","83.404","0.005","84.68","0.005","69.636","0.005","4865","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","1","1","","- C48 H56 Cu N16 O68 P2 W18 -","- C48 H40 Cu N16 O64 P2 W18 -","- C96 H80 Cu2 N32 O128 P4 W36 -","2","1","","Li, Shaobin; Zhang, Li; Chai, Dong Feng; Pang, Haijun; Ma, Huiyuan","Self-assembly of polyoxometalate-based hybrid aggregates: from monomer to dimer via changing pH value of reaction systems","New J. Chem.","2017","","","","","10.1039/C7NJ02475D","","","0.71069","MoKα","","0.0625","0.0434","","","0.1139","0.121","","","","","","0.97","","","","has coordinates","199659","2020-10-21","18:00:00",""
"7056505","14.902","0.005","22.953","0.005","28.479","0.005","90","0.005","99.402","0.005","90","0.005","9610","4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","2","2","","- C96 H114 Cu2 N32 O137 P4 W36 -","- C96 H80 Cu2 N32 O128 P4 W36 -","- C192 H160 Cu4 N64 O256 P8 W72 -","2","0.5","","Li, Shaobin; Zhang, Li; Chai, Dong Feng; Pang, Haijun; Ma, Huiyuan","Self-assembly of polyoxometalate-based hybrid aggregates: from monomer to dimer via changing pH value of reaction systems","New J. Chem.","2017","","","","","10.1039/C7NJ02475D","","","0.71069","MoKα","","0.0606","0.043","","","0.1119","0.1183","","","","","","1.058","","","","has coordinates","199659","2020-10-21","18:00:00",""
"7056506","9.789","0.005","11.682","0.005","17.495","0.005","100.545","0.005","101.652","0.005","106.138","0.005","1820.4","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C43 H30 Cl N7 O5 Ru -","- C43 H30 Cl N7 O5 Ru -","- C86 H60 Cl2 N14 O10 Ru2 -","2","1","","Patra, Shanti G.; Zangrando, Ennio; Datta, Dipankar","Effect of ancillary ligand proton on the photophysical properties of some RuIIN6 cores. A proton valve","New J. Chem.","2017","","","","","10.1039/C7NJ02274C","","","0.71073","MoKα","","0.0915","0.0493","","","0.1001","0.1181","","","","","","1.017","","","","has coordinates","199712","2020-10-21","18:00:00",""
"7056507","9.5224","0.0009","23.282","0.002","18.7461","0.0018","90","","102.086","0.004","90","","4063.9","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H33 Cl2 N7 O10 Ru -","- C39 H33 Cl2 N7 O10 Ru -","- C156 H132 Cl8 N28 O40 Ru4 -","4","1","","Patra, Shanti G.; Zangrando, Ennio; Datta, Dipankar","Effect of ancillary ligand proton on the photophysical properties of some RuIIN6 cores. A proton valve","New J. Chem.","2017","","","","","10.1039/C7NJ02274C","","","0.71073","MoKα","","0.0672","0.0485","","","0.1168","0.125","","","","","","1.042","","","","has coordinates","199712","2020-10-21","18:00:00",""
"7056508","17.0179","0.0004","17.0179","0.0004","12.9851","0.0004","90","","90","","90","","3760.6","0.17","298","2","298","2","","","","","","","","5","P 42/n","-P 4bc","86","","","","- C68 H104 Co3 N16 O12 -","- C68 H104 Co3 N16 O12 -","- C136 H208 Co6 N32 O24 -","2","","","Panja, Anangamohan; Jana, Narayan Ch.; Brandão, Paula","Influence of the first and second coordination spheres on the diverse phenoxazinone synthase activity of cobalt complexes derived from a tetradentate Schiff base ligand","New J. Chem.","2017","","","","","10.1039/C7NJ02015E","","","0.71073","MoKα","","0.0738","0.0391","","","0.0858","0.096","","","","","","1.048","","","","has coordinates","199713","2020-10-21","18:00:00",""
"7056509","18.977","0.003","11.8646","0.0017","21.938","0.003","90","","108.078","0.004","90","","4695.6","1.2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H54 Co2 N11 O4 S5 -","- C37 H54 Co2 N11 O4 S5 -","- C148 H216 Co8 N44 O16 S20 -","4","1","","Panja, Anangamohan; Jana, Narayan Ch.; Brandão, Paula","Influence of the first and second coordination spheres on the diverse phenoxazinone synthase activity of cobalt complexes derived from a tetradentate Schiff base ligand","New J. Chem.","2017","","","","","10.1039/C7NJ02015E","","","0.71073","MoKα","","0.0862","0.0549","","","0.1409","0.1767","","","","","","1.108","","","","has coordinates","199713","2020-10-21","18:00:00",""
"7056510","25.636","0.003","10.3538","0.0004","19.712","0.002","90","","126.446","0.016","90","","4208.8","1.1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H55 Co2 N19 O4 -","- C34 H55 Co2 N19 O4 -","- C136 H220 Co8 N76 O16 -","4","0.5","","Panja, Anangamohan; Jana, Narayan Ch.; Brandão, Paula","Influence of the first and second coordination spheres on the diverse phenoxazinone synthase activity of cobalt complexes derived from a tetradentate Schiff base ligand","New J. Chem.","2017","","","","","10.1039/C7NJ02015E","","","0.71073","MoKα","","0.0507","0.0407","","","0.0972","0.103","","","","","","1.039","","","","has coordinates","199713","2020-10-21","18:00:00",""
"7056511","7.9958","0.0004","10.1437","0.0005","13.4435","0.0007","85.118","0.002","83.482","0.002","89.535","0.002","1079.38","0.09","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H54 Co2 N10 O5 S4 -","- C36 H53 Co2 N10 O4.5 S4 -","- C36 H53 Co2 N10 O4.5 S4 -","1","0.5","","Panja, Anangamohan; Jana, Narayan Ch.; Brandão, Paula","Influence of the first and second coordination spheres on the diverse phenoxazinone synthase activity of cobalt complexes derived from a tetradentate Schiff base ligand","New J. Chem.","2017","","","","","10.1039/C7NJ02015E","","","0.71073","MoKα","","0.0313","0.0251","","","0.0631","0.0661","","","","","","1.033","","","","has coordinates","199713","2020-10-21","18:00:00",""
"7056512","9.7679","0.0002","13.1943","0.0005","15.3233","0.0006","67.616","0.004","73.07","0.003","70.037","0.003","1686.57","0.11","100","0.1","100","0.1","","","","","","","","8","P -1","-P 1","2","","","","- C69 H64 Cl2 F12 N4 O6 P4 Ru2 -","- C69 H64 Cl2 F12 N4 O6 P4 Ru2 -","- C69 H64 Cl2 F12 N4 O6 P4 Ru2 -","1","0.5","","Pandiyan, T.; Hernandez, Jose Hernandez; Huerta Aguilar, Carlos Alberto; Höpfl, Herbert","Ruthenium(III) complex derived from N,N´-bis(salicylidene)ethylenediamine as chemosensor for the selective recognition of acetate and its interaction with cells for bio-imaging: Experimental and theoretical studies","New J. Chem.","2017","","","","","10.1039/C7NJ01591G","","x-ray","0.71073","MoKα","","0.0768","0.0737","","","0.1785","0.1813","","","","","","1.194","","","","has coordinates,has disorder","199760","2020-10-21","18:00:00",""
"7056513","9.0434","0.0001","23.9537","0.0005","12.3526","0.0002","90","","102.996","0.0012","90","","2607.32","0.08","150","1","150","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 Cu F6 N5 O6 S2 -","- C18 H25 Cu F6 N5 O6 S2 -","- C72 H100 Cu4 F24 N20 O24 S8 -","4","1","","Pal, Sarit; Islam, Md Tariqul; Moore, James T.; Reyes, Jesus; Pardo, Andrew; Varela-Ramirez, Armando; Noveron, Juan","Self-assembly of a novel Cu (II) co-ordination complex forms metallo-vesicles that are able to transfect mammalian cells","New J. Chem.","2017","","","","","10.1039/C7NJ02161E","","","0.71073","MoKα","","0.0495","0.0368","","","0.0853","0.093","","","","","","1.032","","","","has coordinates","199791","2020-10-21","18:00:00",""
"7056514","12.1381","0.0005","12.9005","0.0005","15.6604","0.0006","104.149","0.002","90.794","0.002","107.642","0.002","2255.71","0.16","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C97 H94 Cl6 O16 Ru4 -","- C97 H94 Cl6 O16 Ru4 -","- C97 H94 Cl6 O16 Ru4 -","1","0.5","","Tsovaltzi, E.; Malamidou-Xenikaki, E.; Dalezis, P.; Hatzidimitriou, Antonios; Trafalis, D.; Lazarides, Theodore; Sarli, Vasiliki","Synthesis and Analysis of the Anticancer Activity of Ru(II) Complexes Incorporating 2-Hydroxymethylidene-indene-1,3-diones Ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02162C","","","0.71073","MoKα","","0.0969","0.0451","","0.0834","0.0786","0.0786","","","","","","0.9999","","","","has coordinates","199792","2020-10-21","18:00:00",""
"7056515","9.3961","0.001","14.3704","0.0015","18.598","0.002","99.204","0.005","91.117","0.005","94.615","0.005","2469.5","0.5","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H29 Cl O4 Ru -","- C26 H29 Cl O4 Ru -","- C104 H116 Cl4 O16 Ru4 -","4","2","","Tsovaltzi, E.; Malamidou-Xenikaki, E.; Dalezis, P.; Hatzidimitriou, Antonios; Trafalis, D.; Lazarides, Theodore; Sarli, Vasiliki","Synthesis and Analysis of the Anticancer Activity of Ru(II) Complexes Incorporating 2-Hydroxymethylidene-indene-1,3-diones Ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02162C","","","0.71073","MoKα","","0.0624","0.0386","","0.0988","0.0895","0.0895","","","","","","1.0001","","","","has coordinates,has disorder","199792","2020-10-21","18:00:00",""
"7056516","7.7108","0.0003","12.7742","0.0004","12.7925","0.0003","64.6825","0.0015","74.5158","0.0017","83.476","0.002","1097.68","0.06","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H25 Cl O4 Ru -","- C24 H25 Cl O4 Ru -","- C48 H50 Cl2 O8 Ru2 -","2","1","","Tsovaltzi, E.; Malamidou-Xenikaki, E.; Dalezis, P.; Hatzidimitriou, Antonios; Trafalis, D.; Lazarides, Theodore; Sarli, Vasiliki","Synthesis and Analysis of the Anticancer Activity of Ru(II) Complexes Incorporating 2-Hydroxymethylidene-indene-1,3-diones Ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02162C","","","0.71073","MoKα","","0.037","0.0219","","0.05","0.0469","0.0469","","","","","","1","","","","has coordinates","199792","2020-10-21","18:00:00",""
"7056517","11.3428","0.0007","11.6272","0.0008","12.1199","0.0011","65.746","0.006","76.952","0.005","80.911","0.004","1415.9","0.2","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C59 H54 Cl4 N2 O6 Ru2 -","- C59 H54 Cl4 N2 O6 Ru2 -","- C59 H54 Cl4 N2 O6 Ru2 -","1","0.5","","Tsovaltzi, E.; Malamidou-Xenikaki, E.; Dalezis, P.; Hatzidimitriou, Antonios; Trafalis, D.; Lazarides, Theodore; Sarli, Vasiliki","Synthesis and Analysis of the Anticancer Activity of Ru(II) Complexes Incorporating 2-Hydroxymethylidene-indene-1,3-diones Ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02162C","","","0.71073","MoKα","","0.0882","0.0537","","0.1646","0.1469","0.1469","","","","","","1","","","","has coordinates","199792","2020-10-21","18:00:00",""
"7056518","17.786","0.008","10.318","0.005","19.201","0.009","90","","90","","90","","3524","3","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H18 Cl Mn N2 O4 -","- C18 H18 Cl Mn N2 O4 -","- C144 H144 Cl8 Mn8 N16 O32 -","8","1","","Dolai, Malay; Mondal, Abhishake; Liu, Jun-Liang; Mahammad, Ali","Three novel mononuclear Mn(III) based magnetic materials with square pyramidal versus octahedral geometries","New J. Chem.","2017","","","","","10.1039/C7NJ02919E","","","0.71073","MoKα","","0.0984","0.0531","","","0.1091","0.1328","","","","","","1.066","","","","has coordinates","199809","2020-10-21","18:00:00",""
"7056519","18.1502","0.0008","10.0629","0.0004","20.4381","0.0009","90","","90","","90","","3732.9","0.3","273","2","273","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H18 Mn N5 O4 -","- C18 H18 Mn N5 O4 -","- C144 H144 Mn8 N40 O32 -","8","1","","Dolai, Malay; Mondal, Abhishake; Liu, Jun-Liang; Mahammad, Ali","Three novel mononuclear Mn(III) based magnetic materials with square pyramidal versus octahedral geometries","New J. Chem.","2017","","","","","10.1039/C7NJ02919E","","","0.71073","MoKα","","0.1282","0.0634","","","0.1538","0.18","","","","","","1.032","","","","has coordinates","199809","2020-10-21","18:00:00",""
"7056520","11.997","0.0003","13.159","0.0004","22.969","0.0007","90","","90","","90","","3626.08","0.18","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H20 Cl Mn N2 O5 -","- C18 H20 Cl Mn N2 O5 -","- C144 H160 Cl8 Mn8 N16 O40 -","8","1","","Dolai, Malay; Mondal, Abhishake; Liu, Jun-Liang; Mahammad, Ali","Three novel mononuclear Mn(III) based magnetic materials with square pyramidal versus octahedral geometries","New J. Chem.","2017","","","","","10.1039/C7NJ02919E","","","0.71073","MoKα","","0.0526","0.0388","","","0.1035","0.1126","","","","","","1.054","","","","has coordinates","199809","2020-10-21","18:00:00",""
"7056521","10.697","0.004","15.165","0.006","14.304","0.004","90","","129.741","0.012","90","","1784.2","1.1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(1,5-Cyclooctadiene)-bis(N,N'-dimethylthiourea)-iridium(IV)","","- C14 H26 Cl Ir N4 S2 -","- C14 H26 Cl Ir N4 S2 -","- C56 H104 Cl4 Ir4 N16 S8 -","4","1","","Kumar, Sumit; Purcell, Walter; Conradie, Jeanet; Bragg, Robert; Langner, Ernst Hendrik","Synthesis, characterization, computational and antimicrobial activities of a novel iridium thiourea complex","New J. Chem.","2017","","","","","10.1039/C7NJ02019H","","","0.71073","MoKα","","0.0243","0.0212","","","0.0494","0.051","","","","","","1.06","","","","has coordinates","199833","2020-10-21","18:00:00",""
"7056522","13.7585","0.0006","12.5082","0.0004","15.7328","0.0006","90","","110.107","0.004","90","","2542.5","0.18","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H30 I N3 O Zn -","- C27 H30 I N3 O Zn -","- C108 H120 I4 N12 O4 Zn4 -","4","1","","Alaji, Z.; Safaei, E.; Wojtczak, A.","Development of pyridine based o-aminophenolate zinc complexes as structurally tunable catalysts for CO2 fixation into cyclic carbonates","New J. Chem.","2017","","","","","10.1039/C7NJ01656E","","","0.71073","MoKα","","0.0493","0.0284","","","0.0569","0.0601","","","","","","0.918","","","","has coordinates","199834","2020-10-21","18:00:00",""
"7056523","10.1927","0.0013","10.2059","0.0012","14.7907","0.0019","94.834","0.01","98.779","0.011","114.583","0.012","1363.9","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H34 N3 O3.5 Zn -","- C29 H34 N3 O3.5 Zn -","- C58 H68 N6 O7 Zn2 -","2","1","","Alaji, Z.; Safaei, E.; Wojtczak, A.","Development of pyridine based o-aminophenolate zinc complexes as structurally tunable catalysts for CO2 fixation into cyclic carbonates","New J. Chem.","2017","","","","","10.1039/C7NJ01656E","","","0.71073","MoKα","","0.0851","0.0611","","","0.1653","0.2128","","","","","","1.069","","","","has coordinates","199834","2020-10-21","18:00:00",""
"7056524","7.9476","0.0003","11.5809","0.0005","14.2737","0.0006","83.054","0.004","76.725","0.004","89.507","0.003","1269.02","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H30 Br N3 O Zn -","- C27 H30 Br N3 O Zn -","- C54 H60 Br2 N6 O2 Zn2 -","2","1","","Alaji, Z.; Safaei, E.; Wojtczak, A.","Development of pyridine based o-aminophenolate zinc complexes as structurally tunable catalysts for CO2 fixation into cyclic carbonates","New J. Chem.","2017","","","","","10.1039/C7NJ01656E","","","0.71073","MoKα","","0.0639","0.0375","","","0.0796","0.0859","","","","","","0.882","","","","has coordinates","199834","2020-10-21","18:00:00",""
"7056525","21.8983","0.0008","21.8983","0.0008","21.2428","0.0008","90","","90","","120","","8821.9","0.6","150","2","150","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C23 H20.5 O4.25 -","- C23 H20 O4.25 -","- C414 H360 O76.5 -","18","1","","talhi, oualid; Abdeldjebar, Hasnia; Belmiloud, Yamina; Hassaine, Ridha; Taibi, Nadia; Valega, Monica; Almeida Paz, Filipe Alexandre; Brahimi, Meziane; Bachari, Khaldoun; Silva, Artur M. S.","Organobase Catalysed One-pot Exo-selective Synthesis of meso-Spiro[Cyclohexanone-Pyrandione] Derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02168B","","","0.71073","MoKα","","0.0928","0.0603","","","0.1786","0.2048","","","","","","1.06","","","","has coordinates,has disorder","199847","2020-10-21","18:00:00",""
"7056526","14.1989","0.0003","6.3206","0.0001","24.271","0.0005","90","","96.751","0.002","90","","2163.11","0.07","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H24 O6 -","- C25 H24 O6 -","- C100 H96 O24 -","4","1","","talhi, oualid; Abdeldjebar, Hasnia; Belmiloud, Yamina; Hassaine, Ridha; Taibi, Nadia; Valega, Monica; Almeida Paz, Filipe Alexandre; Brahimi, Meziane; Bachari, Khaldoun; Silva, Artur M. S.","Organobase Catalysed One-pot Exo-selective Synthesis of meso-Spiro[Cyclohexanone-Pyrandione] Derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02168B","","","0.715","synchrotron","","0.0638","0.0632","","","0.1367","0.137","","","","","","1.063","","","","has coordinates,has disorder","199847","2020-10-21","18:00:00",""
"7056527","22.418","0.004","9.8837","0.0017","11.914","0.002","90","","93.04","0.005","90","","2636.1","0.8","180","2","180","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C31 H36 O4 -","- C31 H36 O4 -","- C124 H144 O16 -","4","1","","talhi, oualid; Abdeldjebar, Hasnia; Belmiloud, Yamina; Hassaine, Ridha; Taibi, Nadia; Valega, Monica; Almeida Paz, Filipe Alexandre; Brahimi, Meziane; Bachari, Khaldoun; Silva, Artur M. S.","Organobase Catalysed One-pot Exo-selective Synthesis of meso-Spiro[Cyclohexanone-Pyrandione] Derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02168B","","","0.71073","MoKα","","0.0864","0.0722","","","0.1838","0.1963","","","","","","1.029","","","","has coordinates","199847","2020-10-21","18:00:00",""
"7056528","9.4899","0.0016","13.113","0.002","13.165","0.002","110.046","0.012","102.423","0.011","94.908","0.011","1480.2","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H30 N6 O8 -","- C32 H30 N6 O8 -","- C64 H60 N12 O16 -","2","1","","Baruah, Jubaraj Bikash; Tarai, Arup","Competing phenol-imidazole and phenol-phenol interactions in flexible supramolecular environment of N,N'-bis(3-imidazol-1-yl-propyl)naphthalenediimide causing domain expansion","New J. Chem.","2017","","","","","10.1039/C7NJ02322G","","","0.71073","MoKα","","0.0942","0.0501","","","0.086","0.0993","","","","","","1.081","","","","has coordinates","199876","2020-10-21","18:00:00",""
"7056529","8.3794","0.0012","10.8125","0.0017","12.123","0.003","106.232","0.014","108.621","0.015","105.345","0.009","920.7","0.4","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H30 N10 O14 -","- C38 H30 N10 O14 -","- C38 H30 N10 O14 -","1","0.5","","Baruah, Jubaraj Bikash; Tarai, Arup","Competing phenol-imidazole and phenol-phenol interactions in flexible supramolecular environment of N,N'-bis(3-imidazol-1-yl-propyl)naphthalenediimide causing domain expansion","New J. Chem.","2017","","","","","10.1039/C7NJ02322G","","","0.71073","MoKα","","0.1025","0.0542","","","0.0921","0.1134","","","","","","1.081","","","","has coordinates","199876","2020-10-21","18:00:00",""
"7056530","9.2173","0.001","10.4784","0.0011","11.2283","0.0009","101.512","0.008","98.485","0.008","108.836","0.01","979.11","0.19","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H36 N8 O10 -","- C40 H36 N8 O10 -","- C40 H36 N8 O10 -","1","0.5","","Baruah, Jubaraj Bikash; Tarai, Arup","Competing phenol-imidazole and phenol-phenol interactions in flexible supramolecular environment of N,N'-bis(3-imidazol-1-yl-propyl)naphthalenediimide causing domain expansion","New J. Chem.","2017","","","","","10.1039/C7NJ02322G","","","0.71073","MoKα","","0.1413","0.0715","","","0.1449","0.1833","","","","","","1.01","","","","has coordinates","199876","2020-10-21","18:00:00",""
"7056531","9.4179","0.0005","9.5207","0.0005","16.3424","0.0008","86.803","0.004","88.439","0.003","69.925","0.004","1374.12","0.13","296","2","296.15","","","","","","","","","4","P -1","-P 1","2","","","","- C32 H28 N6 O6 -","- C32 H28 N6 O6 -","- C64 H56 N12 O12 -","2","1","","Baruah, Jubaraj Bikash; Tarai, Arup","Competing phenol-imidazole and phenol-phenol interactions in flexible supramolecular environment of N,N'-bis(3-imidazol-1-yl-propyl)naphthalenediimide causing domain expansion","New J. Chem.","2017","","","","","10.1039/C7NJ02322G","","","0.71073","MoKα","","0.1039","0.0621","","","0.1604","0.1959","","","","","","1.049","","","","has coordinates,has disorder","199876","2020-10-21","18:00:00",""
"7056532","9.7353","0.0004","14.6502","0.0006","11.7908","0.0005","90","","97.654","0.003","90","","1666.67","0.12","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H34 N6 O8 -","- C38 H34 N6 O8 -","- C76 H68 N12 O16 -","2","0.5","","Baruah, Jubaraj Bikash; Tarai, Arup","Competing phenol-imidazole and phenol-phenol interactions in flexible supramolecular environment of N,N'-bis(3-imidazol-1-yl-propyl)naphthalenediimide causing domain expansion","New J. Chem.","2017","","","","","10.1039/C7NJ02322G","","","0.71073","MoKα","","0.0758","0.0437","","","0.101","0.1126","","","","","","1.081","","","","has coordinates","199876","2020-10-21","18:00:00",""
"7056533","9.347","","9.949","","10.194","","106.19","","101.69","","110.1","","806.765","","293","2","293","2","","","","","","","","4","P -1","-P 1","2","azine","(1E,2E)-1-(4-ethoxybenzylidene)-2-(1-(4-nitrophenyl)ethylidene)hydrazine","","- C17 H17 N3 O3 -","- C17 H17 N3 O3 -","- C34 H34 N6 O6 -","2","1","","Valverde, Clodoaldo; Fonseca Vaz, Wesley; Custódio, Jean; Duarte, Vitor; Carvalho Jr, Paulo de Sousa; Figueredo, Andreza; Aquino, Gilberto Lúcio Benedito; Baseia, Basilio; Napolitano, Hamilton","Solid State Structure and Environmental Polarization Effect of a Novel Asymmetric Azine","New J. Chem.","2017","","","","","10.1039/C7NJ00618G","","","0.71073","MoKα","","0.078","0.0624","","","0.1706","0.1908","","","","","","1.03","","","","has coordinates","199877","2020-10-21","18:00:00",""
"7056534","7.7389","0.0005","9.6787","0.0006","13.1985","0.0008","81.999","0.002","75","0.001","75.514","0.002","921.62","0.1","298","2","298","2","","","","","","","","5","P -1","-P 1","2","DDL-JE10_55","","","- C15 H12 Er O9 S3 -","- C15 H12 Er O9 S3 -","- C30 H24 Er2 O18 S6 -","2","1","","Einkauf, Jeffrey D.; Ortega, Raul E.; Mathivathanan, Logesh; de Lill, Daniel T.","Nitroaromatic sensing with a new lanthanide coordination polymer [Ln2(C10H4O4S2)3(H2O)6]n (Ln = Sm-Yb) assembled by 2,2’-bithiophene-5,5’-dicarboxylate","New J. Chem.","2017","","","","","10.1039/C7NJ01677H","","","0.71073","MoKα","","0.0308","0.0264","","","0.0589","0.0607","","","","","","1.113","","","","has coordinates","199878","2020-10-21","18:00:00",""
"7056535","17.2827","0.0006","21.8727","0.0011","21.3196","0.0008","90","","103.353","0.003","90","","7841.3","0.6","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C172 H170 Cu2 N8 Ni2 O34 Tb2 -","- C172 H170 Cu2 N8 Ni2 O34 Tb2 -","- C344 H340 Cu4 N16 Ni4 O68 Tb4 -","2","0.5","","Zhu, Zhao-Xia; Cai, Li-Zheng; Deng, Xiao-Wei; Zhou, Yanling; Yao, Min-Xia","Synthesis, structures and magnetism of heterotrimetallic Ni-Cu-Ln complexes based on a dicompartmental imine-oxime ligand","New J. Chem.","2017","","","","","10.1039/C7NJ01955F","","","0.71073","MoKα","","0.1004","0.0514","","","0.1223","0.1366","","","","","","1.097","","","","has coordinates","199889","2020-10-21","18:00:00",""
"7056536","17.2908","0.0017","22.264","0.002","21.455","0.002","90","","103.966","0.007","90","","8015.2","1.3","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C170 H166 Cu2 Gd2 N8 Ni2 O34 -","- C170 H166 Cu2 Gd2 N8 Ni2 O34 -","- C340 H332 Cu4 Gd4 N16 Ni4 O68 -","2","0.5","","Zhu, Zhao-Xia; Cai, Li-Zheng; Deng, Xiao-Wei; Zhou, Yanling; Yao, Min-Xia","Synthesis, structures and magnetism of heterotrimetallic Ni-Cu-Ln complexes based on a dicompartmental imine-oxime ligand","New J. Chem.","2017","","","","","10.1039/C7NJ01955F","","","0.71073","MoKα","","0.136","0.0699","","","0.1857","0.2161","","","","","","1.257","","","","has coordinates","199889","2020-10-21","18:00:00",""
"7056537","17.2892","0.0007","21.8955","0.001","21.2964","0.0008","90","","103.845","0.003","90","","7827.6","0.6","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C172 H170 Cu2 Ho2 N8 Ni2 O34 -","- C172 H170 Cu2 Ho2 N8 Ni2 O34 -","- C344 H340 Cu4 Ho4 N16 Ni4 O68 -","2","0.5","","Zhu, Zhao-Xia; Cai, Li-Zheng; Deng, Xiao-Wei; Zhou, Yanling; Yao, Min-Xia","Synthesis, structures and magnetism of heterotrimetallic Ni-Cu-Ln complexes based on a dicompartmental imine-oxime ligand","New J. Chem.","2017","","","","","10.1039/C7NJ01955F","","","0.71073","MoKα","","0.1159","0.0597","","","0.148","0.1687","","","","","","1.102","","","","has coordinates","199889","2020-10-21","18:00:00",""
"7056538","17.2908","0.0017","22.264","0.002","21.455","0.002","90","","103.966","0.007","90","","8015.2","1.3","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C172 H170 Cu2 Dy2 N8 Ni2 O34 -","- C172 H170 Cu2 Dy2 N8 Ni2 O34 -","- C344 H340 Cu4 Dy4 N16 Ni4 O68 -","2","0.5","","Zhu, Zhao-Xia; Cai, Li-Zheng; Deng, Xiao-Wei; Zhou, Yanling; Yao, Min-Xia","Synthesis, structures and magnetism of heterotrimetallic Ni-Cu-Ln complexes based on a dicompartmental imine-oxime ligand","New J. Chem.","2017","","","","","10.1039/C7NJ01955F","","","0.71073","MoKα","","0.1059","0.0672","","","0.1774","0.1914","","","","","","1.045","","","","has coordinates","199889","2020-10-21","18:00:00",""
"7056539","9.1606","0.0009","9.1763","0.001","15.3777","0.0019","90","","90","","90","","1292.7","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H7 F5 N2 -","- C15 H7 F5 N2 -","- C60 H28 F20 N8 -","4","1","","Prasannan, Dijo; Arunkumar, Chellaiah","Pentafluorophenyl dipyrrin as probe for transition metal ion detection and its bioremediation in Bacillus subtilis and Bacillus cereus","New J. Chem.","2017","","","","","10.1039/C7NJ02157G","","","0.71073","MoKα","","0.0433","0.0378","","","0.0989","0.1058","","","","","","1.081","","","","has coordinates","199890","2020-10-21","18:00:00",""
"7056540","18.125","0.002","18.125","0.002","18.125","0.003","90","","90","","90","","5954.3","1.4","298","2","298","2","","","","","","","","5","I 2 3","I 2 2 3","197","","","","- C36 H74 Cl6 N20 O4 -","- C36 H74.0004 Cl6.0002 N20 O3.9999 -","- C144 H296.002 Cl24.0008 N80 O15.9996 -","4","0.166667","","Matyuska, Ferenc; Nagy, Nora V.; Benyei, Attila; Gajda, Tamás","Control of structure, stability and catechol oxidase activity of copper(II) complexes by the denticity of tripodal platforms","New J. Chem.","2017","","","","","10.1039/C7NJ02013A","","","0.71073","MoKα","","0.0984","0.0878","","","","0.2403","","","","","","1.041","","","","has coordinates","199891","2020-10-21","18:00:00",""
"7056541","17.1341","0.0013","9.4399","0.0006","17.6883","0.0014","90","","117.219","0.001","90","","2544.2","0.3","103","2","103","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(tris[2-(5-pyrazolylmethyl)aminoethyl]amine-N,N',N"",N'"",N"""")-copper(II) diperchlorate","","- C18 H30 Cl2 Cu N10 O8 -","- C18 H30 Cl2 Cu N10 O8 -","- C72 H120 Cl8 Cu4 N40 O32 -","4","1","","Matyuska, Ferenc; Nagy, Nora V.; Benyei, Attila; Gajda, Tamás","Control of structure, stability and catechol oxidase activity of copper(II) complexes by the denticity of tripodal platforms","New J. Chem.","2017","","","","","10.1039/C7NJ02013A","","","0.71073","MoKα","","0.0563","0.0491","","","0.1205","0.1259","","","","","","1.046","","","","has coordinates,has disorder","199891","2020-10-21","18:00:00",""
"7056542","7.798","0.004","23.059","0.003","9.942","0.002","90","","111.31","0.03","90","","1665.5","1","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1'-Methyldispiro[cyclooctane-1,3'-pyrrolidine-2',2''-indene]-1'',2,3''-trione","","- C20 H23 N O3 -","- C20 H23 N O3 -","- C80 H92 N4 O12 -","4","1","","Seeni, Maharani; Vivek Kumar, Sundaravel; Almansour, Abdulrahman Ibrahim; Kumar, Raju; K, Anitha; Raju, Ranjith Kumar","Synthesis of penta- and tetra-cyclic cage-like compounds and dispiro heterocycles through microwave-assisted solvent-free multi-component domino reactions","New J. Chem.","2017","","","","","10.1039/C7NJ01673E","","","0.71073","MoKα","","0.0364","0.0311","","","0.0803","0.0921","","","","","","1.034","","","","has coordinates","199892","2020-10-21","18:00:00",""
"7056543","7.5616","0.0007","8.9033","0.0008","10.8091","0.0011","72.764","0.011","80.486","0.012","72.369","0.011","660.09","0.12","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","5a,10a-Dihydroxy-3-methyl-2,3,4,5,5a,10a-hexahydro-1,5-methanoindeno [1,2-d] azepine-10,11(1H)-dione","","- C15 H15 N O4 -","- C15 H15 N O4 -","- C30 H30 N2 O8 -","2","1","","Seeni, Maharani; Vivek Kumar, Sundaravel; Almansour, Abdulrahman Ibrahim; Kumar, Raju; K, Anitha; Raju, Ranjith Kumar","Synthesis of penta- and tetra-cyclic cage-like compounds and dispiro heterocycles through microwave-assisted solvent-free multi-component domino reactions","New J. Chem.","2017","","","","","10.1039/C7NJ01673E","","","0.71073","MoKα","","0.0427","0.037","","","0.0927","0.0969","","","","","","1.107","","","","has coordinates","199892","2020-10-21","18:00:00",""
"7056544","9.2706","0.0009","19.7818","0.0018","10.5006","0.001","90","","93.572","0.001","90","","1922","0.3","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Benzyl-7a-hydroxy-1-methyl-2,3,5,6,7,7a-hexahydro-1H-3a,7-methano-indeno[2,1-d]pyrrolo[3,2-c]azepine-12,13(4H)-dione","","- C24 H24 N2 O3 -","- C24 H24 N2 O3 -","- C96 H96 N8 O12 -","4","1","","Seeni, Maharani; Vivek Kumar, Sundaravel; Almansour, Abdulrahman Ibrahim; Kumar, Raju; K, Anitha; Raju, Ranjith Kumar","Synthesis of penta- and tetra-cyclic cage-like compounds and dispiro heterocycles through microwave-assisted solvent-free multi-component domino reactions","New J. Chem.","2017","","","","","10.1039/C7NJ01673E","","","0.71073","MoKα","","0.0434","0.04","","","0.1059","0.1092","","","","","","1.043","","","","has coordinates","199892","2020-10-21","18:00:00",""
"7056545","11.7935","0.001","12.3784","0.001","24.81","0.002","90","","90","","90","","3621.9","0.5","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","6a-Hydroxy-1-methyl-4-phenyl-2,3,6,6a-tetrahydro-1H,4H,11H-3a,6-methanoindeno [2',1':4,5]thiopyrano[4,3-b]pyrrole-11,12-dione","","- C22 H19 N O3 S -","- C22 H19 N O3 S -","- C176 H152 N8 O24 S8 -","8","1","","Seeni, Maharani; Vivek Kumar, Sundaravel; Almansour, Abdulrahman Ibrahim; Kumar, Raju; K, Anitha; Raju, Ranjith Kumar","Synthesis of penta- and tetra-cyclic cage-like compounds and dispiro heterocycles through microwave-assisted solvent-free multi-component domino reactions","New J. Chem.","2017","","","","","10.1039/C7NJ01673E","","","0.71073","MoKα","","0.0333","0.0315","","","0.0897","0.0917","","","","","","1.055","","","","has coordinates","199892","2020-10-21","18:00:00",""
"7056546","13.535","0.005","23.826","0.005","8.463","0.005","90","","104.28","0.005","90","","2644.9","1.9","296","2","296","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C46 H52 Lu2 O27 -","- C46 H38 Lu2 O27 -","- C92 H76 Lu4 O54 -","2","0.25","","shi, tian; Chen, Ya-Guang; Ren, Xiao-Yan","Synthesis, characterization and properties of lanthanide coordination polymers with 3,5-bis(4-carboxyphenylmethyloxy) benzoic acid","New J. Chem.","2017","","","","","10.1039/C7NJ01650F","","","0.71069","MoKα","","0.0584","0.0412","","","0.0955","0.121","","","","","","1.101","","","","has coordinates,has disorder","199921","2020-10-21","18:00:00",""
"7056547","13.538","0.005","23.892","0.005","8.482","0.005","90","","104.265","0.005","90","","2658.9","1.9","296","2","296","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C46 H52 Er2 O27 -","- C46 H38 Er2 O27 -","- C92 H76 Er4 O54 -","2","0.25","","shi, tian; Chen, Ya-Guang; Ren, Xiao-Yan","Synthesis, characterization and properties of lanthanide coordination polymers with 3,5-bis(4-carboxyphenylmethyloxy) benzoic acid","New J. Chem.","2017","","","","","10.1039/C7NJ01650F","","","0.71069","MoKα","","0.0376","0.0297","","","0.0718","0.0751","","","","","","1.056","","","","has coordinates,has disorder","199921","2020-10-21","18:00:00",""
"7056548","22.702","0.005","7.53","0.005","29.233","0.005","90","","90","","90","","4997","4","296","2","296","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C23 H24 Ce O12.5 -","- C23 H15 Ce O8 -","- C184 H120 Ce8 O64 -","8","1","","shi, tian; Chen, Ya-Guang; Ren, Xiao-Yan","Synthesis, characterization and properties of lanthanide coordination polymers with 3,5-bis(4-carboxyphenylmethyloxy) benzoic acid","New J. Chem.","2017","","","","","10.1039/C7NJ01650F","","","0.71069","MoKα","","0.1001","0.0453","","","0.089","0.1177","","","","","","0.987","","","","has coordinates,has disorder","199921","2020-10-21","18:00:00",""
"7056549","22.645","0.003","7.6075","0.001","29.26","0.004","90","","90","","90","","5040.7","1.2","296","2","296","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C23 H24 La O12.5 -","- C23 H15 La O8 -","- C184 H120 La8 O64 -","8","1","","shi, tian; Chen, Ya-Guang; Ren, Xiao-Yan","Synthesis, characterization and properties of lanthanide coordination polymers with 3,5-bis(4-carboxyphenylmethyloxy) benzoic acid","New J. Chem.","2017","","","","","10.1039/C7NJ01650F","","","0.71073","MoKα","","0.1289","0.0546","","","0.1123","0.1452","","","","","","0.97","","","","has coordinates,has disorder","199921","2020-10-21","18:00:00",""
"7056550","13.544","0.005","23.806","0.005","8.457","0.005","90","","104.523","0.005","90","","2639.6","1.9","296","2","296","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C46 H52 O27 Tm2 -","- C46 H38 O27 Tm2 -","- C92 H76 O54 Tm4 -","2","0.25","","shi, tian; Chen, Ya-Guang; Ren, Xiao-Yan","Synthesis, characterization and properties of lanthanide coordination polymers with 3,5-bis(4-carboxyphenylmethyloxy) benzoic acid","New J. Chem.","2017","","","","","10.1039/C7NJ01650F","","","0.71069","MoKα","","0.0452","0.0363","","","0.081","0.0905","","","","","","1.076","","","","has coordinates,has disorder","199921","2020-10-21","18:00:00",""
"7056551","11.7418","0.0005","18.5045","0.0008","12.0354","0.0005","90","","93.494","0.001","90","","2610.14","0.19","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","hexacarbonylbis(μ-benzenetellurolato)(μ-pyridazine-κN1:κN2)dirhenium0.5(dichloromethane solvate)","","- C22.5 H15 Cl N2 O6 Re2 Te2 -","- C22.5 H15 Cl N2 O6 Re2 Te2 -","- C90 H60 Cl4 N8 O24 Re8 Te8 -","4","1","","Veronese, Lorenzo; Quartapelle Procopio, Elsa; Maggioni, Daniela; Mercandelli, Pierluigi; Panigati, Monica","Dinuclear Rhenium pyridazine complexes containing bridging chalcogenide anions: synthesis, characterization and computational study","New J. Chem.","2017","","","","","10.1039/C7NJ02548C","","","0.71073","MoKα","","0.0171","0.0162","","","0.0358","0.0361","","","","","","1.142","","","","has coordinates","199922","2020-10-21","18:00:00",""
"7056552","11.6624","0.0008","18.0556","0.0013","11.5828","0.0008","90","","94.007","0.001","90","","2433","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","hexacarbonylbis(μ-benzeneselenolato)(μ-pyridazine-κN1:κN2)dirhenium0.5(dichloromethane solvate)","","- C22.0365 H14.073 Cl0.073 N2 O6 Re2 Se2 -","- C22.036 H14.072 Cl0.073 N2 O6 Re2 Se2 -","- C88.144 H56.288 Cl0.292 N8 O24 Re8 Se8 -","4","1","","Veronese, Lorenzo; Quartapelle Procopio, Elsa; Maggioni, Daniela; Mercandelli, Pierluigi; Panigati, Monica","Dinuclear Rhenium pyridazine complexes containing bridging chalcogenide anions: synthesis, characterization and computational study","New J. Chem.","2017","","","","","10.1039/C7NJ02548C","","","0.71073","MoKα","","0.0308","0.0205","","","0.0398","0.0427","","","","","","1.032","","","","has coordinates","199922","2020-10-21","18:00:00",""
"7056553","5.4915","0.0002","17.403","0.0005","24.2402","0.0007","90","","90","","90","","2316.6","0.13","297","2","297","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H22 Cu N2 O5 -","- C26 H22 Cu N2 O5 -","- C104 H88 Cu4 N8 O20 -","4","1","","Ahmed, Faruk; Halder, Soumi; Dutta, Basudeb; Islam, Sakhiul; Sen, Chandana; Kundu, Suman; Sinha, Chittaranjan; Ray, Partha Pratim; Mir, Mohammad Hedayetullah","Synthesis and structural characterization of Cu(II)-based 1D coordination polymer and its application in Schottky device","New J. Chem.","2017","","","","","10.1039/C7NJ01557G","","","0.71073","MoKα","","0.048","0.0417","","","0.0967","0.0998","","","","","","1.159","","","","has coordinates","199982","2020-10-21","18:00:00",""
"7056554","22.2759","0.0003","22.2759","0.0003","16.4697","0.0006","90","","90","","120","","7077.6","0.3","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C84 H102 Cl6 Cu7 N12 O21 Zn2 -","- C84 H102 Cl6 Cu7 N12 O20.9998 Zn2 -","- C252 H306 Cl18 Cu21 N36 O62.9994 Zn6 -","3","0.166667","","Li, Xiaoqin; Ma, Dan; Cao, Bingran; Lu, Ying","Windmill-type mixed-metal clusters containing schiff-base ligands as efficient catalyst for cyclohexene oxidation","New J. Chem.","2017","","","","","10.1039/C7NJ02359F","","","0.71073","MoKα","","0.0792","0.0653","","","0.1808","0.1934","","","","","","1.038","","","","has coordinates,has disorder","199983","2020-10-21","18:00:00",""
"7056555","22.3264","0.0003","22.3264","0.0003","16.4388","0.0006","90","","90","","120","","7096.4","0.3","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C84 H102 Cl6 Cu7 Mn2 N12 O21 -","- C84 H102 Cl6 Cu7 Mn2 N12 O20.9998 -","- C252 H306.001 Cl18 Cu21 Mn6 N36 O62.9994 -","3","0.166667","","Li, Xiaoqin; Ma, Dan; Cao, Bingran; Lu, Ying","Windmill-type mixed-metal clusters containing schiff-base ligands as efficient catalyst for cyclohexene oxidation","New J. Chem.","2017","","","","","10.1039/C7NJ02359F","","","0.71073","MoKα","","0.0707","0.0511","","","0.1285","0.147","","","","","","1.027","","","","has coordinates,has disorder","199983","2020-10-21","18:00:00",""
"7056556","8.486","0.0004","12.0008","0.0007","12.9636","0.0007","112.276","0.005","97.062","0.004","108.048","0.004","1117.37","0.12","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H22 N2 Ni2 O5 -","- C27 H22 N2 Ni2 O5 -","- C54 H44 N4 Ni4 O10 -","2","1","","Nemec, Ivan; Herchel, Radovan; Machata, Marek; Travnicek, Zdenek","Tetranuclear Ni(II) and Co(II) Schiff-base complexes with an M4O6 defective dicubane-like core: zero-field SMM behavior in the cobalt analogue","New J. Chem.","2017","","","","","10.1039/C7NJ02281F","","","0.71073","MoKα","","0.0505","0.034","","","0.0713","0.0767","","","","","","0.975","","","","has coordinates,has disorder","199984","2020-10-21","18:00:00",""
"7056557","12.6657","0.001","10.6594","0.0009","11.1921","0.0009","90","","115.08","0.002","90","","1368.57","0.19","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Br0.29 F1.71 -","- C20 H12 Br0.29 F1.71 -","- C80 H48 Br1.16 F6.84 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0529","0.0473","","","0.0981","0.0997","","","","","","1.243","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056558","7.3184","0.0005","12.8258","0.0009","18.0272","0.0013","109.369","0.002","90.011","0.002","102.874","0.002","1551.16","0.19","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H12 Br2 -","- C20 H12 Br2 -","- C80 H48 Br8 -","4","2","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0406","0.0316","","","0.0631","0.0664","","","","","","1.089","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056559","12.4551","0.0009","10.6234","0.0008","11.1894","0.0008","90","","115.483","0.0016","90","","1336.49","0.17","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 F2 -","- C20 H12 F2 -","- C80 H48 F8 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0378","0.0346","","","0.0979","0.101","","","","","","1.061","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056560","12.6621","0.0009","10.6518","0.0008","11.173","0.0008","90","","115.065","0.002","90","","1365.04","0.17","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Cl0.33 F1.67 -","- C20 H12 Cl0.328 F1.672 -","- C80 H48 Cl1.312 F6.688 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0361","0.0318","","","0.0859","0.089","","","","","","1.1","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056561","13.6675","0.0011","8.1974","0.0007","14.9831","0.0012","90","","90.5433","0.0019","90","","1678.6","0.2","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 F6 -","- C22 H12 F6 -","- C88 H48 F24 -","4","1","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0357","0.0303","","","0.0746","0.0788","","","","","","1.075","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056562","13.619","0.0007","10.5374","0.0006","11.4528","0.0006","90","","115.295","0.001","90","","1485.99","0.14","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Br2 -","- C20 H12 Br2 -","- C80 H48 Br8 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0355","0.0303","","","0.0791","0.0812","","","","","","1.167","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056563","13.1656","0.001","10.6206","0.0008","11.2471","0.0009","90","","115.052","0.0018","90","","1424.7","0.19","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Cl2 -","- C20 H12 Cl2 -","- C80 H48 Cl8 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0406","0.0331","","","0.0786","0.0831","","","","","","1.077","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056564","27.406","0.003","6.3564","0.0006","9.5554","0.0009","90","","106.745","0.0017","90","","1594","0.3","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 I2 -","- C20 H12 I2 -","- C80 H48 I8 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0342","0.0205","","","0.0476","0.0538","","","","","","1.104","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056565","12.6657","0.001","10.6594","0.0009","11.1921","0.0009","90","","115.08","0.002","90","","1368.57","0.19","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C40 H24 Br0.57 F3.43 -","- C40 H24 Br0.57 F3.43 -","- C80 H48 Br1.14 F6.86 -","2","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0451","0.0359","","","0.0901","0.0938","","","","","","1.067","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056566","12.6575","0.0011","10.6532","0.0009","11.1899","0.001","90","","115.098","0.002","90","","1366.4","0.2","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C40 H24 Br0.55 F3.45 -","- C40 H24 Br0.55 F3.45 -","- C80 H48 Br1.1 F6.9 -","2","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0474","0.0344","","","0.0761","0.0815","","","","","","1.034","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056567","10.1208","0.0004","25.0267","0.001","33.4392","0.0014","90","","92.0165","0.0013","90","","8464.6","0.6","100","2","100","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C32 H22 -","- C32 H22 -","- C512 H352 -","16","4","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","1.54178","CuKα","","0.1097","0.0694","","","0.1648","0.2076","","","","","","1.087","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056568","12.6399","0.0011","10.6517","0.0009","11.176","0.001","90","","115.128","0.002","90","","1362.3","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Cl0.33 F1.67 -","- C20 H12 Cl0.326 F1.674 -","- C80 H48 Cl1.304 F6.696 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0357","0.032","","","0.0852","0.088","","","","","","1.113","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056569","16.4376","0.0011","12.9727","0.0009","7.2813","0.0005","90","","90","","90","","1552.66","0.18","100","2","100","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C20 H12 Br2 -","- C20 H12 Br2 -","- C80 H48 Br8 -","4","1","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0182","0.017","","","0.0421","0.0426","","","","","","1.082","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056570","12.6575","0.0011","10.6532","0.0009","11.1899","0.001","90","","115.098","0.002","90","","1366.4","0.2","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Br0.28 F1.72 -","- C20 H12 Br0.282 F1.718 -","- C80 H48 Br1.128 F6.872 -","4","0.5","","Budniak, Adam K.; Masny, Michał; Prezelj, Kristina; Grzeszkiewicz, Mikołaj; Gawraczyński, Jakub; Dobrzycki, Łukasz; Cyrański, Michał K.; Koźmiński, Wiktor; Mazej, Zoran; Fijałkowski, Karol J.; Grochala, Wojciech; Leszczyński, Piotr J.","Reconnaissance of reactivity of an Ag(ii)SO4 one-electron oxidizer towards naphthalene derivatives","New J. Chem.","2017","","","","","10.1039/C7NJ02299A","","","0.71073","MoKα","","0.0594","0.0515","","","0.1004","0.1026","","","","","","1.325","","","","has coordinates","200020","2020-10-21","18:00:00",""
"7056571","20.2205","0.0015","12.0071","0.0008","13.185","0.001","90","","98.761","0.003","90","","3163.8","0.4","150","2","150.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H34 Cl Mn N6 O6 -","- C32 H34 Cl Mn N6 O6 -","- C128 H136 Cl4 Mn4 N24 O24 -","4","1","","Banerjee, Saikat; Brandao, Paula; Bauza, Antonio; Frontera, Antonio; Barcelo-Oliver, Miquel; Panja, Anangamohan; Saha, Amrita","Nuclearity versus oxidation state in catalytic efficiency of MnII/III azo Schiff base complexes: Computational study on supramolecular interactions and phenoxazinone synthase like activity","New J. Chem.","2017","","","","","10.1039/C7NJ02280H","","","0.71073","MoKα","","0.1248","0.0676","","","0.1815","0.2284","","","","","","1.041","","","","has coordinates","200057","2020-10-21","18:00:00",""
"7056572","8.375","0.0002","14.7703","0.0004","31.987","0.0009","90","","92.029","0.001","90","","3954.35","0.18","150","2","150.15","","","","","","","","","7","P 1 2/c 1","-P 2yc","13","","","","- C70 H84 Cl2 Mn2 N18 O14 Zn2 -","- C70 H84 Cl2 Mn2 N18 O14 Zn2 -","- C140 H168 Cl4 Mn4 N36 O28 Zn4 -","2","0.5","","Banerjee, Saikat; Brandao, Paula; Bauza, Antonio; Frontera, Antonio; Barcelo-Oliver, Miquel; Panja, Anangamohan; Saha, Amrita","Nuclearity versus oxidation state in catalytic efficiency of MnII/III azo Schiff base complexes: Computational study on supramolecular interactions and phenoxazinone synthase like activity","New J. Chem.","2017","","","","","10.1039/C7NJ02280H","","","0.71073","MoKα","","0.083","0.0613","","","0.1815","0.1995","","","","","","1.055","","","","has coordinates,has disorder","200057","2020-10-21","18:00:00",""
"7056573","24.2226","0.0012","7.8812","0.0003","25.4161","0.0013","90","","120.284","0.007","90","","4189.9","0.5","100","0.1","100","0.1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","SebdtSe","","- C22 H22 N4 S Se2 -","- C22 H22 N4 S Se2 -","- C176 H176 N32 S8 Se16 -","8","1","","Ghosh, Sirina; Das, Sarasija; Kumar, Neha Rani; Agrawal, Abhijeet R.; Zade, Sanjio S.","Effect of heteroatom (S/Se) juggling in donor-acceptor-donor (D-A-D) fused systems: synthesis and electrochemical polymerization","New J. Chem.","2017","","","","","10.1039/C7NJ02394D","","x-ray","0.71073","MoKα","","0.0405","0.0347","","","0.0856","0.0892","","","","","","1.063","","","","has coordinates","200058","2020-10-21","18:00:00",""
"7056574","24.0368","0.0011","7.8856","0.0003","24.6824","0.0011","90","","118.162","0.006","90","","4124.6","0.4","293.15","","293.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","SbdSeS","","- C22 H22 N4 S2 Se -","- C22 H22 N4 S2 Se -","- C176 H176 N32 S16 Se8 -","8","1","","Ghosh, Sirina; Das, Sarasija; Kumar, Neha Rani; Agrawal, Abhijeet R.; Zade, Sanjio S.","Effect of heteroatom (S/Se) juggling in donor-acceptor-donor (D-A-D) fused systems: synthesis and electrochemical polymerization","New J. Chem.","2017","","","","","10.1039/C7NJ02394D","","","0.71073","","","0.035303","0.031109","","","","0.116105","","","","","","0.950288","","","","has coordinates","200058","2020-10-21","18:00:00",""
"7056575","20.6742","0.0008","14.3417","0.0005","16.3414","0.0007","90","","111.545","0.004","90","","4506.7","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","SbdtS","","- C22 H22 N4 S3 -","- C22 H22 N4 S3 -","- C176 H176 N32 S24 -","8","1","","Ghosh, Sirina; Das, Sarasija; Kumar, Neha Rani; Agrawal, Abhijeet R.; Zade, Sanjio S.","Effect of heteroatom (S/Se) juggling in donor-acceptor-donor (D-A-D) fused systems: synthesis and electrochemical polymerization","New J. Chem.","2017","","","","","10.1039/C7NJ02394D","","","1.54184","CuKα","","0.0431","0.0386","","","0.1189","0.1245","","","","","","1.083","","","","has coordinates","200058","2020-10-21","18:00:00",""
"7056576","11.0068","0.0012","18.8343","0.0018","19.829","0.002","72.08","0.006","89.811","0.007","77.711","0.007","3813.1","0.7","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H21 N O4 -","- C22 H21 N O4 -","- C176 H168 N8 O32 -","8","4","","Wen, Sai-Shuai; Zhou, Zhao-Fang; Xiao, Jun-An; Li, Jun; Xiang, Haoyue; Yang, Hua","Facile oxidative cyclization to access C2-quaternary 2-hydroxy-indolin-3-ones: Synthetic studies towards matemone","New J. Chem.","2017","","","","","10.1039/C7NJ02246H","","","0.71073","MoKα","","0.1295","0.0534","","","0.1271","0.172","","","","","","0.994","","","","has coordinates","200113","2020-10-21","18:00:00",""
"7056577","9.727","0.004","10.001","0.004","11.403","0.004","113.392","0.01","96.236","0.01","113.408","0.008","886.4","0.6","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H19 N3 -","- C22 H19 N3 -","- C44 H38 N6 -","2","1","","Singh, Ajai kumar; Singh, Mahabir Pratap; Saleem, Fariha; Pal, Ram Sahay","Palladacycles having normal and spiro chelate rings designed from bi- and tridentate ligands with indole core: structure, synthesis and applications as catalysts","New J. Chem.","2017","","","","","10.1039/C7NJ02116J","","","0.71073","MoKα","","0.2039","0.0688","","","0.1075","0.1437","","","","","","0.885","","","","has coordinates","200114","2020-10-21","18:00:00",""
"7056578","8.1295","0.0019","15.338","0.004","18.901","0.004","90","","90","","90","","2356.8","1","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H10 N2 S -","- C13 H10 N2 S -","- C104 H80 N16 S8 -","8","1","","Singh, Ajai kumar; Singh, Mahabir Pratap; Saleem, Fariha; Pal, Ram Sahay","Palladacycles having normal and spiro chelate rings designed from bi- and tridentate ligands with indole core: structure, synthesis and applications as catalysts","New J. Chem.","2017","","","","","10.1039/C7NJ02116J","","","0.71073","MoKα","","0.0636","0.0453","","","0.1175","0.1299","","","","","","0.95","","","","has coordinates","200114","2020-10-21","18:00:00",""
"7056579","14.7535","0.0016","13.5197","0.0015","15.5348","0.0017","90","","111.195","0.002","90","","2889","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27 H20 Cl4 N4 Pd2 S2 -","- C27 H20 Cl4 N4 Pd2 S2 -","- C108 H80 Cl16 N16 Pd8 S8 -","4","0.5","","Singh, Ajai kumar; Singh, Mahabir Pratap; Saleem, Fariha; Pal, Ram Sahay","Palladacycles having normal and spiro chelate rings designed from bi- and tridentate ligands with indole core: structure, synthesis and applications as catalysts","New J. Chem.","2017","","","","","10.1039/C7NJ02116J","","","0.71073","MoKα","","0.0335","0.0297","","","0.0734","0.0753","","","","","","1.042","","","","has coordinates","200114","2020-10-21","18:00:00",""
"7056580","8.5285","0.0018","15.89","0.003","7.5691","0.0016","90","","114.881","0.003","90","","930.5","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H9 N O -","- C12 H9 N O -","- C48 H36 N4 O4 -","4","1","","Singh, Ajai kumar; Singh, Mahabir Pratap; Saleem, Fariha; Pal, Ram Sahay","Palladacycles having normal and spiro chelate rings designed from bi- and tridentate ligands with indole core: structure, synthesis and applications as catalysts","New J. Chem.","2017","","","","","10.1039/C7NJ02116J","","","0.71073","MoKα","","0.0468","0.0383","","","0.1049","0.1106","","","","","","1.078","","","","has coordinates","200114","2020-10-21","18:00:00",""
"7056581","10.45","0.006","12.734","0.008","18.174","0.011","90","","104.019","0.011","90","","2346","2","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H22 Cl N5 Pd -","- C26 H22 Cl N5 Pd -","- C104 H88 Cl4 N20 Pd4 -","4","1","","Singh, Ajai kumar; Singh, Mahabir Pratap; Saleem, Fariha; Pal, Ram Sahay","Palladacycles having normal and spiro chelate rings designed from bi- and tridentate ligands with indole core: structure, synthesis and applications as catalysts","New J. Chem.","2017","","","","","10.1039/C7NJ02116J","","","0.71073","MoKα","","0.1273","0.0873","","","0.1527","0.1687","","","","","","1.168","","","","has coordinates","200114","2020-10-21","18:00:00",""
"7056582","11.737","0.003","12.583","0.003","8.43","0.002","90","","104.108","0.006","90","","1207.4","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 N2 O -","- C15 H12 N2 O -","- C60 H48 N8 O4 -","4","1","","Singh, Ajai kumar; Singh, Mahabir Pratap; Saleem, Fariha; Pal, Ram Sahay","Palladacycles having normal and spiro chelate rings designed from bi- and tridentate ligands with indole core: structure, synthesis and applications as catalysts","New J. Chem.","2017","","","","","10.1039/C7NJ02116J","","","0.71073","MoKα","","0.0768","0.0469","","","0.1036","0.1142","","","","","","1.024","","","","has coordinates","200114","2020-10-21","18:00:00",""
"7056583","10.7502","0.0004","13.3823","0.0006","17.1566","0.0009","83.608","0.004","77.608","0.004","72.188","0.004","2292.36","0.19","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H28 Au2 F14 P2 S2 -","- C50 H28 Au2 F14 P2 S2 -","- C100 H56 Au4 F28 P4 S4 -","2","1","","Moreno-Alcántar, Luis Guillermo; Guevara-Vela, José Manuel; Delgadillo-Ruíz, Rafael; Rocha-Rinza, Tomás; Martín Pendás, Angel; Flores-Alamo, Marcos; Torrens, Hugo","Structural effects of trifluoromethylation and fluorination in gold(I) BIPHEP fluorothiolates","New J. Chem.","2017","","","","","10.1039/C7NJ02202F","","","0.71073","MoKα","","0.0632","0.0518","","","0.1229","0.1343","","","","","","1.08","","","","has coordinates","200115","2020-10-21","18:00:00",""
"7056584","10.9563","0.0005","13.2303","0.0006","16.1494","0.0007","93.295","0.004","101.336","0.004","110.274","0.004","2132.9","0.18","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H28 Au2 F10 P2 S2 -","- C48 H28 Au2 F10 P2 S2 -","- C96 H56 Au4 F20 P4 S4 -","2","1","","Moreno-Alcántar, Luis Guillermo; Guevara-Vela, José Manuel; Delgadillo-Ruíz, Rafael; Rocha-Rinza, Tomás; Martín Pendás, Angel; Flores-Alamo, Marcos; Torrens, Hugo","Structural effects of trifluoromethylation and fluorination in gold(I) BIPHEP fluorothiolates","New J. Chem.","2017","","","","","10.1039/C7NJ02202F","","","0.71073","MoKα","","0.0689","0.0571","","","0.1425","0.1566","","","","","","1.074","","","","has coordinates","200115","2020-10-21","18:00:00",""
"7056585","4.4715","0.0005","6.6057","0.0007","16.7243","0.0018","101.339","0.009","91.268","0.009","105.658","0.01","464.89","0.09","133","2","133","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H14 N4 O4 -","- C22 H14 N4 O4 -","- C22 H14 N4 O4 -","1","0.5","","Farfán, Norberto; Santillan, Rosa; Garcia Ortega, Héctor; Guerrero, Tomas; Morales-Saavedra, O. G.; Lacroix, Pascal Georges","Bis(4-nitroanilines) in interaction through a π-conjugated bridge: conformational effects and potential molecular switches","New J. Chem.","2017","","","","","10.1039/C7NJ02622F","","","0.71073","MoKα","","0.1356","0.0511","","","0.085","0.1009","","","","","","0.807","","","","has coordinates","200169","2020-10-21","18:00:00",""
"7056586","20.583","0.002","10.965","0.001","14.503","0.002","90","","103.007","0.009","90","","3189.2","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-bis[5-(4-(hexyloxy)phenyl)-1,3,4-oxadiazol-2-yl]benzene","","- C34 H37 N5 O6 -","- C34 H37 N5 O6 -","- C136 H148 N20 O24 -","4","0.5","","Gallardo, Hugo; Ferreira, Marli; Westphal, Eduard; Ballottin, Mariana Victoria; Bechtold, Ivan H.; Bortoluzzi, Adailton J.; Mezalira, Daniela Zambelli","Columnar bent-core liquid crystals with two oxadiazole units and two or four alkyl chains and their phase-dependent fluorescence","New J. Chem.","2017","","","","","10.1039/C7NJ00548B","","","0.71069","MoKα","","0.1125","0.0702","","","0.1984","0.2269","","","","","","1.066","","","","has coordinates","200272","2020-10-21","18:00:00",""
"7056587","11.494","0.007","21.318","0.003","14.593","0.005","90","","111.24","0.04","90","","3333","3","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C53 H84 Cl N17 Ni4 O15 -","- C52 H80 Cl N17 Ni4 O14 -","- C104 H160 Cl2 N34 Ni8 O28 -","2","1","","Chattopadhyay, Shouvik; Bhattacharyya, Anik; Das, Mithun; Bauza, Antonio; Herrero, Santiago; González-Prieto, Rodrigo; Frontera, Antonio","Both end-on and end-to-end azide bridged tetranuclear ferromagnetic nickel(II) Schiff base complex","New J. Chem.","2017","","","","","10.1039/C7NJ00852J","","","0.71073","MoKα","","0.057","0.045","","","0.1158","0.123","","","","","","1.068","","","","has coordinates","200437","2020-10-21","18:00:00",""
"7056588","11.5443","0.0003","11.6413","0.0003","15.0137","0.0004","74.386","0.002","69.643","0.002","74.148","0.002","1785.5","0.09","150","2","150","2","","","","","","","","7","P 1","P 1","1","","","","- C13 H19 Cl Cu N7 O2.5 S -","- C13 H19 Cl Cu N7 O2.5 S -","- C52 H76 Cl4 Cu4 N28 O10 S4 -","4","4","","Shen, Fang; Liu, Ya-Xian; Li, Shu-Min; Jiang, Chi-Kun; Wang, Bing-Feng; Xiong, Yahong; Mao, Zong-Wan; Le, Xue-Yi","Synthesis, crystal structures, molecular docking, in vitro cytotoxicity studies of two new copper(II) complexes: special emphasis on their binding to HSA","New J. Chem.","2017","","","","","10.1039/C7NJ02351K","","","1.54184","CuKα","","0.0359","0.0356","","","0.0998","0.1001","","","","","","1.041","","","","has coordinates","200766","2020-10-21","18:00:00",""
"7056589","11.462","0.0003","13.0187","0.0005","21.6957","0.0004","83.139","0.002","76.475","0.002","70.908","0.003","2971.27","0.16","150","2","150","2","","","","","","","","6","P 1","P 1","1","","","","- C17 H22 Cl Cu N7 O4 -","- C17 H22 Cl Cu N7 O4 -","- C102 H132 Cl6 Cu6 N42 O24 -","6","6","","Shen, Fang; Liu, Ya-Xian; Li, Shu-Min; Jiang, Chi-Kun; Wang, Bing-Feng; Xiong, Yahong; Mao, Zong-Wan; Le, Xue-Yi","Synthesis, crystal structures, molecular docking, in vitro cytotoxicity studies of two new copper(II) complexes: special emphasis on their binding to HSA","New J. Chem.","2017","","","","","10.1039/C7NJ02351K","","","0.71073","MoKα","","0.0322","0.0276","","","0.062","0.0644","","","","","","1.022","","","","has coordinates","200766","2020-10-21","18:00:00",""
"7056590","7.5607","0.0008","13.715","0.0015","8.9269","0.0009","90","","102.388","0.004","90","","904.12","0.17","299","2","299","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H6 N10 O -","- C4 H6 N10 O -","- C16 H24 N40 O4 -","4","1","","Chen, Fu-Xue; Wang, Q.; Lu, Tian; Wang, Chenbin; Fan, Gui-Juan; Yin, Hongquan","Synthesis of 5,5'-azoxybistetrazole via nitration and de-oxygen rearrangement of triazene","New J. Chem.","2017","","","","","10.1039/C7NJ02724A","","","0.71073","MoKα","","0.0775","0.0553","","","0.1401","0.1562","","","","","","1.033","","","","has coordinates","200767","2020-10-21","18:00:00",""
"7056591","10.08","0.002","12.781","0.003","15.66","0.003","80.391","0.004","71.443","0.004","74.048","0.004","1832","0.7","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H28 Ag9 N12 O40 P W12 -","- C42 H28 Ag9 N12 O40 P W12 -","- C42 H28 Ag9 N12 O40 P W12 -","1","0.5","","Cao, Yue; Lv, Jinghua; Yu, Kai; Wang, Chunmei; Su, Zhanhua; Wang, Lu; Zhou, Baibin","Synthesis and photo-/electro-catalytic properties of Keggin polyoxometalate inorganic-organic hybrid layers based on d10 metal and rigid benzo-diazole/-triazole ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02615C","","","0.71073","MoKα","","0.0924","0.0743","","","0.1039","0.1229","","","","","","1.057","","","","has coordinates","200768","2020-10-21","18:00:00",""
"7056592","11.679","0.01","12.709","0.012","13.329","0.012","95.994","0.013","111.209","0.013","107.347","0.013","1710","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H26 Cu7 Mo12 N18 O40 P -","- C36 H26 Cu7 Mo12 N18 O40 P -","- C36 H26 Cu7 Mo12 N18 O40 P -","1","0.5","","Cao, Yue; Lv, Jinghua; Yu, Kai; Wang, Chunmei; Su, Zhanhua; Wang, Lu; Zhou, Baibin","Synthesis and photo-/electro-catalytic properties of Keggin polyoxometalate inorganic-organic hybrid layers based on d10 metal and rigid benzo-diazole/-triazole ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02615C","","","0.71073","MoKα","","0.0627","0.0583","","","0.1082","0.1165","","","","","","1.068","","","","has coordinates","200768","2020-10-21","18:00:00",""
"7056593","9.9145","0.0016","11.2727","0.0019","13.766","0.002","69.701","0.003","82.052","0.003","71.665","0.002","1369","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H28 Mo12 N8 O40 Si -","- C28 H28 Mo12 N8 O40 Si -","- C28 H28 Mo12 N8 O40 Si -","1","0.5","","Cao, Yue; Lv, Jinghua; Yu, Kai; Wang, Chunmei; Su, Zhanhua; Wang, Lu; Zhou, Baibin","Synthesis and photo-/electro-catalytic properties of Keggin polyoxometalate inorganic-organic hybrid layers based on d10 metal and rigid benzo-diazole/-triazole ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02615C","","","0.71068","MoKα","","0.0858","0.0722","","","0.1226","0.1032","","","","","","1.09","","","","has coordinates","200768","2020-10-21","18:00:00",""
"7056594","11.6544","0.0008","12.8654","0.0009","13.5532","0.0009","95.994","0.001","111.033","0.001","106.86","0.002","1765.1","0.2","296","2","296","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H26 Ag7 As N18 O40 W12 -","- C36 H26 Ag7 As N18 O40 W12 -","- C36 H26 Ag7 As N18 O40 W12 -","1","0.5","","Cao, Yue; Lv, Jinghua; Yu, Kai; Wang, Chunmei; Su, Zhanhua; Wang, Lu; Zhou, Baibin","Synthesis and photo-/electro-catalytic properties of Keggin polyoxometalate inorganic-organic hybrid layers based on d10 metal and rigid benzo-diazole/-triazole ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02615C","","","0.71073","MoKα","","0.0803","0.0741","","","0.105","0.1174","","","","","","1.073","","","","has coordinates","200768","2020-10-21","18:00:00",""
"7056595","12.409","0.0008","14.8977","0.001","17.3674","0.0011","65.948","0.001","80.814","0.001","69.922","0.001","2753","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H27 Mo12 N8 O40 P -","- C28 H27 Mo12 N8 O40 P -","- C56 H54 Mo24 N16 O80 P2 -","2","1","","Cao, Yue; Lv, Jinghua; Yu, Kai; Wang, Chunmei; Su, Zhanhua; Wang, Lu; Zhou, Baibin","Synthesis and photo-/electro-catalytic properties of Keggin polyoxometalate inorganic-organic hybrid layers based on d10 metal and rigid benzo-diazole/-triazole ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02615C","","","0.71073","MoKα","","0.0591","0.0338","","","0.1155","0.1368","","","","","","1.125","","","","has coordinates","200768","2020-10-21","18:00:00",""
"7056596","12.5644","0.0019","14.395","0.002","15.5","0.002","90","","90","","90","","2803.4","0.7","296","2","296.15","","","","","","","","","5","I 21 21 21","I 2b 2c","24","","","","- C30 H26 N4 O4 Zn -","- C30 H26 N4 O4 Zn -","- C120 H104 N16 O16 Zn4 -","4","0.5","","Zhang, Mei-Li; Wang, Ji-Jiang; Ma, Zhen-Zhen; Qiao, Lei","Color tunable entangled coordination polymers based on long flexible bis(imidazole) ligands and phenylenediacetate","New J. Chem.","2017","","","","","10.1039/C7NJ00645D","","","0.71073","MoKα","","0.0402","0.0368","","","0.0972","0.0999","","","","","","1.0147","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7056597","17.5339","0.0013","16.7657","0.0012","12.7103","0.0009","90","","132.795","0.001","90","","2741.7","0.3","296","2","296.15","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C60 H50 Cd2 N8 O8 -","- C60 H50 Cd2 N8 O8 -","- C120 H100 Cd4 N16 O16 -","2","0.5","","Zhang, Mei-Li; Wang, Ji-Jiang; Ma, Zhen-Zhen; Qiao, Lei","Color tunable entangled coordination polymers based on long flexible bis(imidazole) ligands and phenylenediacetate","New J. Chem.","2017","","","","","10.1039/C7NJ00645D","","","0.71073","MoKα","","0.0188","0.018","","","0.0507","0.0515","","","","","","1.0334","","","","has coordinates","278046","2022-09-21","15:45:42",""
"7056598","12.3569","0.0007","16.5347","0.0009","17.0455","0.0009","100.883","0.001","103.834","0.001","109.436","0.001","3048.9","0.3","293","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C66.5 H56 Co2 N8 O11 -","- C66.5 H56 Co2 N8 O11 -","- C133 H112 Co4 N16 O22 -","2","1","","Zhang, Mei-Li; Wang, Ji-Jiang; Ma, Zhen-Zhen; Qiao, Lei","Color tunable entangled coordination polymers based on long flexible bis(imidazole) ligands and phenylenediacetate","New J. Chem.","2017","","","","","10.1039/C7NJ00645D","","","0.71073","MoKα","","0.1046","0.0687","","","0.2064","0.2426","","","","","","1.036","","","","has coordinates","200816","2020-10-21","18:00:00",""
"7056599","10.2073","0.0014","10.5715","0.0015","15.142","0.002","109.687","0.002","99.922","0.002","92.742","0.002","1505.5","0.4","296","2","","","","","","","","","","6","P -1","-P 1","2","","","","- C30 H29 Cl N4 O5 Pd -","- C30 H29 Cl N4 O5 Pd -","- C60 H58 Cl2 N8 O10 Pd2 -","2","1","","Zhang, Mei-Li; Wang, Ji-Jiang; Ma, Zhen-Zhen; Qiao, Lei","Color tunable entangled coordination polymers based on long flexible bis(imidazole) ligands and phenylenediacetate","New J. Chem.","2017","","","","","10.1039/C7NJ00645D","","","0.71073","MoKα","","0.0466","0.04","","","0.1237","0.1323","","","","","","0.9561","","","","has coordinates","200816","2020-10-21","18:00:00",""
"7056600","12.325","0.003","6.5356","0.0015","17.769","0.003","90","","115.411","0.012","90","","1292.8","0.5","293","2","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C30 H26 Cd N4 O4 -","- C30 H26 Cd N4 O4 -","- C60 H52 Cd2 N8 O8 -","2","0.5","","Zhang, Mei-Li; Wang, Ji-Jiang; Ma, Zhen-Zhen; Qiao, Lei","Color tunable entangled coordination polymers based on long flexible bis(imidazole) ligands and phenylenediacetate","New J. Chem.","2017","","","","","10.1039/C7NJ00645D","","","0.71073","MoKα","","0.0413","0.0398","","","0.1104","0.1112","","","","","","1.0183","","","","has coordinates","200816","2020-10-21","18:00:00",""
"7056601","16.5928","0.0012","10.6712","0.0008","16.0573","0.0011","90","","110.762","0.001","90","","2658.6","0.3","296","2","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H27 Cd N4 O6 -","- C27 H27 Cd N4 O6 -","- C108 H108 Cd4 N16 O24 -","4","1","","Zhang, Mei-Li; Wang, Ji-Jiang; Ma, Zhen-Zhen; Qiao, Lei","Color tunable entangled coordination polymers based on long flexible bis(imidazole) ligands and phenylenediacetate","New J. Chem.","2017","","","","","10.1039/C7NJ00645D","","","0.71073","MoKα","","0.0413","0.0285","","","0.0649","0.0737","","","","","","1.027","","","","has coordinates","200816","2020-10-21","18:00:00",""
"7056602","8.201","0.006","9.946","0.007","21.325","0.015","81.89","0.03","84.71","0.02","87.42","0.02","1714","2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H56 Br0 Cl22 N4 O0 Ru2 -","- C50 H56 Cl22 N4 Ru2 -","- C50 H56 Cl22 N4 Ru2 -","1","0.5","","Ramaiah, Danaboyina; Viji, Mambattakkara; Tyagi, Nidhi; Naithani, Neeraj","Aryl Appended Neutral and Cationic Half-sandwich Ruthenium(II)-NHC Complexes: Synthesis, Characterisation and Catalytic Applications","New J. Chem.","2017","","","","","10.1039/C7NJ02822A","","","0.71073","MoKα","","0.1059","0.0785","","","0.2043","0.2212","","","","","","1.21","","","","has coordinates","200877","2020-10-21","18:00:00",""
"7056603","16.376","0.011","10.424","0.007","20.145","0.01","90","","127.64","0.04","90","","2723","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H50 Cl16 N4 Ru2 -","- C40 H50 Cl16 N4 Ru2 -","- C80 H100 Cl32 N8 Ru4 -","2","0.5","","Ramaiah, Danaboyina; Viji, Mambattakkara; Tyagi, Nidhi; Naithani, Neeraj","Aryl Appended Neutral and Cationic Half-sandwich Ruthenium(II)-NHC Complexes: Synthesis, Characterisation and Catalytic Applications","New J. Chem.","2017","","","","","10.1039/C7NJ02822A","","","0.71073","MoKα","","0.1477","0.1139","","","0.2066","0.2229","","","","","","1.226","","","","has coordinates","200877","2020-10-21","18:00:00",""
"7056604","29.1612","0.0011","12.5438","0.0005","16.5284","0.0006","90","","103.261","0.002","90","","5884.7","0.4","296","2","296","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C27 H31 Cl F6 N3 P Ru -","- C27 H31 Cl F6 N3 P Ru -","- C216 H248 Cl8 F48 N24 P8 Ru8 -","8","1","","Ramaiah, Danaboyina; Viji, Mambattakkara; Tyagi, Nidhi; Naithani, Neeraj","Aryl Appended Neutral and Cationic Half-sandwich Ruthenium(II)-NHC Complexes: Synthesis, Characterisation and Catalytic Applications","New J. Chem.","2017","","","","","10.1039/C7NJ02822A","","","0.71073","MoKα","","0.0729","0.0577","","","0.184","0.2022","","","","","","0.999","","","","has coordinates","200877","2020-10-21","18:00:00",""
"7056605","13.3979","0.0007","10.3168","0.0005","19.7429","0.0009","90","","101.468","0.002","90","","2674.5","0.2","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Cl F6 N3 P Ru -","- C25 H27 Cl F6 N3 P Ru -","- C100 H108 Cl4 F24 N12 P4 Ru4 -","4","1","","Ramaiah, Danaboyina; Viji, Mambattakkara; Tyagi, Nidhi; Naithani, Neeraj","Aryl Appended Neutral and Cationic Half-sandwich Ruthenium(II)-NHC Complexes: Synthesis, Characterisation and Catalytic Applications","New J. Chem.","2017","","","","","10.1039/C7NJ02822A","","","0.71073","MoKα","","0.0541","0.0352","","","0.0876","0.0965","","","","","","1.05","","","","has coordinates,has disorder","200877","2020-10-21","18:00:00",""
"7056606","9.36","0.0019","23.494","0.005","9.6076","0.0019","90","","97.83","0.03","90","","2093.1","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 Cu N5 O6 -","- C20 H19 Cu N5 O6 -","- C80 H76 Cu4 N20 O24 -","4","1","","Azary, Akbar; Bezaatpour, Abolfazl; Zahri, Saber; Amiri, Mandana","Synthesis, characterization, Crystal structure Electrochemical, Solvatochromic and Biological investigation of Novel N4 and N3 type Cu(II) Schiff base complexes","New J. Chem.","2017","","","","","10.1039/C7NJ02187A","","","0.71073","MoKα","","0.1485","0.0499","","","0.1005","0.1254","","","","","","0.778","","","","has coordinates","200918","2020-10-21","18:00:00",""
"7056607","7.1742","0.0014","11.35","0.002","12.47","0.003","76.8","0.03","75.49","0.03","83.62","0.03","955.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H18 Cl2 Cu N3 -","- C20 H18 Cl2 Cu N3 -","- C40 H36 Cl4 Cu2 N6 -","2","1","","Azary, Akbar; Bezaatpour, Abolfazl; Zahri, Saber; Amiri, Mandana","Synthesis, characterization, Crystal structure Electrochemical, Solvatochromic and Biological investigation of Novel N4 and N3 type Cu(II) Schiff base complexes","New J. Chem.","2017","","","","","10.1039/C7NJ02187A","","","0.71073","MoKα","","0.3636","0.0879","","","0.1337","0.2442","","","","","","0.587","","","","has coordinates","200918","2020-10-21","18:00:00",""
"7056608","10.267","0.004","25.086","0.009","16.403","0.006","90","","90","","90","","4225","3","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C44 H40 N4 O6 -","- C44 H40 N4 O6 -","- C176 H160 N16 O24 -","4","1","","Paul, Parimal; Bhatt, Madhuri; Maity, Debdeep; Hingu, vinayak; Suresh, Eringathodi; Ganguly, Bishwajit","Functionalized calix[4]arene as colorimetric dual sensor for Cu(II) and cysteine in aqueous media: Experimental and computational study","New J. Chem.","2017","","","","","10.1039/C7NJ02537H","","","0.71073","MoKα","","0.1536","0.1106","","","0.2278","0.2492","","","","","","1.075","","","","has coordinates","200955","2020-10-21","18:00:00",""
"7056609","9.974","0.002","10.59","0.002","13.315","0.003","111.62","0.03","96.36","0.03","106.73","0.03","1214.4","0.6","298","2","571","2","","","","","","","","4","P -1","-P 1","2","","","","- C29 H33 N3 O2 -","- C29 H33 N3 O2 -","- C58 H66 N6 O4 -","2","1","","Azadbakht, Reza; Hakimi, Mohammad; Khanabadi, Javad; Amiri Rudbari, Hadi","A new macrocyclic ligand as a turn-on fluorescent chemosensor for the recognition of Pb2+ ions","New J. Chem.","2017","","","","","10.1039/C7NJ02873C","","","0.71073","MoKα","","0.1193","0.0646","","","0.1657","0.1928","","","","","","0.843","","","","has coordinates","200964","2020-10-21","18:00:00",""
"7056610","33.17","0.007","3.969","0.0008","13.572","0.003","90","","90","","90","","1786.8","0.7","298","2","298","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C24 H18 O4 -","- C24 H18 O4 -","- C96 H72 O16 -","4","0.5","","Azadbakht, Reza; Hakimi, Mohammad; Khanabadi, Javad; Amiri Rudbari, Hadi","A new macrocyclic ligand as a turn-on fluorescent chemosensor for the recognition of Pb2+ ions","New J. Chem.","2017","","","","","10.1039/C7NJ02873C","","","0.71069","MoKα","","0.1","0.0504","","","0.113","0.1366","","","","","","1.065","","","","has coordinates","200964","2020-10-21","18:00:00",""
"7056611","6.1749","0.0007","6.3972","0.0007","9.0143","0.001","78.006","0.004","80.204","0.004","63.912","0.004","311.56","0.06","171","2","171","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H4 F2 N4 O12 -","- C6 H4 F2 N4 O12 -","- C6 H4 F2 N4 O12 -","1","0.5","","Ma, Jinchao; Yang, Hongwei; Cheng, Guangbin","Study on the synthesis of 2-fluoro-2,2-dinitroethyl esters as potential melt cast matrix in explosive charges","New J. Chem.","2017","","","","","10.1039/C7NJ02717F","","","0.71073","MoKα","","0.0568","0.036","","","0.0729","0.0784","","","","","","1.056","","","","has coordinates","200965","2020-10-21","18:00:00",""
"7056612","5.8921","0.0006","12.6006","0.0016","18.796","0.002","90","","90","","90","","1395.5","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H4 F N5 O12 -","- C9 H4 F N5 O12 -","- C36 H16 F4 N20 O48 -","4","1","","Ma, Jinchao; Yang, Hongwei; Cheng, Guangbin","Study on the synthesis of 2-fluoro-2,2-dinitroethyl esters as potential melt cast matrix in explosive charges","New J. Chem.","2017","","","","","10.1039/C7NJ02717F","","","0.71073","MoKα","","0.1163","0.0514","","","0.074","0.0914","","","","","","1.017","","","","has coordinates","200965","2020-10-21","18:00:00",""
"7056613","6.0766","0.0004","9.436","0.0003","9.7318","0.0004","73.389","0.003","72.298","0.004","84.89","0.004","509.4","0.04","295","2","295","2","","","","","","","","5","P 1","P 1","1","","5-(N-benzyl)amino-5-deoxy-1,2-O-isopropylidene-3-O-methyl-a-D-xylo-furanosyl)-(R,S)-2,3,3,3-tetrafluoropropanamide","","- C19 H23 F4 N O5 -","- C19 H23 F4 N O5 -","- C19 H23 F4 N O5 -","1","1","","Bilska-Markowska, Monika; Siodła, Tomasz; Patyk, Ewa; Katrusiak, Andrzej; Koroniak, Henryk","The conformations of new CF3 and CF3-CHF containing amides derived from carbohydrates: NMR, crystallographic and DFT study","New J. Chem.","2017","","","","","10.1039/C7NJ02986A","","x-ray","1.54184","CuKα","","0.0838","0.0782","","","0.2411","0.2534","","","","","","1.106","","","","has coordinates","201019","2020-10-21","18:00:00",""
"7056614","14.4123","0.0005","5.7309","0.0002","16.0699","0.0005","90","","113.838","0.001","90","","1214.07","0.07","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H10 Cl N S -","- C14 H10 Cl N S -","- C56 H40 Cl4 N4 S4 -","4","2","","Ge, Xin; Sun, Fengli; Liu, Xuemin; Chen, Xinzhi; Qian, Chao; Zhou, Shaodong","Combined Experimental/theoretical Study on D-Glucosamine Promoted Regioselective Sulfenylation of Indoles Catalyzed by Copper","New J. Chem.","2017","","","","","10.1039/C7NJ02784B","","","0.71073","MoKα","","0.0244","0.0231","","","0.0733","0.0745","","","","","","1.002","","","","has coordinates","201335","2020-10-21","18:00:00",""
"7056615","7.2727","0.0002","7.4681","0.0001","7.4416","0.0002","90","","95.939","0.001","90","","402.008","0.016","160","2","160","2","","","","","","","","6","P 1 2/m 1","-P 2y","10","","","","- C12 H10.4 Fe N8 O1.2 Pt -","- C12 H8 Fe N8 O1.2 Pt -","- C12 H8 Fe N8 O1.2 Pt -","1","0.25","","Polyzou, Christina D.; Lalioti, Nikolia; Psycharis, Vassilis; Tangoulis, Vassilis","Guest Induced Hysteretic Tristability in 3D Pillared Hofmann-type Microporous Metal-Organic Framework","New J. Chem.","2017","","","","","10.1039/C7NJ02398G","","","1.54178","CuKα","","0.0464","0.0438","","","0.0925","0.0941","","","","","","1.041","","","","has coordinates","201336","2020-10-21","18:00:00",""
"7056616","7.28","0.0001","7.47","0.0001","7.4387","0.0001","90","","95.88","0.001","90","","402.4","0.009","160","2","160","2","","","","","","","","6","P 1 2/m 1","-P 2y","10","","","","- C12 H10.4 Fe N8 O1.2 Pd -","- C12 H8 Fe N8 O1.2 Pd -","- C12 H8 Fe N8 O1.2 Pd -","1","0.25","","Polyzou, Christina D.; Lalioti, Nikolia; Psycharis, Vassilis; Tangoulis, Vassilis","Guest Induced Hysteretic Tristability in 3D Pillared Hofmann-type Microporous Metal-Organic Framework","New J. Chem.","2017","","","","","10.1039/C7NJ02398G","","","1.54178","CuKα","","0.0446","0.0433","","","0.1055","0.1065","","","","","","1.097","","","","has coordinates","201336","2020-10-21","18:00:00",""
"7056617","9.7915","0.0007","10.7841","0.0008","28.665","0.002","90","","90","","90","","3026.8","0.4","200","","200","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2,2-difluoro-4,6-bis(2-pyrimidyl)-1,3-dihydro-1,3,5,2-triazaborinine","","- C11 H10 B Cl2 F2 N7 -","- C11 H10 B Cl2 F2 N7 -","- C88 H80 B8 Cl16 F16 N56 -","8","1","","Yousaf, Muhammad; Yutronkie, Nathan J.; Castañeda, Raúl; Klein, Jacob A.; Brusso, Jaclyn","Boratriazines: inducing luminescence through boron incorporation into a terpy-type framework","New J. Chem.","2017","","","","","10.1039/C7NJ02462B","","","0.71073","MoKα","","0.1228","0.0692","","","0.1794","0.1955","","","","","","1.06","","","","has coordinates,has disorder","201337","2020-10-21","18:00:00",""
"7056618","8.1901","0.0002","6.215","0.0002","14.8496","0.0004","90","","92.216","0.002","90","","755.3","0.04","200","","200","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H6 B F3 N4 -","- C5 H6 B F3 N4 -","- C20 H24 B4 F12 N16 -","4","1","","Yousaf, Muhammad; Yutronkie, Nathan J.; Castañeda, Raúl; Klein, Jacob A.; Brusso, Jaclyn","Boratriazines: inducing luminescence through boron incorporation into a terpy-type framework","New J. Chem.","2017","","","","","10.1039/C7NJ02462B","","","0.71073","MoKα","","0.0444","0.0341","","","0.0975","0.1016","","","","","","1.103","","","","has coordinates","201337","2020-10-21","18:00:00",""
"7056619","7.7785","0.0003","8.8782","0.0003","9.621","0.0004","91.401","0.002","102.708","0.002","109.795","0.002","606.29","0.04","200","","200","","","","","","","","","5","P -1","-P 1","2","","2,2-difluoro-4,6-bis(2-pyridyl)-1,3-dihydro-1,3,5,2-triazaborinine","","- C12 H10 B F2 N5 -","- C12 H10 B F2 N5 -","- C24 H20 B2 F4 N10 -","2","1","","Yousaf, Muhammad; Yutronkie, Nathan J.; Castañeda, Raúl; Klein, Jacob A.; Brusso, Jaclyn","Boratriazines: inducing luminescence through boron incorporation into a terpy-type framework","New J. Chem.","2017","","","","","10.1039/C7NJ02462B","","","0.71073","MoKα","","0.0649","0.0536","","","0.1584","0.168","","","","","","1.087","","","","has coordinates","201337","2020-10-21","18:00:00",""
"7056620","12.5375","0.0012","14.0018","0.0012","15.3625","0.0015","90","","109.974","0.003","90","","2534.6","0.4","123","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","Cadmium Complex","","","- C24 H27 Cd Cl2 N5 O S -","- C24 H27 Cd Cl2 N5 O S -","- C96 H108 Cd4 Cl8 N20 O4 S4 -","4","1","","Raje, Sakthi; Mani, Kalaikodikumaran; MinnathParsutkar, Mahesh; Angamuthu, Raja","Metal ions as external stimuli in stereoselective self-sorting of koneramines and thiokoneramines","New J. Chem.","2017","","","","","10.1039/C7NJ01941F","","","0.71073","MoKα","","0.0775","0.0419","","","0.1031","0.1286","","","","","","0.834","","","","has coordinates","201338","2020-10-21","18:00:00",""
"7056621","36.547","0.007","10.4667","0.0019","13.743","0.002","90","","100.796","0.003","90","","5164","1.6","123","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H27 Cl2 N5 S Zn -","- C24 H27 Cl2 N5 S Zn -","- C192 H216 Cl16 N40 S8 Zn8 -","8","2","","Raje, Sakthi; Mani, Kalaikodikumaran; MinnathParsutkar, Mahesh; Angamuthu, Raja","Metal ions as external stimuli in stereoselective self-sorting of koneramines and thiokoneramines","New J. Chem.","2017","","","","","10.1039/C7NJ01941F","","","0.71073","MoKα","","0.0833","0.0557","","","0.113","0.1439","","","","","","1.107","","","","has coordinates,has disorder","201338","2020-10-21","18:00:00",""
"7056622","9.0819","0.0005","11.9997","0.0006","12.4935","0.0006","105.822","0.001","92.123","0.002","108.589","0.001","1230.09","0.11","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H27 Cl2 N5 O S Zn -","- C24 H27 Cl2 N5 O S Zn -","- C48 H54 Cl4 N10 O2 S2 Zn2 -","2","1","","Raje, Sakthi; Mani, Kalaikodikumaran; MinnathParsutkar, Mahesh; Angamuthu, Raja","Metal ions as external stimuli in stereoselective self-sorting of koneramines and thiokoneramines","New J. Chem.","2017","","","","","10.1039/C7NJ01941F","","","0.71073","MoKα","","0.0767","0.0442","","","0.0897","0.1001","","","","","","1.003","","","","has coordinates","201338","2020-10-21","18:00:00",""
"7056623","10.202","0.002","17.783","0.004","17.633","0.004","90","","102.04","0.03","90","","3128.6","1.2","123","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H30 Cd Cl4 N6 Ni -","- C28 H30 Cd Cl4 N6 Ni -","- C112 H120 Cd4 Cl16 N24 Ni4 -","4","1","","Raje, Sakthi; Mani, Kalaikodikumaran; MinnathParsutkar, Mahesh; Angamuthu, Raja","Metal ions as external stimuli in stereoselective self-sorting of koneramines and thiokoneramines","New J. Chem.","2017","","","","","10.1039/C7NJ01941F","","","0.71073","MoKα","","0.145","0.1113","","","0.3075","0.3225","","","","","","2.21","","","","has coordinates","201338","2020-10-21","18:00:00",""
"7056624","11.612","0.005","18.565","0.005","11.65","0.005","90","0.005","99.506","0.005","90","0.005","2477","1.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H21 N2 O9 Zn2 -","- C28 H21 N2 O9 Zn2 -","- C112 H84 N8 O36 Zn8 -","4","1","","Gupta, Anoop Kumar; Tomar, Kapil; Bharadwaj, Parimal K.","Structural Diversity of Zn(II) Based Coordination Polymers Constructed from a Flexible Carboxylate Linker and Pyridyl Co-linkers : Fluorescence Sensing of Nitro-aromatics","New J. Chem.","2017","","","","","10.1039/C7NJ02651J","","","0.71069","MoKα","","0.0587","0.0372","","","0.0923","0.1201","","","","","","1.155","","","","has coordinates","201339","2020-10-21","18:00:00",""
"7056625","14.513","0.005","14.2","0.005","14.873","0.005","90","0.005","108.193","0.005","90","0.005","2911.9","1.7","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C62 H44 N12 O17 Zn2 -","- C62 H44 N12 O17 Zn2 -","- C124 H88 N24 O34 Zn4 -","2","0.5","","Gupta, Anoop Kumar; Tomar, Kapil; Bharadwaj, Parimal K.","Structural Diversity of Zn(II) Based Coordination Polymers Constructed from a Flexible Carboxylate Linker and Pyridyl Co-linkers : Fluorescence Sensing of Nitro-aromatics","New J. Chem.","2017","","","","","10.1039/C7NJ02651J","","","0.71069","MoKα","","0.0852","0.0548","","","0.1146","0.1284","","","","","","1.021","","","","has coordinates","201339","2020-10-21","18:00:00",""
"7056626","10.2889","0.0007","11.9148","0.0008","15.1141","0.0011","91.109","0.002","96.935","0.002","105.482","0.002","1770","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C76 H60 N2 O37 Zn5 -","- C76 H60 N2 O37 Zn5 -","- C76 H60 N2 O37 Zn5 -","1","0.5","","Gupta, Anoop Kumar; Tomar, Kapil; Bharadwaj, Parimal K.","Structural Diversity of Zn(II) Based Coordination Polymers Constructed from a Flexible Carboxylate Linker and Pyridyl Co-linkers : Fluorescence Sensing of Nitro-aromatics","New J. Chem.","2017","","","","","10.1039/C7NJ02651J","","","0.71073","MoKα","","0.067","0.0441","","","0.099","0.1085","","","","","","1.026","","","","has coordinates,has disorder","201339","2020-10-21","18:00:00",""
"7056627","13.8409","0.0006","14.6035","0.0006","15.77","0.0007","90","","109.286","0.001","90","","3008.6","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H29 N3 O8 Zn -","- C34 H29 N3 O8 Zn -","- C136 H116 N12 O32 Zn4 -","4","1","","Gupta, Anoop Kumar; Tomar, Kapil; Bharadwaj, Parimal K.","Structural Diversity of Zn(II) Based Coordination Polymers Constructed from a Flexible Carboxylate Linker and Pyridyl Co-linkers : Fluorescence Sensing of Nitro-aromatics","New J. Chem.","2017","","","","","10.1039/C7NJ02651J","","","0.71073","MoKα","","0.1439","0.0837","","","0.1869","0.2241","","","","","","1.038","","","","has coordinates","201339","2020-10-21","18:00:00",""
"7056628","11.8","0.005","15.524","0.005","13.684","0.005","90","0.005","95.835","0.005","90","0.005","2493.7","1.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H24 N2 O7 Zn -","- C29 H24 N2 O7 Zn -","- C116 H96 N8 O28 Zn4 -","4","1","","Gupta, Anoop Kumar; Tomar, Kapil; Bharadwaj, Parimal K.","Structural Diversity of Zn(II) Based Coordination Polymers Constructed from a Flexible Carboxylate Linker and Pyridyl Co-linkers : Fluorescence Sensing of Nitro-aromatics","New J. Chem.","2017","","","","","10.1039/C7NJ02651J","","","0.71069","MoKα","","0.0731","0.0444","","","0.0954","0.1167","","","","","","1.083","","","","has coordinates","201339","2020-10-21","18:00:00",""
"7056629","11.4204","0.0012","21.689","0.003","15.3958","0.0017","90","","97.293","0.003","90","","3782.6","0.8","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 Cd N2 O7 -","- C14 H20 Cd N2 O7 -","- C112 H160 Cd8 N16 O56 -","8","1","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.089","0.0619","","","0.1704","0.1877","","","","","","1.042","","","","has coordinates","201340","2020-10-21","18:00:00",""
"7056630","8.9084","0.001","12.5072","0.0015","14.9281","0.0018","105.185","0.008","99.615","0.008","102.311","0.008","1523.8","0.3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H32 Cd N5 O7 -","- C29 H32 Cd N5 O7 -","- C58 H64 Cd2 N10 O14 -","2","1","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.0661","0.0443","","","0.0874","0.096","","","","","","1.026","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056631","23.6688","0.0015","13.4856","0.0009","24.0246","0.0015","90","","105.012","0.003","90","","7406.7","0.8","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H43 N6 O10.5 Zn -","- C34 H43 N6 O10.5 Zn -","- C272 H344 N48 O84 Zn8 -","8","2","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.1634","0.0741","","","0.19","0.2383","","","","","","0.993","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056632","20.1431","0.0008","8.0764","0.0004","21.7544","0.0009","90","","97.401","0.002","90","","3509.6","0.3","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H20 N2 O7 Zn -","- C14 H20 N2 O7 Zn -","- C112 H160 N16 O56 Zn8 -","8","1","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.0473","0.0363","","","0.0892","0.0963","","","","","","1.054","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056633","10.255","0.002","12.619","0.002","13.064","0.002","90","","108.023","0.004","90","","1607.6","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 Hg N2 O5 -","- C14 H16 Hg N2 O5 -","- C56 H64 Hg4 N8 O20 -","4","1","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.0839","0.0411","","","0.0778","0.0917","","","","","","0.948","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056634","9.316","0.013","13.037","0.018","13.162","0.016","61.74","0.03","81.33","0.04","85.11","0.04","1392","3","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H46 N8 O9 Zn2 -","- C48 H46 N8 O9 Zn2 -","- C48 H46 N8 O9 Zn2 -","1","0.5","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.1161","0.097","","","0.2795","0.298","","","","","","1.15","","","","has coordinates,has disorder","296814","2024-12-10","08:46:16",""
"7056635","12.38","0.002","19.659","0.003","15.164","0.002","90","","108.148","0.009","90","","3507","0.9","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H42 Hg N5 O12 -","- C29 H42 Hg N5 O12 -","- C116 H168 Hg4 N20 O48 -","4","1","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.0702","0.0382","","","0.0839","0.0958","","","","","","0.984","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056636","8.0907","0.0003","9.8783","0.0005","12.7432","0.0006","106.076","0.002","98.523","0.002","108.795","0.002","894.34","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H34 N4 O12 Zn3 -","- C32 H34 N4 O12 Zn3 -","- C32 H34 N4 O12 Zn3 -","1","0.5","","do Nascimento Neto, José Antônio; da Silva, Cameron Capeletti; Ribeiro, Leandro; Vasconcelos, Géssica Adriana; Gontijo Vaz, Boniek; Ferreira, Vinicius Sousa; Queiroz Júnior, Luiz Keng; Maia, Lauro J. Q.; Sarotti, Ariel Marcelo; Martins, Felipe Terra","Probing the Competition between Acetate and 2,2’-Bipyridine Ligands to Bind to d-Block 12 Group Metals: Molecular and Structural Diversity towards High-Efficiency Luminescent Materials","New J. Chem.","2017","","","","","10.1039/C7NJ02393F","","","0.71073","MoKα","","0.0279","0.0245","","","0.0659","0.068","","","","","","1.045","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056637","4.2229","0.0006","13.994","0.002","42.276","0.006","90","","90","","90","","2498.3","0.6","298","2","298","2","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C16 H16 Ba Cl6 O10 -","- C16 H16 Ba Cl6 O10 -","- C64 H64 Ba4 Cl24 O40 -","4","0.5","","Xu, Xiu ling; Hu, Fan; Shuai, Qi","A facile synthesis, crystal structure and bioactivity evaluation of two novel barium complexes based on 2,4,6-trichlorophenoxyacetic acid and o-ferrocenylcarbonyl benzoic acid","New J. Chem.","2017","","","","","10.1039/C7NJ03046K","","","0.71073","MoKα","","0.0652","0.0589","","","0.1655","0.1764","","","","","","1.178","","","","has coordinates","201495","2020-10-21","18:00:00",""
"7056638","9.3623","0.0006","11.8133","0.0015","20.503","0.002","77.734","0.001","89.018","0.002","89.116","0.002","2215.4","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H54 Ba Fe2 O20 -","- C36 H54 Ba Fe2 O20 -","- C72 H108 Ba2 Fe4 O40 -","2","1","","Xu, Xiu ling; Hu, Fan; Shuai, Qi","A facile synthesis, crystal structure and bioactivity evaluation of two novel barium complexes based on 2,4,6-trichlorophenoxyacetic acid and o-ferrocenylcarbonyl benzoic acid","New J. Chem.","2017","","","","","10.1039/C7NJ03046K","","","0.71073","MoKα","","0.1658","0.0993","","","0.2312","0.2936","","","","","","1.06","","","","has coordinates","201495","2020-10-21","18:00:00",""
"7056639","7.5576","0.0003","15.4438","0.0008","9.6007","0.0005","90","","91.438","0.005","90","","1120.22","0.09","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 Cu2 N14 S2 -","- C16 H18 Cu2 N14 S2 -","- C32 H36 Cu4 N28 S4 -","2","0.5","","Biswas, Niladri; KHANRA, SUMIT; Sarkar, Arnab; Mandal, Deba Prasad; Bhattacharjee, Shamee; Chaudhuri, Ankur; Chakraborty, Sibani; Roy Choudhury, Chirantan","One new azido bridged dinuclear copper(II) thiosemicarbazide complex: Synthesis, DNA/protein binding, molecular docking study and cytotoxicity activity","New J. Chem.","2017","","","","","10.1039/C7NJ01998J","","","0.71073","MoKα","","0.0463","0.0362","","","0.0787","0.0838","","","","","","1.073","","","","has coordinates","201496","2020-10-21","18:00:00",""
"7056640","13.6857","0.0012","19.1641","0.0016","20.631","0.0018","90","","105.861","0.002","90","","5205","0.8","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C46 H54 Ag2 F12 N10 O2 P2 -","- C46 H54 Ag2 F12 N10 O2 P2 -","- C184 H216 Ag8 F48 N40 O8 P8 -","4","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.077","0.0529","","","0.1499","0.1711","","","","","","1.068","","","","has coordinates","201497","2020-10-21","18:00:00",""
"7056641","12.736","0.005","30.092","0.012","16.19","0.007","90","","98.396","0.005","90","","6138","4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C48 H62 Ag3 F18 N10 O4 P3 -","- C48 H62 Ag3 F18 N10 O4 P3 -","- C192 H248 Ag12 F72 N40 O16 P12 -","4","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.17","0.0933","","","0.24","0.2904","","","","","","1.018","","","","has coordinates","201497","2020-10-21","18:00:00",""
"7056642","13.072","0.003","14.373","0.003","15.647","0.004","71.028","0.004","71.887","0.004","65.687","0.004","2479.5","1","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H44 F12 N8 Ni P2 -","- C42 H44 F12 N8 Ni P2 -","- C84 H88 F24 N16 Ni2 P4 -","2","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.1764","0.1085","","","0.2179","0.2437","","","","","","1.094","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056643","12.925","0.004","13.073","0.004","16.324","0.006","75.27","0.007","69.306","0.007","66.767","0.006","2349.8","1.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H40 F12 N8 P2 Pd -","- C40 H40 F11.994 N8 P1.999 Pd -","- C80 H80 F23.988 N16 P3.998 Pd2 -","2","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.0969","0.0613","","","0.1422","0.1579","","","","","","1.055","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056644","12.74","0.002","14.279","0.003","16.577","0.003","78.433","0.004","71.473","0.004","64.699","0.004","2577.7","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C2.75 H3 F0.75 N0.5 P0.12 Pt0.06 -","- C2.75 H3 F0.75 N0.5 P0.125 Pt0.0625 -","- C88 H96 F24 N16 P4 Pt2 -","32","16","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.101","0.0617","","","0.161","0.1718","","","","","","1.077","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056645","11.4236","0.0019","13.822","0.002","15.218","0.002","90.046","0.004","96.534","0.004","102.324","0.004","2331.5","0.6","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H44 F12 N8 P2 Pd -","- C42 H44 F12 N8 P2 Pd -","- C84 H88 F24 N16 P4 Pd2 -","2","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.2014","0.1164","","","0.2096","0.2419","","","","","","1.057","","","","has coordinates","201497","2020-10-21","18:00:00",""
"7056646","12.866","0.002","12.956","0.002","16.28","0.003","75.394","0.004","69.092","0.002","67.037","0.002","2314","0.7","190","2","190","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H40 F12 N8 P2 Pt -","- C40 H40 F12 N8 P2 Pt -","- C80 H80 F24 N16 P4 Pt2 -","2","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.0893","0.0631","","","0.1476","0.1567","","","","","","1.04","","","","has coordinates","201497","2020-10-21","18:00:00",""
"7056647","16.245","0.003","14.013","0.003","20.618","0.004","90","","93.493","0.004","90","","4684.8","1.6","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H40 F12 N8 Ni P2 -","- C40 H40 F12 N8 Ni P2 -","- C160 H160 F48 N32 Ni4 P8 -","4","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.1457","0.0628","","","0.1101","0.1332","","","","","","1.04","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056648","12.775","0.0011","14.4409","0.0013","16.4321","0.0014","78.288","0.003","71.501","0.003","63.775","0.001","2571.8","0.4","190","2","190","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H48 F12 N8 Ni P2 -","- C44 H48 F12 N8 Ni P2 -","- C88 H96 F24 N16 Ni2 P4 -","2","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.1678","0.0829","","","0.2113","0.259","","","","","","1.038","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056649","13.4115","0.0008","14.8836","0.0008","15.868","0.0008","92.478","0.002","112.811","0.002","116.642","0.001","2517.5","0.2","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H44 F12 N8 P2 Pt -","- C42 H44 F12 N8 P2 Pt -","- C84 H88 F24 N16 P4 Pt2 -","2","1","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.0666","0.048","","","0.094","0.0995","","","","","","1.036","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056650","31.573","0.002","43.5","0.003","45.318","0.003","90","","90","","90","","62241","7","120","2","120","2","","","","","","","","6","F d d d","-F 2uv 2vw","70","","","","- C264 H288 Ag12 F72 N48 P12 -","- C264 H288 Ag12 F72 N48 P12 -","- C2112 H2304 Ag96 F576 N384 P96 -","8","","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.1189","0.0973","","","0.2627","0.2792","","","","","","0.991","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056651","20.0846","0.0007","20.0846","0.0007","38.506","0.002","90","","90","","90","","15533","1.1","153","2","153","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C44 H48 F12 N8 P2 Pd -","- C44 H48 F12 N8 P2 Pd -","- C528 H576 F144 N96 P24 Pd12 -","12","1.5","","Fei, Fan; Lu, Taotao; Chen, Xue-tai; Xue, Ziling Ben","Synthesis and structural characterization of metal complexes with macrocyclic tetracarbene ligands","New J. Chem.","2017","","","","","10.1039/C7NJ02485A","","","0.71073","MoKα","","0.0802","0.0663","","","0.1685","0.1758","","","","","","1.097","","","","has coordinates,has disorder","201497","2020-10-21","18:00:00",""
"7056652","26.301","0.002","18.6381","0.0015","22.7995","0.0016","90","","107.972","0.005","90","","10631","1.4","200","2","200","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C124 H168 -","- C124 H168 -","- C496 H672 -","4","1","","Yu, Chin-Yang; Chen, Yu-Chi; Wang, Chao-Chi","Synthesis and Ring Opening Reaction of Octaoctyl Substituted [2.2.2.2](2,7)-Fluorenophanetetraene by Photooxidation","New J. Chem.","2017","","","","","10.1039/C7NJ02735D","","","0.71073","MoKα","","0.318","0.0975","","","0.2346","0.3416","","","","","","0.902","","","","has coordinates,has disorder","201583","2020-10-21","18:00:00",""
"7056653","13.0587","0.0007","11.2253","0.0006","17.2297","0.0008","90","","120.987","0.003","90","","2165.2","0.2","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H25 N2 O16 Tb -","- C15 H25 N2 O16 Tb -","- C60 H100 N8 O64 Tb4 -","4","1","","Feyisa Bogale, Raji; Chen, Yanzhen; Ye, Junwei; Zhang, Siqi; Li, Yiwen; Liu, Xigang; Zheng, Ting; Rauf, Abdul; Ning, Guiling","A terbium(iii)-based coordination polymer for selective and sensitive sensing of nitroaromatics and ferric ion: synthesis, crystal structure and photoluminescence properties","New J. Chem.","2017","","","","","10.1039/C7NJ02492D","","","0.71073","MoKα","","0.0336","0.0255","","","0.0631","0.069","","","","","","1.039","","","","has coordinates","201584","2020-10-21","18:00:00",""
"7056654","28.3225","0.0015","9.7812","0.0005","18.605","0.0009","90","","110.718","0.002","90","","4820.8","0.4","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H44 Cu2 N2 P4 S2 -","- C54 H44 Cu2 N2 P4 S2 -","- C216 H176 Cu8 N8 P16 S8 -","4","0.5","","Trivedi, Manoj; Smreker, Jacob Robert; Singh, Gurmeet; Kumar, Abhinav; Rath, Nigam P.","cis-1,2-bis(diphenylphosphino)ethylene copper(I) catalyzed C-H activation and carboxylation of terminal alkynes","New J. Chem.","2017","","","","","10.1039/C7NJ03038J","","","0.71073","MoKα","","0.0803","0.042","","","0.0817","0.096","","","","","","1.023","","","","has coordinates","201680","2020-10-21","18:00:00",""
"7056655","20.0996","0.0003","11.2677","0.0002","20.9221","0.0004","90","","96.228","0.002","90","","4710.39","0.14","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C58 H45 Cl N2 P2 Pt2 -","- C58 H45 Cl N2 P2 Pt2 -","- C232 H180 Cl4 N8 P8 Pt8 -","4","1","","Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Kubicki, Maciej; Rashidi, Mehdi","Photophysical Study on Unsymmetrical Binuclear Cycloplatinated(II) Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03034G","","","0.7107","MoKα","","0.0488","0.0322","","","0.053","0.0568","","","","","","0.96","","","","has coordinates","201681","2020-10-21","18:00:00",""
"7056656","33.725","0.0002","11.0882","0.0001","26.5368","0.0002","90","","92.967","0.001","90","","9910.12","0.13","130","1","130","1","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C117 H90 Cl2 F6 N4 O4 P4 Pt4 -","- C117 H90 Cl2 F6 N4 O4 P4 Pt4 -","- C468 H360 Cl8 F24 N16 O16 P16 Pt16 -","4","0.5","","Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Kubicki, Maciej; Rashidi, Mehdi","Photophysical Study on Unsymmetrical Binuclear Cycloplatinated(II) Complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03034G","","","1.5418","CuKα","","0.0377","0.0377","","","0.1361","0.1361","","","","","","1.27","","","","has coordinates,has disorder","201681","2020-10-21","18:00:00",""
"7056657","10.9965","0.0006","11.8076","0.0008","13.2007","0.0007","90","","92.894","0.005","90","","1711.82","0.17","295.2","0.3","295.2","0.3","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1","","- C24 H16 O2 -","- C24 H16 O2 -","- C96 H64 O8 -","4","1","","Kong, Qunshou; Zhuang, Weihua; Li, Gaocan; Xu, Yangyang; Jiang, Qing; Wang, Yunbing","High contrast stimuli-responsive luminescence switching of pyrene-1-carboxylic esters triggered by a crystal-to-crystal transition","New J. Chem.","2017","","","","","10.1039/C7NJ03014B","","x-ray","1.54184","CuKα","","0.0673","0.0556","","","0.1581","0.173","","","","","","1.028","","","","has coordinates","201682","2020-10-21","18:00:00",""
"7056658","5.4969","0.0003","10.735","0.0007","22.1474","0.0012","90","","90","","90","","1306.9","0.13","293","2","293.15","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","lgc-127","","- C18 H12 O2 -","- C18 H12 O2 -","- C72 H48 O8 -","4","1","","Kong, Qunshou; Zhuang, Weihua; Li, Gaocan; Xu, Yangyang; Jiang, Qing; Wang, Yunbing","High contrast stimuli-responsive luminescence switching of pyrene-1-carboxylic esters triggered by a crystal-to-crystal transition","New J. Chem.","2017","","","","","10.1039/C7NJ03014B","","x-ray","0.71073","MoKα","","0.0651","0.045","","","0.0885","0.1018","","","","","","1.084","","","","has coordinates","201682","2020-10-21","18:00:00",""
"7056659","9.6985","0.0007","11.4602","0.0009","14.9575","0.0012","80.519","0.004","73.258","0.004","76.892","0.004","1541.7","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","rotaxane","","","- C31 H33 Cl N5 O4 -","- C31 H33 Cl N5 O4 -","- C62 H66 Cl2 N10 O8 -","2","1","","Martins, Marcos A. P.; Zimmer, Geórgia Cristiane; Rodrigues, Leticia V.; Orlando, Tainára; Buriol, Lilian; Alajarin, Mateo; Berna, Jose; Frizzo, Clarissa Piccinin; Bonacorso, Helio Gauze; Zanatta, Nilo","Competition Between the Donor and Acceptor Hydrogen Bonds of the Threads in the Formation of [2]Rotaxane by Clipping Reaction","New J. Chem.","2017","","","","","10.1039/C7NJ02443F","","","0.71073","MoKα","","0.0676","0.0506","","","0.1417","0.1495","","","","","","1.082","","","","has coordinates","201683","2020-10-21","18:00:00",""
"7056660","6.9687","0.0003","12.1818","0.0006","16.6042","0.0009","90","","99.584","0.002","90","","1389.88","0.12","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","thread 1,3-pyrazole","'1,2-bis(aminocarbonyl-(5'-phenyl)-(1'-tert-butyl)-1H-pyrazole-3'-il)-ethane'","","- C30 H36 N6 O2 -","- C30 H36 N6 O2 -","- C60 H72 N12 O4 -","2","0.5","","Martins, Marcos A. P.; Zimmer, Geórgia Cristiane; Rodrigues, Leticia V.; Orlando, Tainára; Buriol, Lilian; Alajarin, Mateo; Berna, Jose; Frizzo, Clarissa Piccinin; Bonacorso, Helio Gauze; Zanatta, Nilo","Competition Between the Donor and Acceptor Hydrogen Bonds of the Threads in the Formation of [2]Rotaxane by Clipping Reaction","New J. Chem.","2017","","","","","10.1039/C7NJ02443F","","","0.71073","MoKα","","0.066","0.0506","","","0.1384","0.1538","","","","","","1.057","","","","has coordinates","201683","2020-10-21","18:00:00",""
"7056661","26.6417","0.0008","11.3041","0.0003","9.7939","0.0002","90","","91.318","0.002","90","","2948.75","0.13","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,5-thread-p-Ph-Cl","'1,2-bis(aminocarbonyl-(3'-(4""-chlorophenyl)-1'- (1',1'-tert-butyl)-1H-pyrazole-5'-il))-ethane'","","- C15 H17 Cl N3 O -","- C15 H17 Cl N3 O -","- C120 H136 Cl8 N24 O8 -","8","1","","Martins, Marcos A. P.; Zimmer, Geórgia Cristiane; Rodrigues, Leticia V.; Orlando, Tainára; Buriol, Lilian; Alajarin, Mateo; Berna, Jose; Frizzo, Clarissa Piccinin; Bonacorso, Helio Gauze; Zanatta, Nilo","Competition Between the Donor and Acceptor Hydrogen Bonds of the Threads in the Formation of [2]Rotaxane by Clipping Reaction","New J. Chem.","2017","","","","","10.1039/C7NJ02443F","","","0.71073","MoKα","","0.0485","0.0387","","","0.1041","0.1112","","","","","","1.052","","","","has coordinates","201683","2020-10-21","18:00:00",""
"7056662","13.0096","0.001","18.5432","0.0014","12.0412","0.0009","90","","100.744","0.003","90","","2853.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","thread-1,5-fenil","'1,2-bis(aminocarbonyl-(3'-phenyl)-(1'(tert-butyl)-1H-pyrazole-5'-il)ethane'","","- C30 H36 N6 O2 -","- C30 H36 N6 O2 -","- C120 H144 N24 O8 -","4","1","","Martins, Marcos A. P.; Zimmer, Geórgia Cristiane; Rodrigues, Leticia V.; Orlando, Tainára; Buriol, Lilian; Alajarin, Mateo; Berna, Jose; Frizzo, Clarissa Piccinin; Bonacorso, Helio Gauze; Zanatta, Nilo","Competition Between the Donor and Acceptor Hydrogen Bonds of the Threads in the Formation of [2]Rotaxane by Clipping Reaction","New J. Chem.","2017","","","","","10.1039/C7NJ02443F","","","1.54178","CuKα","","0.1086","0.0996","","","0.3381","0.3454","","","","","","1.176","","","","has coordinates","201683","2020-10-21","18:00:00",""
"7056663","6.6195","0.0013","8.2505","0.0019","12.924","0.005","96.15","0.03","99.794","0.018","97.771","0.014","683","0.3","296","2","296","2","","","","","","","N-cyanoguanidine","5","P -1","-P 1","2","2-carbamoylguanidinium p-toluensulfonate","N-carbamoylguanidinium p-toluensulfonate","","- C9 H14 N4 O4 S -","- C9 H14 N4 O4 S -","- C18 H28 N8 O8 S2 -","2","1","","Fernández-Stefanuto, V.; Verdía, P.; Tojo, E.","A new procedure to obtain ε-caprolactam catalyzed by a guanidinium salt","New J. Chem.","2017","","","","","10.1039/C7NJ03443A","","","1.54178","CuKα","","0.068","0.0573","","","0.1658","0.1763","","","","","","1.069","","","","has coordinates","201684","2020-10-21","18:00:00",""
"7056664","5.7367","0.0006","7.4012","0.0008","21.041","0.002","90","","91.012","0.002","90","","893.23","0.16","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H34 I N -","- C15 H34 I N -","- C30 H68 I2 N2 -","2","1","","Roitershtein, Dmitrii M.; Puntus, Lada N.; Lyssenko, Konstantin A.; Taidakov, Ilya V.; Varaksina, Evgenia; Minyaev, Mikhail M.; Gerasin, Viktor Anatol'evich; Guseva, Maria A.; Vinogradov, Alexey V.; Savchenko, Maria S.; Nifant'ev, Ilya E.","An efficient route for design of luminescent composite materials based on polyethylene containing europium dibenzoylmethanate","New J. Chem.","2017","","","","","10.1039/C7NJ03055J","","","0.71073","MoKα","","0.0344","0.0276","","","0.0587","0.0622","","","","","","1.04","","","","has coordinates,has disorder","201685","2020-10-21","18:00:00",""
"7056665","25.835","0.002","8.3357","0.0008","25.37","0.002","90","","90.106","0.0019","90","","5463.5","0.8","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C64 H56 Eu Na O10 -","- C64 H56 Eu Na O10 -","- C256 H224 Eu4 Na4 O40 -","4","1","","Roitershtein, Dmitrii M.; Puntus, Lada N.; Lyssenko, Konstantin A.; Taidakov, Ilya V.; Varaksina, Evgenia; Minyaev, Mikhail M.; Gerasin, Viktor Anatol'evich; Guseva, Maria A.; Vinogradov, Alexey V.; Savchenko, Maria S.; Nifant'ev, Ilya E.","An efficient route for design of luminescent composite materials based on polyethylene containing europium dibenzoylmethanate","New J. Chem.","2017","","","","","10.1039/C7NJ03055J","","","0.71073","MoKα","","0.0502","0.0381","","","0.0773","0.0824","","","","","","0.977","","","","has coordinates,has disorder","201685","2020-10-21","18:00:00",""
"7056666","13.9894","0.0006","17.6752","0.0007","19.1128","0.0008","90","","90","","90","","4725.9","0.3","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C54 H61 B Ir N2 O3 P -","- C54 H61 B Ir N2 O3 P -","- C216 H244 B4 Ir4 N8 O12 P4 -","4","1","","Albertin, Gabriele; Antoniutti, Stefano; Bortoluzzi, Marco; Castro, Jesús; Sibilla, Francesca; Trave, Enrico","Preparation of metalated azine complexes of iridium(iii)","New J. Chem.","2017","","","","","10.1039/C7NJ02224G","","","0.71073","MoKα","","0.0244","0.0217","","","0.039","0.0398","","","","","","1.067","","","","has coordinates","201880","2020-10-21","18:00:00",""
"7056667","8.8062","0.0018","17.518","0.004","8.1176","0.0016","90","","103.15","0.03","90","","1219.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 N5 O5 -","- C10 H11 N5 O5 -","- C40 H44 N20 O20 -","4","1","","Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang","Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ03445H","","","0.71073","MoKα","","0.1555","0.0875","","","0.1798","0.2043","","","","","","1.169","","","","has coordinates","201881","2020-10-21","18:00:00",""
"7056668","4.2","0.0008","8.507","0.0017","17.069","0.003","90","","94.05","0.03","90","","608.3","0.2","293","2","293","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C10 H11 N5 O5 -","- C10 H11 N5 O5 -","- C20 H22 N10 O10 -","2","1","","Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang","Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ03445H","","","0.71073","MoKα","","0.0458","0.0404","","","0.1162","0.1226","","","","","","1.001","","","","has coordinates","201881","2020-10-21","18:00:00",""
"7056669","4.419","0.0009","8.581","0.0017","17.499","0.004","90","","91.35","0.03","90","","663.4","0.2","293","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C10 H11 Cl N4 O6 -","- C10 H11 Cl N4 O6 -","- C20 H22 Cl2 N8 O12 -","2","1","","Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang","Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ03445H","","","0.71073","MoKα","","0.0681","0.0553","","","0.1418","0.153","","","","","","1.08","","","","has coordinates","201881","2020-10-21","18:00:00",""
"7056670","21.2012","0.0014","7.069","0.003","17.137","","90","","90","","90","","2568.3","1.1","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C20 H25 N8 O9 P -","- C20 H25 N8 O9 P -","- C80 H100 N32 O36 P4 -","4","1","","Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang","Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ03445H","","","0.71073","MoKα","","0.1354","0.0923","","","0.2198","0.244","","","","","","1.069","","","","has coordinates","201881","2020-10-21","18:00:00",""
"7056671","8.011","0.0016","11.071","0.002","13.968","0.003","100.75","0.03","91.99","0.03","108.46","0.03","1148.6","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H21 Cl N8 O8 -","- C20 H21 Cl N8 O8 -","- C40 H42 Cl2 N16 O16 -","2","1","","Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang","Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ03445H","","","0.71073","MoKα","","0.0863","0.0581","","","0.1522","0.1712","","","","","","1.059","","","","has coordinates","201881","2020-10-21","18:00:00",""
"7056672","4.4091","0.0009","8.6022","0.0017","17.525","0.004","90","","91.34","0.03","90","","664.5","0.2","293","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C10 H13 N4 O6 P -","- C10 H13 N4 O6 P -","- C20 H26 N8 O12 P2 -","2","1","","Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang","Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ03445H","","","0.71073","MoKα","","0.075","0.0558","","","0.1205","0.1404","","","","","","0.995","","","","has coordinates","201881","2020-10-21","18:00:00",""
"7056673","5.422","0.0011","10.436","0.002","17.944","0.004","90","","91.2","0.03","90","","1015.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 N4 O2 -","- C10 H10 N4 O2 -","- C40 H40 N16 O8 -","4","1","","Wang, Jin-Wen; Li, Yao-Jia; Chen, Chen; Luo, Yang-Hui; Sun, Baiwang","Substituent swap affect the crystal structure and properties of N-benzyl-4-amino-1, 2, 4-triazole related organic salts","New J. Chem.","2017","","","","","10.1039/C7NJ03445H","","","0.71073","MoKα","","0.1","0.0561","","","0.1331","0.1581","","","","","","1.002","","","","has coordinates","201881","2020-10-21","18:00:00",""
"7056674","5.835","0.0004","8.6412","0.0006","15.4578","0.001","85.662","0.001","83.585","0.001","86.652","0.001","771.32","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 Cl O S2 -","- C15 H17 Cl O S2 -","- C30 H34 Cl2 O2 S4 -","2","1","","Kurva, Srinivas; Sriramoju, Vinodkumar; Madabhushi, Sridhar; Nanubolu, Jagadeesh Babu","Synthesis of polysubstituted 3,4-dihydro-2H-thiopyrans by regioselective annulation of 3,3-disubstituted allylic alcohols with a β-oxodithioester","New J. Chem.","2017","","","","","10.1039/C7NJ03025H","","","0.71073","MoKα","","0.0404","0.0376","","","0.1039","0.1066","","","","","","1.07","","","","has coordinates","201882","2020-10-21","18:00:00",""
"7056675","11.3734","0.0005","7.9651","0.0003","15.65","0.0007","90","","94.572","0.002","90","","1413.23","0.1","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 4',6'-dimethyl-2-oxo-2H-[1,2'-bipyridine]-5-carboxylate","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C60 H64 N8 O12 -","4","1","","Akhtar, Muhammad Saeed; Shim, Jae-Jin; Kim, Sung Hong; Lee, Yong Rok","Novel construction of diversely functionalized N-heteroaryl-2-pyridones via copper(ii)-catalyzed [3+2+1] annulation","New J. Chem.","2017","","","","","10.1039/C7NJ03013D","","","0.71073","MoKα","","0.0763","0.0459","","","0.1101","0.1283","","","","","","1.038","","","","has coordinates","201883","2020-10-21","18:00:00",""
"7056676","13.1184","0.0006","12.6369","0.0005","32.3036","0.0012","90","","96.168","0.004","90","","5324.2","0.4","293","2","293","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C32 H113 Er Ge2 Mo22 N8 O100 -","- C20 H50 Er Ge2 Mo22 N5 O83 -","- C40 H100 Er2 Ge4 Mo44 N10 O166 -","2","1","","Jin, Zhanbin; Bai, Jie; Wei, Tingting; Li, Fengyan; Song, Chunli; Luo, Xinze; Xu, Lin","New series of mononuclear lanthanide single molecule magnets based on sandwich-type germanomolybdates [Ln(GeMo11O39)2]13- (Ln = ErIII, GdIII, DyIII or TbIII)","New J. Chem.","2017","","","","","10.1039/C7NJ02104F","","","0.71073","MoKα","","0.053","0.0452","","","0.1032","0.1082","","","","","","1.013","","","","has coordinates","201884","2020-10-21","18:00:00",""
"7056677","13.2175","0.0003","12.7258","0.0004","32.5224","0.001","90","","96.203","0.003","90","","5438.3","0.3","293","2","293","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C32 H111 Gd Ge2 Mo22 N8 O99 -","- C28 H68 Gd Ge2 Mo22 N7 O85 -","- C56 H136 Gd2 Ge4 Mo44 N14 O170 -","2","1","","Jin, Zhanbin; Bai, Jie; Wei, Tingting; Li, Fengyan; Song, Chunli; Luo, Xinze; Xu, Lin","New series of mononuclear lanthanide single molecule magnets based on sandwich-type germanomolybdates [Ln(GeMo11O39)2]13- (Ln = ErIII, GdIII, DyIII or TbIII)","New J. Chem.","2017","","","","","10.1039/C7NJ02104F","","","0.71073","MoKα","","0.0409","0.0391","","","0.1007","0.1023","","","","","","1.024","","","","has coordinates","201884","2020-10-21","18:00:00",""
"7056678","13.2127","0.0003","12.7291","0.0003","32.5182","0.001","90","","96.158","0.002","90","","5437.5","0.2","293","2","293","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C32 H115 Dy Ge2 Mo22 N8 O101 -","- C24 H56 Dy Ge2 Mo22 N6 O84 -","- C48 H112 Dy2 Ge4 Mo44 N12 O168 -","2","1","","Jin, Zhanbin; Bai, Jie; Wei, Tingting; Li, Fengyan; Song, Chunli; Luo, Xinze; Xu, Lin","New series of mononuclear lanthanide single molecule magnets based on sandwich-type germanomolybdates [Ln(GeMo11O39)2]13- (Ln = ErIII, GdIII, DyIII or TbIII)","New J. Chem.","2017","","","","","10.1039/C7NJ02104F","","","0.71073","MoKα","","0.0417","0.0399","","","0.111","0.1129","","","","","","1.04","","","","has coordinates","201884","2020-10-21","18:00:00",""
"7056679","13.2174","0.0006","12.7175","0.0006","32.4095","0.0014","90","","96.294","0.004","90","","5415","0.4","293","2","293","2","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C32 H113 Ge2 Mo22 N8 O100 Tb -","- C28 H56 Ge2 Mo22 N7 O85 Tb -","- C56 H112 Ge4 Mo44 N14 O170 Tb2 -","2","1","","Jin, Zhanbin; Bai, Jie; Wei, Tingting; Li, Fengyan; Song, Chunli; Luo, Xinze; Xu, Lin","New series of mononuclear lanthanide single molecule magnets based on sandwich-type germanomolybdates [Ln(GeMo11O39)2]13- (Ln = ErIII, GdIII, DyIII or TbIII)","New J. Chem.","2017","","","","","10.1039/C7NJ02104F","","","0.71073","MoKα","","0.0382","0.0363","","","0.0962","0.0977","","","","","","1.023","","","","has coordinates","201884","2020-10-21","18:00:00",""
"7056680","9.5639","0.0005","29.929","0.0012","10.7888","0.0005","90","","116.105","0.006","90","","2773.1","0.3","100.01","0.1","100.01","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H29 N6 Ni O3.75 S -","- C30 H29.606 N6 Ni O3.803 S -","- C120 H118.424 N24 Ni4 O15.212 S4 -","4","1","","Vereshchagin, Anatoliy A.; Sizov, Vladimir; Vlasov, Petr; Alekseeva, Elena V.; Konev, Alexander S.; Levin, Oleg V.","Water-stable [Ni(salen)]-type electrode material based on phenylazosubstituted salicylic aldehyde imine ligand","New J. Chem.","2017","","","","","10.1039/C7NJ03526H","","x-ray","1.54184","CuKα","","0.0634","0.0549","","","0.1377","0.1469","","","","","","1.043","","","","has coordinates,has disorder","201907","2020-10-21","18:00:00",""
"7056681","18.2388","0.0001","51.6192","0.0004","20.9479","0.0002","90","","102.414","0.0003","90","","19260.7","0.3","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C128 N15 O69 Si2 W20 Zn -","- C128 N15 O69 Si2 W20 Zn -","- C512 N60 O276 Si8 W80 Zn4 -","4","1","","Jeong, Jinu; Suzuki, Kosuke; Yamaguchi, Kazuya; Mizuno, Noritaka","Visible-light-responsive catalysis of a zinc-introduced lacunary disilicoicosatungstate for deoxygenation of pyridine N-oxides","New J. Chem.","2017","","","","","10.1039/C7NJ03057F","","","0.71069","MoKα","","0.0932","0.0777","","","0.1782","0.191","","","","","","1.2","","","","has coordinates","201937","2020-10-21","18:00:00",""
"7056682","23.021","0.005","16.305","0.003","24.931","0.005","90","","108.69","0.03","90","","8865","3","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C76 H70 Ca Cl14 Mo6 N2 O6 P4 -","- C76 H70 Ca Cl14 Mo6 N2 O6 P4 -","- C304 H280 Ca4 Cl56 Mo24 N8 O24 P16 -","4","0.5","","Evtushok, Darya V.; Vorotnikova, Natalya A.; Logvinenko, Vladimir A.; Smolentsev, Anton I.; Brylev, Konstantin; Plyusnin, Pavel E.; Pishchur, Denis P.; Kitamura, N.; Mironov, Yuri V.; Solovieva, Anastasiya O.; Efremova, Olga A.; Shestopalov, Michael A.","Luminescent Coordination Polymers Based on Ca2+ and Octahedral Cluster Anions [{M6Cli8}Cla6]2‒ (M = Mo, W): Synthesis and Thermal Stability Studies","New J. Chem.","2017","","","","","10.1039/C7NJ02858J","","","0.71073","MoKα","","0.0607","0.0331","","","0.0757","0.0829","","","","","","1.023","","","","has coordinates","202014","2020-10-21","18:00:00",""
"7056683","25.3726","0.001","14.1362","0.0006","24.2685","0.0011","90","","113.212","0.001","90","","7999.8","0.6","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C72 H60 Ca Cl14 O4 P4 W6 -","- C72 H60 Ca Cl14 O4 P4 W6 -","- C288 H240 Ca4 Cl56 O16 P16 W24 -","4","0.5","","Evtushok, Darya V.; Vorotnikova, Natalya A.; Logvinenko, Vladimir A.; Smolentsev, Anton I.; Brylev, Konstantin; Plyusnin, Pavel E.; Pishchur, Denis P.; Kitamura, N.; Mironov, Yuri V.; Solovieva, Anastasiya O.; Efremova, Olga A.; Shestopalov, Michael A.","Luminescent Coordination Polymers Based on Ca2+ and Octahedral Cluster Anions [{M6Cli8}Cla6]2‒ (M = Mo, W): Synthesis and Thermal Stability Studies","New J. Chem.","2017","","","","","10.1039/C7NJ02858J","","","0.71073","MoKα","","0.0707","0.0367","","","0.0739","0.0818","","","","","","0.98","","","","has coordinates","202014","2020-10-21","18:00:00",""
"7056684","22.955","0.005","16.219","0.003","24.818","0.005","90","","108.58","0.03","90","","8758","3","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C76 H70 Ca Cl14 N2 O6 P4 W6 -","- C76 H70 Ca Cl14 N2 O6 P4 W6 -","- C304 H280 Ca4 Cl56 N8 O24 P16 W24 -","4","0.5","","Evtushok, Darya V.; Vorotnikova, Natalya A.; Logvinenko, Vladimir A.; Smolentsev, Anton I.; Brylev, Konstantin; Plyusnin, Pavel E.; Pishchur, Denis P.; Kitamura, N.; Mironov, Yuri V.; Solovieva, Anastasiya O.; Efremova, Olga A.; Shestopalov, Michael A.","Luminescent Coordination Polymers Based on Ca2+ and Octahedral Cluster Anions [{M6Cli8}Cla6]2‒ (M = Mo, W): Synthesis and Thermal Stability Studies","New J. Chem.","2017","","","","","10.1039/C7NJ02858J","","","0.71073","MoKα","","0.0756","0.0616","","","0.1328","0.1471","","","","","","0.985","","","","has coordinates","202014","2020-10-21","18:00:00",""
"7056685","8.871","0.0007","16.8165","0.0014","21.3749","0.0014","90","","114.521","0.002","90","","2901.1","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H40 B Cu F4 N8 -","- C24 H40 B Cu F4 N8 -","- C96 H160 B4 Cu4 F16 N32 -","4","1","","Melekhova, Anna A.; Novikov, Alexander S.; Panikorovsky, Taras L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu.","Novel Family of Homoleptic Copper(I) Complexes Featuring Disubstituted Cyanamides: Combined Synthetic, Structural, and Theoretical Study","New J. Chem.","2017","","","","","10.1039/C7NJ02798B","","","0.71073","MoKα","","0.0524","0.042","","","0.1024","0.1082","","","","","","1.079","","","","has coordinates","202048","2020-10-21","18:00:00",""
"7056686","9.8926","0.0002","17.9661","0.0003","15.057","0.0002","90","","91.906","0.002","90","","2674.62","0.08","100","2","100","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C20 H32 B Cu F4 N8 O4 -","- C20 H32 B Cu F4 N8 O4 -","- C80 H128 B4 Cu4 F16 N32 O16 -","4","2","","Melekhova, Anna A.; Novikov, Alexander S.; Panikorovsky, Taras L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu.","Novel Family of Homoleptic Copper(I) Complexes Featuring Disubstituted Cyanamides: Combined Synthetic, Structural, and Theoretical Study","New J. Chem.","2017","","","","","10.1039/C7NJ02798B","","","0.71073","MoKα","","0.0274","0.0251","","","0.0604","0.0618","","","","","","1.028","","","","has coordinates","202048","2020-10-21","18:00:00",""
"7056687","12.423","0.0004","12.423","0.0004","26.376","0.002","90","","90","","90","","4070.6","0.4","100","2","100","2","","","","","","","","6","I -4 2 d","I -4 2bw","122","","","","- C12 H24 B Cu F4 N8 -","- C12 H24 B Cu F4 N8 -","- C96 H192 B8 Cu8 F32 N64 -","8","0.5","","Melekhova, Anna A.; Novikov, Alexander S.; Panikorovsky, Taras L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu.","Novel Family of Homoleptic Copper(I) Complexes Featuring Disubstituted Cyanamides: Combined Synthetic, Structural, and Theoretical Study","New J. Chem.","2017","","","","","10.1039/C7NJ02798B","","","0.71073","MoKα","","0.0274","0.0218","","","0.0528","0.0557","","","","","","1.142","","","","has coordinates","202048","2020-10-21","18:00:00",""
"7056688","10.0889","0.0013","12.1516","0.0015","13.1028","0.0018","105.885","0.003","98.459","0.004","98.029","0.004","1500.6","0.3","123","2","123","2","","","","","","","","8","P -1","-P 1","2","","[Fe(qsal-Cl)(qsal-Br)]NCS MeOH","","- C34 H24 Br Cl Fe N5 O3 S -","- C34 H24 Br Cl Fe N5 O3 S -","- C68 H48 Br2 Cl2 Fe2 N10 O6 S2 -","2","1","","Phonsri, Wasinee; Harding, Phimphaka; Murray, Keith S.; Moubaraki, Boujemaa; Harding, David J.","Spin crossover in mixed ligand iron(III) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03676K","","","0.71073","MoKα","","0.1044","0.0903","","","0.2435","0.2518","","","","","","1.08","","","","has coordinates,has disorder","202145","2020-10-21","18:00:00",""
"7056689","13.6206","0.0005","13.6929","0.0005","16.2779","0.0006","112.954","0.002","96.785","0.002","110.518","0.002","2501.27","0.18","123","2","123","2","","","","","","","","8","P -1","-P 1","2","","","","- C58 H44 B Br Cl5 Fe N4 O2 -","- C58 H44 B Br Cl5 Fe N4 O2 -","- C116 H88 B2 Br2 Cl10 Fe2 N8 O4 -","2","1","","Phonsri, Wasinee; Harding, Phimphaka; Murray, Keith S.; Moubaraki, Boujemaa; Harding, David J.","Spin crossover in mixed ligand iron(III) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03676K","","","0.71073","MoKα","","0.1152","0.0548","","","0.111","0.1331","","","","","","1.025","","","","has coordinates,has disorder","202145","2020-10-21","18:00:00",""
"7056690","14.0102","0.0007","19.1475","0.0009","12.2634","0.0005","90","","111.177","0.001","90","","3067.6","0.2","123","2","123","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","[Fe(qsal-Cl)(qsal-Br)]CF3SO3","","- C33.5 H20.5 Br Cl F3 Fe N4 O5.5 S -","- C33.5 H20.5 Br Cl F3 Fe N4 O5.5 S -","- C134 H82 Br4 Cl4 F12 Fe4 N16 O22 S4 -","4","1","","Phonsri, Wasinee; Harding, Phimphaka; Murray, Keith S.; Moubaraki, Boujemaa; Harding, David J.","Spin crossover in mixed ligand iron(III) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03676K","","","0.71073","MoKα","","0.0812","0.0534","","","0.1366","0.1522","","","","","","1.049","","","","has coordinates,has disorder","202145","2020-10-21","18:00:00",""
"7056691","13.719","0.002","14.012","0.003","16.606","0.005","113.81","0.02","96.164","0.018","110.831","0.019","2609.4","1.3","267","9","267","9","","","","","","","","8","P -1","-P 1","2","","[Fe(qsal-Cl)(qsal-Br)]BPh4","","- C58 H44 B Br Cl5 Fe N4 O2 -","- C58 H44 B Br Cl5 Fe N4 O2 -","- C116 H88 B2 Br2 Cl10 Fe2 N8 O4 -","2","1","","Phonsri, Wasinee; Harding, Phimphaka; Murray, Keith S.; Moubaraki, Boujemaa; Harding, David J.","Spin crossover in mixed ligand iron(III) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03676K","","","0.7107","MoKα","","0.193","0.0869","","","0.2265","0.3093","","","","","","0.948","","","","has coordinates,has disorder","202145","2020-10-21","18:00:00",""
"7056692","10.3803","0.0006","12.557","0.0007","23.1729","0.0014","86.246","0.003","81.312","0.003","89.492","0.003","2979.4","0.3","123","2","123","2","","","","","","","","9","P -1","-P 1","2","","[Fe(qsal-Cl)(qsal-Br)]PF6","","- C32 H20 Br Cl F6 Fe N4 O2 P -","- C32 H20 Br Cl F6 Fe N4 O2 P -","- C128 H80 Br4 Cl4 F24 Fe4 N16 O8 P4 -","4","2","","Phonsri, Wasinee; Harding, Phimphaka; Murray, Keith S.; Moubaraki, Boujemaa; Harding, David J.","Spin crossover in mixed ligand iron(III) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03676K","","","0.71073","MoKα","","0.167","0.0552","","","0.0752","0.0953","","","","","","0.76","","","","has coordinates,has disorder","202145","2020-10-21","18:00:00",""
"7056693","13.5484","0.0008","13.5845","0.0006","16.3212","0.001","97.29","0.004","112.892","0.005","109.908","0.005","2482.6","0.3","100.01","0.1","100.01","0.1","","","","","","","","8","P -1","-P 1","2","","[Fe(qsal-Cl)(qsal-Br)]BPh4","","- C58 H44 B Br Cl5 Fe N4 O2 -","- C58 H44 B Br Cl5 Fe N4 O2 -","- C116 H88 B2 Br2 Cl10 Fe2 N8 O4 -","2","1","","Phonsri, Wasinee; Harding, Phimphaka; Murray, Keith S.; Moubaraki, Boujemaa; Harding, David J.","Spin crossover in mixed ligand iron(III) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03676K","","","0.7107","MoKα","","0.0826","0.0476","","","0.1042","0.122","","","","","","1.007","","","","has coordinates,has disorder","202145","2020-10-21","18:00:00",""
"7056694","11.8119","0.0004","13.0851","0.0004","13.4912","0.0004","90.401","0.001","91.035","0.001","107.506","0.002","1988.13","0.11","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H19 Cl2 Cu N3 O -","- C13 H19 Cl2 Cu N3 O -","- C52 H76 Cl8 Cu4 N12 O4 -","4","2","","Kumari, Sweta; Mahato, Arun Kumar; Maurya, Abhishek; Singh, Vijay Kumar; Kesharwani, Neha; Kachhap, Payal; Koshevoy, Igor O.; Haldar, Chanchal","Syntheses and characterization of monobasic tridentate Cu(ii) Schiff-base complexes for efficient oxidation of 3,5-di-tert-butylcatechol and oxidative bromination of organic substrates","New J. Chem.","2017","","","","","10.1039/C7NJ00957G","","","0.71073","MoKα","","0.0497","0.0327","","","0.0778","0.0839","","","","","","1.031","","","","has coordinates","202241","2020-10-21","18:00:00",""
"7056695","22.4034","0.0016","14.9191","0.0016","20.435","0.002","90","","113.618","0.004","90","","6258","1","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H74 Co7 N12 O22 S6 -","- C30 H54 Co7 N12 O12 S6 -","- C120 H216 Co28 N48 O48 S24 -","4","0.5","","Ahamad, M. Naqi; Sama, Farasha; Akhtar, Muhammad Nadeem; Chen, Yan-Cong; Tong, Mingliang; Ahmad, Musheer; Shahid, M.; Hussain, Sahid; Khan, Kulsum","A disc like Co7 cluster with solvent dependent catecholase activity","New J. Chem.","2017","","","","","10.1039/C7NJ03149A","","","0.71073","MoKα","","0.1268","0.0664","","","0.1514","0.1793","","","","","","1.027","","","","has coordinates","202242","2020-10-21","18:00:00",""
"7056696","13.66","0.03","19.02","0.04","10.88","0.02","90","","90","","90","","2827","10","273","2","273","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C16 H14 Fe N2 O2 -","- C16 H14 Fe N2 O2 -","- C128 H112 Fe8 N16 O16 -","8","2","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.0653","0.0445","","","0.0822","0.0898","","","","","","0.921","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056697","11.285","0.019","13.21","0.02","15.82","0.03","98.5","0.02","97.19","0.04","107.13","0.03","2193","6","273","2","273","2","","","","","","","","8","P -1","-P 1","2","","","","- C46 H39 Cl2 Co N2 O3 Pd S -","- C46 H39 Cl2 Co N2 O3 Pd S -","- C92 H78 Cl4 Co2 N4 O6 Pd2 S2 -","2","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.0566","0.0426","","","0.1035","0.1112","","","","","","1.005","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056698","11.024","0.011","20.65","0.02","14.762","0.011","90","","97.1","0.03","90","","3335","5","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C41 H30 Co N3 O2 Pd -","- C41 H30 Co N3 O2 Pd -","- C164 H120 Co4 N12 O8 Pd4 -","4","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.1168","0.0498","","","0.0634","0.0749","","","","","","0.724","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056699","12.92","0.04","14.34","0.04","17.16","0.06","90","","93.61","0.03","90","","3173","17","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C39 H29 Co N2 O2 -","- C39 H29 Co N2 O2 -","- C156 H116 Co4 N8 O8 -","4","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.0754","0.0438","","","0.0849","0.0924","","","","","","0.882","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056700","10.27","0.02","16.5","0.03","23.24","0.05","90","","90","","90","","3938","13","273","2","273","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C49 H35 Co N2 O Se -","- C49 H35 Co N2 O Se -","- C196 H140 Co4 N8 O4 Se4 -","4","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.1529","0.094","","","0.1256","0.1426","","","","","","1.064","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056701","10.257","0.002","11.746","0.002","18.873","0.004","96.25","0.03","92.91","0.03","94.13","0.03","2250.5","0.8","273","2","273","2","","","","","","","","8","P -1","-P 1","2","","","","- C48 H44 B Cl3 Co N O3 S -","- C48 H44 B Cl3 Co N O3 S -","- C96 H88 B2 Cl6 Co2 N2 O6 S2 -","2","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.1639","0.0626","","","0.1201","0.1506","","","","","","0.776","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056702","11.64","0.05","13.37","0.05","13.68","0.06","65.93","0.1","78.53","0.07","77.94","0.07","1885","14","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H40 B Co N2 O3 -","- C45 H40 B Co N2 O3 -","- C90 H80 B2 Co2 N4 O6 -","2","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.096","0.0529","","","0.0901","0.1025","","","","","","0.832","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056703","13","0.03","13.25","0.03","23.77","0.05","84.63","0.02","86.64","0.02","72.88","0.03","3894","15","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H40 Co N O S Si -","- C44 H40 Co N O S Si -","- C176 H160 Co4 N4 O4 S4 Si4 -","4","2","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.0966","0.0559","","","0.1212","0.1339","","","","","","0.916","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056704","11.255","0.006","22.409","0.01","12.599","0.006","90","","90.186","0.016","90","","3178","3","304","2","304","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C41 H32 Co N O S -","- C41 H32 Co N O S -","- C164 H128 Co4 N4 O4 S4 -","4","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.0869","0.0467","","","0.1073","0.1237","","","","","","1.025","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056705","10.8","0.03","11.71","0.03","15.37","0.04","95.62","0.04","101.53","0.04","103.73","0.04","1828","8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H16 Fe N3 O2.5 Pd -","- C18 H16 Fe N3 O2.5 Pd -","- C72 H64 Fe4 N12 O10 Pd4 -","4","2","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.0816","0.05","","","0.1147","0.134","","","","","","0.931","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7056706","9.91","0.03","12.38","0.03","14.01","0.04","90","","90","","90","","1719","8","273","2","273","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H17 Fe N O S -","- C18 H17 Fe N O S -","- C72 H68 Fe4 N4 O4 S4 -","4","1","","Deb, Mayukh; Singh, Jatinder; Mallik, Shuvadip; Hazra, Susanta; Elias, Anil J.","Borylation, silylation and selenation of C-H bonds in metal sandwich compounds by applying a directing group strategy","New J. Chem.","2017","","","","","10.1039/C7NJ02388J","","","0.71073","MoKα","","0.0533","0.0377","","","0.0643","0.0687","","","","","","0.864","","","","has coordinates","202263","2020-10-21","18:00:00",""
"7056707","14.2613","0.0007","14.2613","0.0007","30.489","0.002","90","","90","","120","","5370.2","0.5","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C39 H28 Fe N6 O6.5 -","- C39 H27.9999 Fe N6 O6.5 -","- C234 H167.999 Fe6 N36 O39 -","6","0.333333","","Lee, Sze-Ling; Hu, Fei-long; Shang, Xiu-Juan; Shi, Yi-Xiang; Tan, Ai Ling; Mizera, Jens; Clegg, Jack Kay; Zhang, Wen-Hua; Young, David James; Lang, Jian-Ping","Efficient ring-opening polymerization (ROP) of ɛ-caprolactone catalysed by isomeric pyridyl β-diketonate iron(lll) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03571C","","","0.71073","MoKα","","0.1015","0.0751","","","0.2468","0.2725","","","","","","1.099","","","","has coordinates,has disorder","202295","2020-10-21","18:00:00",""
"7056708","10.5081","0.0012","12.0042","0.0018","16.4968","0.0018","77.517","0.003","73.321","0.003","75.069","0.003","1903.2","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C42.5 H35 Cl Fe N6 O6 -","- C42.5 H35 Cl Fe N6 O6 -","- C85 H70 Cl2 Fe2 N12 O12 -","2","1","","Lee, Sze-Ling; Hu, Fei-long; Shang, Xiu-Juan; Shi, Yi-Xiang; Tan, Ai Ling; Mizera, Jens; Clegg, Jack Kay; Zhang, Wen-Hua; Young, David James; Lang, Jian-Ping","Efficient ring-opening polymerization (ROP) of ɛ-caprolactone catalysed by isomeric pyridyl β-diketonate iron(lll) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03571C","","","0.71073","MoKα","","0.0745","0.0543","","","0.1233","0.1329","","","","","","1.045","","","","has coordinates,has disorder","202295","2020-10-21","18:00:00",""
"7056709","13.7398","0.0016","13.7398","0.0016","33.05","0.007","90","","90","","120","","5403.3","1.4","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C39 H28 Fe N6 O6.5 -","- C39 H27 Fe N6 O6.5 -","- C234 H162 Fe6 N36 O39 -","6","0.333333","","Lee, Sze-Ling; Hu, Fei-long; Shang, Xiu-Juan; Shi, Yi-Xiang; Tan, Ai Ling; Mizera, Jens; Clegg, Jack Kay; Zhang, Wen-Hua; Young, David James; Lang, Jian-Ping","Efficient ring-opening polymerization (ROP) of ɛ-caprolactone catalysed by isomeric pyridyl β-diketonate iron(lll) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03571C","","","0.71073","MoKα","","0.0836","0.0721","","","0.1807","0.19","","","","","","1.22","","","","has coordinates,has disorder","202295","2020-10-21","18:00:00",""
"7056710","10.6","0.003","12.147","0.004","16.59","0.005","77.32","0.009","73.287","0.009","74.385","0.009","1946.8","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H34 Fe N6 O6 -","- C42 H34 Fe N6 O6 -","- C84 H68 Fe2 N12 O12 -","2","1","","Lee, Sze-Ling; Hu, Fei-long; Shang, Xiu-Juan; Shi, Yi-Xiang; Tan, Ai Ling; Mizera, Jens; Clegg, Jack Kay; Zhang, Wen-Hua; Young, David James; Lang, Jian-Ping","Efficient ring-opening polymerization (ROP) of ɛ-caprolactone catalysed by isomeric pyridyl β-diketonate iron(lll) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03571C","","","0.71073","MoKα","","0.0928","0.0744","","","0.1914","0.2016","","","","","","1.058","","","","has coordinates,has disorder","202295","2020-10-21","18:00:00",""
"7056711","16.0478","0.0007","16.0478","0.0007","8.2848","0.0009","90","","90","","120","","1847.8","0.2","150","2","150","2","","","","","","","","5","P -3","-P 3","147","","","","- C39 H35 Fe N6 O10 -","- C39 H27 Fe N6 O10 -","- C78 H54 Fe2 N12 O20 -","2","0.333333","","Lee, Sze-Ling; Hu, Fei-long; Shang, Xiu-Juan; Shi, Yi-Xiang; Tan, Ai Ling; Mizera, Jens; Clegg, Jack Kay; Zhang, Wen-Hua; Young, David James; Lang, Jian-Ping","Efficient ring-opening polymerization (ROP) of ɛ-caprolactone catalysed by isomeric pyridyl β-diketonate iron(lll) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03571C","","","0.71073","MoKα","","0.0813","0.0512","","","0.1327","0.1506","","","","","","1.037","","","","has coordinates","202295","2020-10-21","18:00:00",""
"7056712","9.0163","0.0006","22.1308","0.0013","17.6843","0.0011","90","","91.643","0.006","90","","3527.2","0.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H27 Fe N6 O6 -","- C39 H27 Fe N6 O6 -","- C156 H108 Fe4 N24 O24 -","4","0.5","","Lee, Sze-Ling; Hu, Fei-long; Shang, Xiu-Juan; Shi, Yi-Xiang; Tan, Ai Ling; Mizera, Jens; Clegg, Jack Kay; Zhang, Wen-Hua; Young, David James; Lang, Jian-Ping","Efficient ring-opening polymerization (ROP) of ɛ-caprolactone catalysed by isomeric pyridyl β-diketonate iron(lll) complexes","New J. Chem.","2017","","","","","10.1039/C7NJ03571C","","","0.71073","MoKα","","0.0913","0.0604","","","0.1408","0.161","","","","","","1.046","","","","has coordinates,has disorder","202295","2020-10-21","18:00:00",""
"7056713","9.751","0.0003","16.2442","0.0005","17.3619","0.0005","90","","100.538","0.002","90","","2703.69","0.14","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H31 Cl2 O3 P Ru -","- C29 H31 Cl2 O3 P Ru -","- C116 H124 Cl8 O12 P4 Ru4 -","4","1","","Marchetti, Fabio; Biancalana, Lorenzo; Pratesi, Alessandro; Chiellini, Federica; Zacchini, Stefano; Funaioli, Tiziana; Gabbiani, Chiara","Ruthenium Arene Complexes with Triphenylphosphane Ligands: Cytotoxic Activity Towards Pancreatic Cancer Cells, Interaction with Model Proteins, and Critical Effect of Ethacrynic Acid Substitution","New J. Chem.","2017","","","","","10.1039/C7NJ02300F","","","0.71073","MoKα","","0.0448","0.033","","","0.0785","0.0875","","","","","","1.074","","","","has coordinates","202296","2020-10-21","18:00:00",""
"7056714","15.373","0.002","13.9","0.002","23.827","0.004","90","","94.239","0.004","90","","5077.5","1.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H28 Cl O2 P Ru -","- C29 H28 Cl O2 P Ru -","- C232 H224 Cl8 O16 P8 Ru8 -","8","2","","Marchetti, Fabio; Biancalana, Lorenzo; Pratesi, Alessandro; Chiellini, Federica; Zacchini, Stefano; Funaioli, Tiziana; Gabbiani, Chiara","Ruthenium Arene Complexes with Triphenylphosphane Ligands: Cytotoxic Activity Towards Pancreatic Cancer Cells, Interaction with Model Proteins, and Critical Effect of Ethacrynic Acid Substitution","New J. Chem.","2017","","","","","10.1039/C7NJ02300F","","","0.71073","MoKα","","0.1022","0.0728","","","0.1397","0.1496","","","","","","1.132","","","","has coordinates","202296","2020-10-21","18:00:00",""
"7056715","9.3256","0.0014","16.641","0.003","31.414","0.005","90","","93.589","0.003","90","","4865.5","1.4","100","2","100.15","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Bis(phenylanthryl)phenanthrene","3,6-bis(10-phenylanthracen-9-yl)phenanthrene","","- C57 H37 Cl9 -","- C57 H37 Cl9 -","- C228 H148 Cl36 -","4","1","","Jhulki, Samik; Mishra, Abhaya Kumar; Chow, Tahsin J.; Moorthy, J. Narasimha","Carbo[5]helicene versus planar phenanthrene as a scaffold for organic materials in OLEDs: electroluminescence of anthracene-functionalized emissive materials","New J. Chem.","2017","","","","","10.1039/C7NJ02233F","","","0.71073","MoKα","","0.1961","0.0884","","","0.186","0.2471","","","","","","1.032","","","","has coordinates","202372","2020-10-21","18:00:00",""
"7056716","7.6164","0.0008","19.798","0.002","7.849","0.001","90","","114.01","0.01","90","","1081.1","0.2","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-trifluoromethylchromone-3-cyanide-methyl","","- C12 H6 F3 N O2 -","- C12 H6 F3 N O2 -","- C48 H24 F12 N4 O8 -","4","1","","Alcivar León, Christian David; Echeverría, Gustavo A.; Piro, Oscar E.; Ulic, Sonia E.; Jios, Jorge Luis; Pereanez, Jaime A.; Henao Castañeda, Isabel Cristina; Pérez, Hiram","The role of non-covalent interactions in some 2-trifluoromethylchromones in the solid state.","New J. Chem.","2017","","","","","10.1039/C7NJ00481H","","","1.5418","CuKα","","0.0629","0.0456","","","0.1256","0.1447","","","","","","1.04","","","","has coordinates","202373","2020-10-21","18:00:00",""
"7056717","4.7865","0.0002","15.3885","0.0006","13.7073","0.0005","90","","93.722","0.003","90","","1007.51","0.07","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-trifluoromethylchromone-3-oxydryl-methyl","","- C11 H7 F3 O3 -","- C11 H7 F3 O3 -","- C44 H28 F12 O12 -","4","1","","Alcivar León, Christian David; Echeverría, Gustavo A.; Piro, Oscar E.; Ulic, Sonia E.; Jios, Jorge Luis; Pereanez, Jaime A.; Henao Castañeda, Isabel Cristina; Pérez, Hiram","The role of non-covalent interactions in some 2-trifluoromethylchromones in the solid state.","New J. Chem.","2017","","","","","10.1039/C7NJ00481H","","x-ray","1.54184","CuKα","","0.0677","0.0609","","","0.167","0.1759","","","","","","1.067","","","","has coordinates,has disorder","202373","2020-10-21","18:00:00",""
"7056718","7.5438","0.0005","20.2116","0.0011","7.7385","0.0006","90","","110.717","0.009","90","","1103.61","0.14","297","2","297","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","2-trifluoromethylchromone-3-nitro-methyl","","- C11 H6 F3 N O4 -","- C11 H6 F3 N O4 -","- C44 H24 F12 N4 O16 -","4","1","","Alcivar León, Christian David; Echeverría, Gustavo A.; Piro, Oscar E.; Ulic, Sonia E.; Jios, Jorge Luis; Pereanez, Jaime A.; Henao Castañeda, Isabel Cristina; Pérez, Hiram","The role of non-covalent interactions in some 2-trifluoromethylchromones in the solid state.","New J. Chem.","2017","","","","","10.1039/C7NJ00481H","","","1.5418","CuKα","","0.1144","0.0757","","","0.2382","0.333","","","","","","1.133","","","","has coordinates","202373","2020-10-21","18:00:00",""
"7056719","30.875","0.006","16.909","0.003","14.799","0.003","90","","116.37","0.03","90","","6922","3","298","","298","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C29 H27 Co F12 N4 O4 P2 -","- C29 H27 Co F12 N4 O4 P2 -","- C232 H216 Co8 F96 N32 O32 P16 -","8","1","","Lanznaster, Mauricio; da Silva, Aline Farias Moreira; Vital, Renata de Uzeda; Martins, Daniela de Luna; Rocha, David Rodrigues; Ferreira, Glaucio Braga; Camargos-Resende, Jackson A. L.","Investigation of cobalt(III)-tpa complexes as potential bioreductively activated carriers for naphthoquinone-based drugs","New J. Chem.","2017","","","","","10.1039/C7NJ03072J","","","0.71073","MoKα","","0.0966","0.0622","","","0.1632","0.1969","","","","","","1.035","","","","has coordinates","202468","2020-10-21","18:00:00",""
"7056720","10.3773","0.0003","8.6965","0.0003","33.1936","0.0011","90","","93.449","0.003","90","","2990.17","0.17","150","0.1","150.15","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H27 B Cl Co F4 N4 O5 -","- C29 H27.004 B Cl Co F4 N4 O5.002 -","- C116 H108.016 B4 Cl4 Co4 F16 N16 O20.008 -","4","1","","Lanznaster, Mauricio; da Silva, Aline Farias Moreira; Vital, Renata de Uzeda; Martins, Daniela de Luna; Rocha, David Rodrigues; Ferreira, Glaucio Braga; Camargos-Resende, Jackson A. L.","Investigation of cobalt(III)-tpa complexes as potential bioreductively activated carriers for naphthoquinone-based drugs","New J. Chem.","2017","","","","","10.1039/C7NJ03072J","","","0.71073","MoKα","","0.0761","0.0595","","","0.1579","0.1789","","","","","","1.123","","","","has coordinates,has disorder","202468","2020-10-21","18:00:00",""
"7056721","10.23899","0.00016","8.76417","0.00012","33.1396","0.0004","90","","93.9895","0.0013","90","","2966.62","0.07","149.8","0.2","150.15","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C29 H27 B Br Co F4 N4 O5 -","- C29 H27.002 B Br Co F4 N4 O5.001 -","- C116 H108.008 B4 Br4 Co4 F16 N16 O20.004 -","4","1","","Lanznaster, Mauricio; da Silva, Aline Farias Moreira; Vital, Renata de Uzeda; Martins, Daniela de Luna; Rocha, David Rodrigues; Ferreira, Glaucio Braga; Camargos-Resende, Jackson A. L.","Investigation of cobalt(III)-tpa complexes as potential bioreductively activated carriers for naphthoquinone-based drugs","New J. Chem.","2017","","","","","10.1039/C7NJ03072J","","","0.71073","MoKα","","0.0486","0.0427","","","0.1032","0.1058","","","","","","1.147","","","","has coordinates,has disorder","202468","2020-10-21","18:00:00",""
"7056722","10.7","0.002","14.421","0.003","14.701","0.003","90","","101.754","0.003","90","","2220.9","0.8","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","PM3FBP-PTSC","1-phenyl-3-methyl-4-(3-fluorobenzal)-5-hydroxypyrazole 4-phenylthiosemicarbazone","","- C24 H20 F N5 O S -","- C24 H20 F N5 O S -","- C96 H80 F4 N20 O4 S4 -","4","1","","Che, Yuanyuan; Liu, Lang; Tang, Yakun; Qiao, Yuqian; Zhao, Xianmei; Gao, Shasha; Ding, Sheng; Jia, Dianzeng","Solid-state photochromic behavior of pyrazolone 4-phenylthiosemicarbazone","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03406G","","","0.71073","MoKα","","0.117","0.0677","","","0.175","0.2045","","","","","","1.084","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7056723","10.0427","0.0003","11.1946","0.0003","21.0233","0.0004","96.2914","0.0018","92.4769","0.0018","109.769","0.002","2202.67","0.1","120","","120","","","","101","","","","","3","P -1","-P 1","2","","","","- C53 H56 O6.45 -","- C53 H56 O6.451 -","- C106 H112 O12.902 -","2","1","","Slavik, Petr; Dvorakova, Hana; Eigner, Vaclav; Lhotak, Pavel","meta-Bridged Calix[4]arenes Prepared by Friedel‒Crafts Alkylation","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03394J","","","1.54184","CuKα","","0.0611","0.0563","","0.1678","0.1589","0.1678","","","","","","0.9371","","","","has coordinates,has disorder","202539","2020-10-21","18:00:00",""
"7056724","12.6881","0.0002","19.1234","0.0003","14.91023","0.00019","90","","93.081","0.0013","90","","3612.58","0.09","95","","95","","","","101","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C43 H52 O4 -","- C43 H52 O4 -","- C172 H208 O16 -","4","1","","Slavik, Petr; Dvorakova, Hana; Eigner, Vaclav; Lhotak, Pavel","meta-Bridged Calix[4]arenes Prepared by Friedel‒Crafts Alkylation","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03394J","","","1.54184","CuKα","","0.0514","0.0428","","0.0825","0.0764","0.0825","","","","","","0.9937","","","","has coordinates","202539","2020-10-21","18:00:00",""
"7056725","11.4179","0.0005","11.8579","0.0005","23.594","0.001","77.2299","0.0019","79.1729","0.0018","72.4389","0.0018","2944.9","0.2","180","","180","","","","101","","","","","3","P -1","-P 1","2","","","","- C67 H70 O6 -","- C67 H70 O6 -","- C134 H140 O12 -","2","1","","Slavik, Petr; Dvorakova, Hana; Eigner, Vaclav; Lhotak, Pavel","meta-Bridged Calix[4]arenes Prepared by Friedel‒Crafts Alkylation","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03394J","","","1.54178","CuKα","","0.0867","0.0785","","0.213","0.2057","0.2127","","","","","","1.0105","","","","has coordinates,has disorder","202539","2020-10-21","18:00:00",""
"7056726","10.0361","0.0016","10.3968","0.0017","11.9591","0.0019","81.792","0.003","67.635","0.003","77.335","0.003","1123.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H18.5 Co N5.5 O6 -","- C21 H13 Co N5 O4 -","- C42 H26 Co2 N10 O8 -","2","1","","Xu, Zhouqing; Li, Huijun; Li, Qingqing; He, Yaling; Tang, Qingjie","Two novel porous MOFs with square-shaped cavities for removing toxic dyes: adsorption or degradation?","New Journal of Chemistry","2017","","","","","10.1039/C7NJ02904G","","","0.71073","MoKα","","0.0631","0.0418","","","0.0756","0.0814","","","","","","1.048","","","","has coordinates","202540","2020-10-21","18:00:00",""
"7056727","10.108","0.003","36.981","0.01","15.237","0.004","90","","100.592","0.005","90","","5599","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H60 Mn2 N12 O16 -","- C42 H28 Mn2 N10 O9 -","- C168 H112 Mn8 N40 O36 -","4","1","","Xu, Zhouqing; Li, Huijun; Li, Qingqing; He, Yaling; Tang, Qingjie","Two novel porous MOFs with square-shaped cavities for removing toxic dyes: adsorption or degradation?","New Journal of Chemistry","2017","","","","","10.1039/C7NJ02904G","","","0.71073","MoKα","","0.0661","0.0405","","","0.0912","0.0988","","","","","","1.021","","","","has coordinates","202540","2020-10-21","18:00:00",""
"7056728","27.649","0.003","7.2495","0.0009","21.908","0.002","90","","90","","90","","4391.3","0.8","170","2","170","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C26 H28 N2 O3 Si -","- C26 H27.5 N2 O3 Si -","- C208 H220 N16 O24 Si8 -","8","2","","Singh, Gurjaspreet; Singh, Akshpreet; Singh, Jasbhinder; Aulakh, Darpandeep; Wriedt, Mario; Ruiz , Cristóbal Espinosa; Esteban, Maria A.; Sehgal, Rakesh; Goyal, Kapil; Sinha, Shweta","First synthesis of pyrene functionalized silatranes for mechanistic insight into their potential anti-parasitic and anti-oxidation activities","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03338A","","","0.71073","MoKα","","0.2031","0.05","","","0.072","0.096","","","","","","0.748","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7056729","32.089","0.005","10.5036","0.0015","13.786","0.002","90","","90","","90","","4646.6","1.2","100","2","100","2","","","101.3","","","","synthesis","6","P c a 21","P 2c -2ac","29","","","","- C52 H58 N6 O2 Pt S2 -","- C52 H58 N6 O2 Pt S2 -","- C208 H232 N24 O8 Pt4 S8 -","4","1","","Koch, Klaus R.; Kotze, Izak; smith, vincent; Kangara, Edmore F.","Rare, Hypodentate L-κS Coordination Mode of N,N-dialkyl-N’-aroylthioureas leads to Unprecedented Mixed-ligand [Pt(phen)(L-κS)2] Complexes..","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03178E","","x-ray","0.71073","MoKα","","0.0267","0.0222","","","0.0439","0.0455","","","","","","0.845","","","","has coordinates","202592","2020-10-21","18:00:00",""
"7056730","13.203","0.006","14.849","0.007","19.502","0.009","102.474","0.005","108.801","0.005","94.644","0.005","3487","3","100","2","100","2","","","101.3","","","","synthesis","6","P -1","-P 1","2","","","","- C72 H78 N12 O6 Pt2 S4 -","- C72 H78 N12 O6 Pt2 S4 -","- C144 H156 N24 O12 Pt4 S8 -","2","1","","Koch, Klaus R.; Kotze, Izak; smith, vincent; Kangara, Edmore F.","Rare, Hypodentate L-κS Coordination Mode of N,N-dialkyl-N’-aroylthioureas leads to Unprecedented Mixed-ligand [Pt(phen)(L-κS)2] Complexes..","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03178E","","x-ray","0.71073","MoKα","","0.0709","0.0431","","","0.0903","0.1012","","","","","","0.988","","","","has coordinates,has disorder","202592","2020-10-21","18:00:00",""
"7056731","32.476","0.008","11.761","0.002","16.74","0.003","90","","112.62","0.03","90","","5902","2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H58 Cd3 N8 O15 -","- C58 H58 Cd3 N8 O15 -","- C232 H232 Cd12 N32 O60 -","4","0.5","","Rouhani, Farzaneh; Morsali, Ali","Highly Effective Brønsted Base/Lewis Acid Cooperative Catalysis: A new Cd metal-organic framework for synthesis of Hantzsch 1, 4-DHPs at ambient temperature","New Journal of Chemistry","2017","","","","","10.1039/C7NJ01509G","","","0.71073","MoKα","","0.166","0.0796","","","0.1367","0.1591","","","","","","0.894","","","","has coordinates","202884","2020-10-21","18:00:00",""
"7056732","21.311","0.004","12.257","0.003","16.659","0.003","90","","128.4","0.03","90","","3410.2","1.9","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 N2 Pt -","- C20 H18 N2 Pt -","- C160 H144 N16 Pt8 -","8","1","","Shahsavari, Hamid R.; Babadi Aghakhanpour, Reza; Hossein-Abadi, Mojdeh; Golbon Haghighi, Mohsen; Notash, Behrouz; fereidoonnezhad, Masood","A New Approach to the Effects of Isocyanide (CN-R) Ligands on the Luminescence Properties of Cycloplatinated(II) Complexes","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03110F","","","0.71073","MoKα","","0.0736","0.0375","","","0.0616","0.0678","","","","","","0.878","","","","has coordinates","202885","2020-10-21","18:00:00",""
"7056733","9.3461","0.0019","10.106","0.002","17.704","0.004","90","","90","","90","","1672.2","0.6","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H20 N2 Pt -","- C17 H20 N2 Pt -","- C68 H80 N8 Pt4 -","4","1","","Shahsavari, Hamid R.; Babadi Aghakhanpour, Reza; Hossein-Abadi, Mojdeh; Golbon Haghighi, Mohsen; Notash, Behrouz; fereidoonnezhad, Masood","A New Approach to the Effects of Isocyanide (CN-R) Ligands on the Luminescence Properties of Cycloplatinated(II) Complexes","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03110F","","","0.71073","MoKα","","0.0633","0.0496","","","0.1102","0.1141","","","","","","0.949","","","","has coordinates","202885","2020-10-21","18:00:00",""
"7056734","10.399","0.002","10.919","0.002","11.408","0.002","80.9","0.03","72.01","0.03","68.39","0.03","1144","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H19 N2 O2 -","- C31 H19 N2 O2 -","- C62 H38 N4 O4 -","2","1","","Zhao, Kun; Wang, Huimin; Sun, Hao; Tian, Wen; Yang, Shanguang; Liu, Jingjing; Peng, Jing; Wang, Mingliang","Studying the fluorescence conversion in organic charge transfer cocrystals of chalcone derivatives and TCNB","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03127K","","","0.71073","MoKα","","0.1425","0.066","","","0.1528","0.1841","","","","","","0.998","","","","has coordinates","202945","2020-10-21","18:00:00",""
"7056735","11.815","0.002","10.38","0.002","17.887","0.004","90","","99.44","0.03","90","","2163.9","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H17 N2 O -","- C30 H17 N2 O -","- C120 H68 N8 O4 -","4","1","","Zhao, Kun; Wang, Huimin; Sun, Hao; Tian, Wen; Yang, Shanguang; Liu, Jingjing; Peng, Jing; Wang, Mingliang","Studying the fluorescence conversion in organic charge transfer cocrystals of chalcone derivatives and TCNB","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03127K","","","0.71073","MoKα","","0.2","0.0819","","","0.1596","0.2059","","","","","","1.006","","","","has coordinates","202945","2020-10-21","18:00:00",""
"7056736","9.945","0.002","10.712","0.002","13.518","0.003","68.19","0.03","81.65","0.03","75.2","0.03","1290.6","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H18 N4 O -","- C35 H18 N4 O -","- C70 H36 N8 O2 -","2","1","","Zhao, Kun; Wang, Huimin; Sun, Hao; Tian, Wen; Yang, Shanguang; Liu, Jingjing; Peng, Jing; Wang, Mingliang","Studying the fluorescence conversion in organic charge transfer cocrystals of chalcone derivatives and TCNB","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03127K","","","0.71073","MoKα","","0.1769","0.0737","","","0.1084","0.1326","","","","","","0.994","","","","has coordinates","202945","2020-10-21","18:00:00",""
"7056737","9.5695","0.0011","10.607","0.001","16.3461","0.0015","71.986","0.004","83.215","0.005","85.146","0.005","1564.8","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H33 Cu N6 O6 -","- C33 H33 Cu N6 O6 -","- C66 H66 Cu2 N12 O12 -","2","1","","Banerjee, Saikat; Ghorai, Pravat; Brandão, Paula; Ghosh, Dipanjan; Bhuiya, Sutanwi; Chattopadhyay, Dhrubajyoti; Das, Suman; Saha, Amrita","Syntheses, crystal structures, DNA binding, DNA cleavage, molecular docking and DFT study of Cu(ii) complexes involving N2O4 donor azo Schiff base ligands","New Journal of Chemistry","2018","42","1","246","","10.1039/C7NJ03293E","","","0.71073","MoKα","","0.1027","0.0582","","","0.1351","0.1572","","","","","","1.052","","","","has coordinates,has disorder","230224","2020-10-21","18:00:00",""
"7056738","12.013","0.0014","12.2684","0.0015","12.398","0.0015","70.845","0.004","80.21","0.004","72.219","0.004","1638.6","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H36 Cu N6 O6 -","- C33 H32 Cu N6 O6 -","- C66 H64 Cu2 N12 O12 -","2","1","","Banerjee, Saikat; Ghorai, Pravat; Brandão, Paula; Ghosh, Dipanjan; Bhuiya, Sutanwi; Chattopadhyay, Dhrubajyoti; Das, Suman; Saha, Amrita","Syntheses, crystal structures, DNA binding, DNA cleavage, molecular docking and DFT study of Cu(ii) complexes involving N2O4 donor azo Schiff base ligands","New Journal of Chemistry","2018","42","1","246","","10.1039/C7NJ03293E","","","0.71073","MoKα","","0.1338","0.0674","","","0.164","0.1908","","","","","","0.997","","","","has coordinates","230224","2020-10-21","18:00:00",""
"7056739","11.0747","0.0003","10.6797","0.0003","25.2355","0.0007","90","","91.65","0.002","90","","2983.48","0.14","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H32 Cu N6 O6 -","- C31 H28 Cu N6 O6 -","- C124 H112 Cu4 N24 O24 -","4","1","","Banerjee, Saikat; Ghorai, Pravat; Brandão, Paula; Ghosh, Dipanjan; Bhuiya, Sutanwi; Chattopadhyay, Dhrubajyoti; Das, Suman; Saha, Amrita","Syntheses, crystal structures, DNA binding, DNA cleavage, molecular docking and DFT study of Cu(ii) complexes involving N2O4 donor azo Schiff base ligands","New Journal of Chemistry","2018","42","1","246","","10.1039/C7NJ03293E","","","0.71073","MoKα","","0.1278","0.0789","","","0.2192","0.266","","","","","","1.033","","","","has coordinates,has disorder","230224","2020-10-21","18:00:00",""
"7056740","6.6946","0.0003","10.7516","0.0005","11.4183","0.0005","90","","95.446","0.004","90","","818.15","0.06","120","0.1","120","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H28 Ga2 N2 O2 -","- C10 H28 Ga2 N2 O2 -","- C20 H56 Ga4 N4 O4 -","2","0.5","","Cybularczyk, Martyna; Zaremba, Rafał; Hurko, Aleksander; Plichta, Andrzej Tadeusz; Dranka, Maciej; Horeglad, Paweł","Dialkylgallium alkoxides ‒ a tool for facile and stereoselective synthesis of PLA-drug conjugates","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03089D","","x-ray","0.71073","MoKα","","0.0419","0.0356","","","0.0912","0.0984","","","","","","1.147","","","","has coordinates,has disorder","203031","2020-10-21","18:00:00",""
"7056741","21.4049","0.0007","8.2553","0.0003","18.0932","0.0005","90","","100.559","0.003","90","","3143","0.18","293","1","293","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H48 Ga2 N2 O4 -","- C28 H48 Ga2 N2 O4 -","- C112 H192 Ga8 N8 O16 -","4","0.5","","Cybularczyk, Martyna; Zaremba, Rafał; Hurko, Aleksander; Plichta, Andrzej Tadeusz; Dranka, Maciej; Horeglad, Paweł","Dialkylgallium alkoxides ‒ a tool for facile and stereoselective synthesis of PLA-drug conjugates","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03089D","","x-ray","0.71073","MoKα","","0.0269","0.0221","","","0.0584","0.062","","","","","","1.063","","","","has coordinates","203031","2020-10-21","18:00:00",""
"7056742","6.4969","0.0002","13.5023","0.0004","11.1683","0.0004","90","","95.288","0.003","90","","975.55","0.05","120","0.1","120","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H36 Ga2 N2 O2 -","- C14 H36 Ga2 N2 O2 -","- C28 H72 Ga4 N4 O4 -","2","0.5","","Cybularczyk, Martyna; Zaremba, Rafał; Hurko, Aleksander; Plichta, Andrzej Tadeusz; Dranka, Maciej; Horeglad, Paweł","Dialkylgallium alkoxides ‒ a tool for facile and stereoselective synthesis of PLA-drug conjugates","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03089D","","x-ray","0.71073","MoKα","","0.0244","0.0206","","","0.0508","0.0526","","","","","","1.071","","","","has coordinates","203031","2020-10-21","18:00:00",""
"7056743","8.109","0.004","14.882","0.006","7.304","0.004","90","","90","","90","","881.4","0.7","296","2","296","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C4 H6 N6 Ni S2 -","- C4 H6 N6 Ni S2 -","- C16 H24 N24 Ni4 S8 -","4","0.5","","Bharty, M. K.; Paswan, Santosh; Bharati, P.; Sonkar, Piyush Kumar; Ganesan, Vellaichamy; Butcher, Raymond J.","Square planar Ni(II) complexes of acetone N4-phenyl-thiosemicarbazone and in situ generated benzoyl thiosemicarbazide ligand: Synthesis, spectral and structural characterizations, thermal behaviour and electrochemical studies","New Journal of Chemistry","2017","","","","","10.1039/C7NJ01030C","","","0.71073","MoKα","","0.0802","0.0435","","","0.0753","0.0864","","","","","","1.117","","","","has coordinates","203106","2020-10-21","18:00:00",""
"7056744","23.403","0.002","7.6265","0.0005","12.2279","0.0009","90","","96.569","0.007","90","","2168.1","0.3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H24 N6 Ni S2 -","- C20 H24 N6 Ni S2 -","- C80 H96 N24 Ni4 S8 -","4","0.5","","Bharty, M. K.; Paswan, Santosh; Bharati, P.; Sonkar, Piyush Kumar; Ganesan, Vellaichamy; Butcher, Raymond J.","Square planar Ni(II) complexes of acetone N4-phenyl-thiosemicarbazone and in situ generated benzoyl thiosemicarbazide ligand: Synthesis, spectral and structural characterizations, thermal behaviour and electrochemical studies","New Journal of Chemistry","2017","","","","","10.1039/C7NJ01030C","","","0.71073","MoKα","","0.0953","0.0633","","","0.1522","0.1837","","","","","","1.083","","","","has coordinates","203106","2020-10-21","18:00:00",""
"7056745","9.2167","0.0007","14.4067","0.001","13.1603","0.0009","90","","90.874","0.002","90","","1747.3","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H15 Cl4 N O3 -","- C14 H15 Cl4 N O3 -","- C56 H60 Cl16 N4 O12 -","4","1","","Bakewell, Nicholas Owen; Thavarajah, Rumintha; Motevalli, Majid; Sheriff, Tippu S.","Nucleophile and Base Differentiation of Pyridine in Reaction with Tetrahalocatechols and the Formation of Manganese(III)-Catecholate and Pyridinium-Catecholate Complexes for the in situ Generation of Hydrogen Peroxide from Dioxygen","New Journal of Chemistry","2017","","","","","10.1039/C7NJ02725G","","","0.71073","MoKα","","0.0784","0.0417","","","0.0971","0.112","","","","","","1.028","","","","has coordinates","203142","2020-10-21","18:00:00",""
"7056746","17.155","0.018","8.049","0.005","18.643","0.011","90","","92.815","0.009","90","","2571","3","100","2","100","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C11 H7 Cl4 N O2 -","- C11 H7 Cl4 N O2 -","- C88 H56 Cl32 N8 O16 -","8","1","","Bakewell, Nicholas Owen; Thavarajah, Rumintha; Motevalli, Majid; Sheriff, Tippu S.","Nucleophile and Base Differentiation of Pyridine in Reaction with Tetrahalocatechols and the Formation of Manganese(III)-Catecholate and Pyridinium-Catecholate Complexes for the in situ Generation of Hydrogen Peroxide from Dioxygen","New Journal of Chemistry","2017","","","","","10.1039/C7NJ02725G","","","0.71073","MoKα","","0.045","0.031","","","0.0777","0.0846","","","","","","1.028","","","","has coordinates","203142","2020-10-21","18:00:00",""
"7056747","8.353","0.005","14.954","0.008","13.404","0.007","90","","95.134","0.014","90","","1667.6","1.6","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 Br4 N O3 -","- C13 H13 Br4 N O3 -","- C52 H52 Br16 N4 O12 -","4","1","","Bakewell, Nicholas Owen; Thavarajah, Rumintha; Motevalli, Majid; Sheriff, Tippu S.","Nucleophile and Base Differentiation of Pyridine in Reaction with Tetrahalocatechols and the Formation of Manganese(III)-Catecholate and Pyridinium-Catecholate Complexes for the in situ Generation of Hydrogen Peroxide from Dioxygen","New Journal of Chemistry","2017","","","","","10.1039/C7NJ02725G","","","0.71073","MoKα","","0.028","0.022","","","0.0486","0.0513","","","","","","0.922","","","","has coordinates,has disorder","203142","2020-10-21","18:00:00",""
"7056748","9.708","0.0012","11.5722","0.0015","14.215","0.002","91.344","0.007","99.494","0.007","106.741","0.007","1504.1","0.3","294","2","294","2","","","","","","","","5","P -1","-P 1","2","68dmprsp","68dmprsp","","- C39 H30 Cl N4 O -","- C39 H30 Cl N4 O -","- C78 H60 Cl2 N8 O2 -","2","1","","Saravana Mani, Kailasam; Kaminsky, Werner; Rajendran, Subramaniam Parameswaran","A facile atom economic one pot multicomponent synthesis of bioactive spiro-indenoquinoxaline pyrrolizines as potent antioxidants and anti-cancer agents","New Journal of Chemistry","2018","42","1","301","","10.1039/C7NJ02993D","","","0.71073","MoKα","","0.1646","0.0562","","","0.1237","0.1649","","","","","","0.897","","","","has coordinates","230221","2020-10-21","18:00:00",""
"7056749","14.7935","0.0005","14.7935","0.0005","42.5752","0.0016","90","","90","","120","","8069.2","0.5","301","2","301","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C60 H58 F6 N7 P -","- C60 H58 F6.006 N7 P -","- C360 H348 F36.036 N42 P6 -","6","0.333333","","Jonah, Tosin M.; Mathivathanan, Logesh; Morozov, Alexander N.; Mebel, Alexander M.; Raptis, Raphael G.; Kavallieratos, Konstantinos","Remarkably selective NH4+ binding and fluorescence sensing by tripodal tris(pyrazolyl) receptors derived from 1,3,5-triethylbenzene: structural and theoretical insights on the role of ion pairing","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03213G","","","0.71073","MoKα","","0.1473","0.082","","","0.1814","0.212","","","","","","1.027","","","","has coordinates,has disorder","203228","2020-10-21","18:00:00",""
"7056750","10.5434","0.0004","12.4141","0.0005","19.6118","0.0008","94.867","0.001","102.526","0.001","106.638","0.001","2371.1","0.16","297","2","297.01","","","","","","","","","3","P -1","-P 1","2","","","","- C60 H54 N6 -","- C60 H54 N6 -","- C120 H108 N12 -","2","1","","Jonah, Tosin M.; Mathivathanan, Logesh; Morozov, Alexander N.; Mebel, Alexander M.; Raptis, Raphael G.; Kavallieratos, Konstantinos","Remarkably selective NH4+ binding and fluorescence sensing by tripodal tris(pyrazolyl) receptors derived from 1,3,5-triethylbenzene: structural and theoretical insights on the role of ion pairing","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03213G","","","0.71073","MoKα","","0.1758","0.0702","","","0.1483","0.1884","","","","","","1.007","","","","has coordinates,has disorder","203228","2020-10-21","18:00:00",""
"7056751","14.162","0.001","38.224","0.003","14.065","0.0011","90","","94.915","0.002","90","","7585.8","1","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly{[diaquatris(mu4-perylene-3,4,9,10-tetracarboxylato)-eicosakis(dimethylformamide)tetradysprosium] tetrahydrate tetrakis(dimethylformamide)}","","- C60 H99 Dy2 N12 O33 S6 -","- C55.5 H84.5 Dy2 N10.5 O29.5 S6 -","- C222 H338 Dy8 N42 O118 S24 -","4","1","","García-García, Amalia; Oyarzabal, Itziar; Cepeda, Javier; Seco, José M.; García-Valdivia, Antonio A.; Gómez-Ruiz, Santiago; Salinas-Castillo, Alfonso; Choquesillo-Lazarte, Duane; Rodríguez-Diéguez, Antonio","Slow relaxation of magnetization and luminescence properties of a novel dysprosium and pyrene-1,3,6,8-tetrasulfonate based MOF","New Journal of Chemistry","2018","42","2","832","","10.1039/C7NJ02935G","","","0.71073","MoKα","","0.0607","0.0521","","","0.1316","0.1374","","","","","","1.072","","","","has coordinates,has disorder","230300","2020-10-21","18:00:00",""
"7056752","8.454","0.004","12.125","0.006","7.206","0.003","90","","91.66","0.02","90","","738.3","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-methoxythieno[2,3-d]pyrimidin-4(3H)-one","","- C7 H6 N2 O2 S -","- C7 H6 N2 O2 S -","- C28 H24 N8 O8 S4 -","4","1","","Soares, Maria I.L.; Manaia Nunes, Cláudio; Gomes, Clara S. B.; Pinho e Melo, Teresa M. V. D.; Fausto, Rui","Conformational Behaviour, Photochemistry and Flash Vacuum Pyrolysis of a 2-(1H-Tetrazol-1-yl)thiophene","New Journal of Chemistry","2017","","","","","10.1039/C7NJ02775C","","x-ray","0.71073","MoKα","","0.0885","0.053","","","0.1132","0.1253","","","","","","1.017","","","","has coordinates","203230","2020-10-21","18:00:00",""
"7056753","3.9245","0.0005","18.054","0.002","12.6455","0.0015","90","","98.936","0.008","90","","885.1","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl 2-(1H-tetrazol-1-yl)thiophene-3-carboxylate","","- C7 H6 N4 O2 S -","- C7 H6 N4 O2 S -","- C28 H24 N16 O8 S4 -","4","1","","Soares, Maria I.L.; Manaia Nunes, Cláudio; Gomes, Clara S. B.; Pinho e Melo, Teresa M. V. D.; Fausto, Rui","Conformational Behaviour, Photochemistry and Flash Vacuum Pyrolysis of a 2-(1H-Tetrazol-1-yl)thiophene","New Journal of Chemistry","2017","","","","","10.1039/C7NJ02775C","","x-ray","0.71073","MoKα","","0.0388","0.0347","","","0.0909","0.0937","","","","","","1.026","","","","has coordinates","203230","2020-10-21","18:00:00",""
"7056754","9.8099","0.0005","14.0372","0.0007","14.7788","0.0011","90","","90.878","0.006","90","","2034.9","0.2","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H19 Br2 N O -","- C22 H19 Br2 N O -","- C88 H76 Br8 N4 O4 -","4","1","","Martins, Nayara Silva; Alberto, Eduardo E.","Dibromination of alkenes with LiBr and H2O2 under mild conditions","New Journal of Chemistry","2018","42","1","161","","10.1039/C7NJ04300G","","x-ray","0.71073","MoKα","","0.0775","0.0431","","","0.092","0.1058","","","","","","1.021","","","","has coordinates","296814","2024-12-10","08:46:16",""
"7056755","9.453","0.002","12.533","0.003","23.913","0.005","90","","115.7","0.004","90","","2552.8","1","120","","120","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H23 B2 Cl4 Fe N8 O6 -","- C16 H23 B2 Cl4 Fe N8 O6 -","- C64 H92 B8 Cl16 Fe4 N32 O24 -","4","1","","Zelinskii, Genrikh E.; Belov, Alexander S.; Belaya, Irina G.; Vologzhanina, Anna V.; Novikov, Valentin V.; Varzatskii, Oleg A.; Voloshin, Yan Z.","The molecular design of cage metal complexes for biological applications: pathways of the synthesis, and X-ray structures of a series of new N2-, S2- and O2-alicyclic iron(ii) di- and tetrachloroclathrochelates","New Journal of Chemistry","2018","42","1","56","","10.1039/C7NJ03051G","","","0.71073","MoKα","","0.148","0.114","","","0.2425","0.2549","","","","","","1.052","","","","has coordinates,has disorder","230225","2020-10-21","18:00:00",""
"7056756","11.0772","0.0002","11.0772","0.0002","26.6909","0.0009","90","","90","","90","","3275.09","0.14","120","","120","","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C32 H30 B2 Fe N6 O12 -","- C32 H30 B2 Fe N6 O12 -","- C128 H120 B8 Fe4 N24 O48 -","4","0.5","","Zelinskii, Genrikh E.; Belov, Alexander S.; Belaya, Irina G.; Vologzhanina, Anna V.; Novikov, Valentin V.; Varzatskii, Oleg A.; Voloshin, Yan Z.","The molecular design of cage metal complexes for biological applications: pathways of the synthesis, and X-ray structures of a series of new N2-, S2- and O2-alicyclic iron(ii) di- and tetrachloroclathrochelates","New Journal of Chemistry","2018","42","1","56","","10.1039/C7NJ03051G","","","0.71073","MoKα","","0.0357","0.03","","","0.0742","0.0772","","","","","","1.008","","","","has coordinates","230225","2020-10-21","18:00:00",""
"7056757","14.486","0.0004","15.3721","0.0003","15.7873","0.0004","117.417","0.001","99.084","0.002","107.035","0.001","2800.59","0.13","120","","120","","","","","","","","","8","P -1","-P 1","2","","","","- C37 H54 B4 Cl3 Fe2 N12 O12 S9 -","- C37 H54 B4 Cl3 Fe2 N12 O12 S9 -","- C74 H108 B8 Cl6 Fe4 N24 O24 S18 -","2","1","","Zelinskii, Genrikh E.; Belov, Alexander S.; Belaya, Irina G.; Vologzhanina, Anna V.; Novikov, Valentin V.; Varzatskii, Oleg A.; Voloshin, Yan Z.","The molecular design of cage metal complexes for biological applications: pathways of the synthesis, and X-ray structures of a series of new N2-, S2- and O2-alicyclic iron(ii) di- and tetrachloroclathrochelates","New Journal of Chemistry","2018","42","1","56","","10.1039/C7NJ03051G","","","1.54178","CuKα","","0.0644","0.0506","","","0.0981","0.1043","","","","","","0.993","","","","has coordinates,has disorder","230225","2020-10-21","18:00:00",""
"7056758","7.087","0.003","8.894","0.003","16.147","0.006","90","","101.284","0.013","90","","998.1","0.7","122","2","122","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 Cl4 Cu2 N4 O2 -","- C16 H20 Cl4 Cu2 N4 O2 -","- C32 H40 Cl8 Cu4 N8 O4 -","2","0.5","","Jehdaramarn, Attawit; Pornsuwan, Soraya; Chumsaeng, Phongnarin; Phomphrai, Khamphee; Sangtrirutnugul, Preeyanuch","Effects of appended hydroxyl groups and ligand chain length on copper coordination and oxidation activity","New Journal of Chemistry","2018","42","1","654","","10.1039/C7NJ03113K","","","0.71073","","","0.0248","0.0219","","","0.0544","0.0556","","","","","","1.071","","","","has coordinates","230230","2020-10-21","18:00:00",""
"7056759","14.024","0.008","7.716","0.005","17.612","0.013","90","","111.47","0.03","90","","1774","2","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 Cl3 Cu2 N3 O2 -","- C15 H16 Cl3 Cu2 N3 O2 -","- C60 H64 Cl12 Cu8 N12 O8 -","4","1","","Jehdaramarn, Attawit; Pornsuwan, Soraya; Chumsaeng, Phongnarin; Phomphrai, Khamphee; Sangtrirutnugul, Preeyanuch","Effects of appended hydroxyl groups and ligand chain length on copper coordination and oxidation activity","New Journal of Chemistry","2018","42","1","654","","10.1039/C7NJ03113K","","","0.71073","","","0.0356","0.0243","","","0.0492","0.0523","","","","","","1.03","","","","has coordinates","230230","2020-10-21","18:00:00",""
"7056760","12.9346","0.0007","16.1294","0.0009","18.8407","0.0009","86.086","0.004","84.022","0.004","69.942","0.005","3670","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C133.33 H152.98 Cu10 N16 O45.16 -","- C133.333 H137.334 Cu10 N16 O45.1666 -","- C133.333 H137.334 Cu10 N16 O45.1666 -","1","0.5","","Haldar, Shobhraj; Vijaykumar, Gonela; Carrella, Luca; Musie, Ghezai T.; Bera, Manindranath","Structure and properties of a novel staircase-like decanuclear [CuII10] cluster supported by carbonate and carboxylate bridges","New Journal of Chemistry","2018","42","2","1276","","10.1039/C7NJ03714G","","","0.71073","MoKα","","0.0878","0.0716","","","0.1777","0.1855","","","","","","1.095","","","","has coordinates,has disorder","230304","2020-10-21","18:00:00",""
"7056761","43.3833","0.001","9.7679","0.0002","38.6961","0.0007","90","","94.968","0.002","90","","16336.4","0.6","100","1","100","1","","","","","","","","7","I 2/c 1 1","-I 2ya","15","","","","- C42 H30 Br2 N4 O6 Pd2 S2 -","- C42 H30 Br2 N4 O6 Pd2 S2 -","- C672 H480 Br32 N64 O96 Pd32 S32 -","16","2","","Karami, Kazem; alinaghi, moloud; Amirghofran, Zahra; Lipkowski, Janusz; Momtazi-borojeni, amir abbas","A saccharinate-bridged palladacyclic dimer with Pd-Pd bond: experimental and molecular docking studies of the interaction with DNA and BSA and in vitro cytotoxicity activities against human cancer cell lines","New Journal of Chemistry","2017","","","","","10.1039/C7NJ03138F","","","1.54184","CuKα","","0.0638","0.0542","","","0.1481","0.1564","","","","","","0.966","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7056762","16.7661","0.0015","22.86","0.002","11.406","0.0011","90","","90","","90","","4371.6","0.7","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C18 H28 Bi2 I9 N5 -","- C18 H28 Bi2 I9 N5 -","- C72 H112 Bi8 I36 N20 -","4","0.5","","Yan, Zhi Shuo; Long, Ji Ying; Gong, Yun; Hua Lin, Jian","Three in situ-synthesized novel inorganic‒organic hybrid materials based on metal (M = Bi, Pb) iodide and organoamine using one-pot reactions: structures, band gaps and optoelectronic properties","New Journal of Chemistry","2018","42","1","699","","10.1039/C7NJ02815F","","","0.71073","MoKα","","0.2059","0.0859","","","0.2283","0.2904","","","","","","1.025","","","","has coordinates","230222","2020-10-21","18:00:00",""
"7056763","18.36","0.02","7.91","0.01","19.67","0.02","90","","90","","90","","2857","6","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C7 H10 I3 N Pb -","- C7 H10 I3 N Pb -","- C56 H80 I24 N8 Pb8 -","8","1","","Yan, Zhi Shuo; Long, Ji Ying; Gong, Yun; Hua Lin, Jian","Three in situ-synthesized novel inorganic‒organic hybrid materials based on metal (M = Bi, Pb) iodide and organoamine using one-pot reactions: structures, band gaps and optoelectronic properties","New Journal of Chemistry","2018","42","1","699","","10.1039/C7NJ02815F","","","0.71073","MoKα","","0.079","0.04","","","0.0824","0.097","","","","","","1.044","","","","has coordinates","230222","2020-10-21","18:00:00",""
"7056764","14.9571","0.0012","8.096","0.0008","9.8979","0.0009","90","","90","","90","","1198.56","0.19","298","2","298","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C5 H6 I3 N Pb -","- C5 H6 I3 N Pb -","- C20 H24 I12 N4 Pb4 -","4","0.5","","Yan, Zhi Shuo; Long, Ji Ying; Gong, Yun; Hua Lin, Jian","Three in situ-synthesized novel inorganic‒organic hybrid materials based on metal (M = Bi, Pb) iodide and organoamine using one-pot reactions: structures, band gaps and optoelectronic properties","New Journal of Chemistry","2018","42","1","699","","10.1039/C7NJ02815F","","","0.71073","MoKα","","0.1005","0.09","","","0.2185","0.2263","","","","","","1.115","","","","has coordinates,has disorder","230222","2020-10-21","18:00:00",""
"7056765","9.0323","0.0006","10.9047","0.0007","12.9519","0.0009","93.339","0.002","106.159","0.002","102.703","0.002","1185.55","0.14","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H25 N3 O2 S -","- C28 H25 N3 O2 S -","- C56 H50 N6 O4 S2 -","2","1","","Shiva Kumar, K.; Kumar, N. Praveen; Rajesham, Bandari; Kishan, Gugulothu; Akula, Sravani; Kancha, Rama Krishna","Silver-catalyzed synthesis of pyrrolopiperazine fused with oxazine/imidazole via a domino approach: evaluation of anti-cancer activity","New Journal of Chemistry","2018","42","1","34","","10.1039/C7NJ03608F","","","0.71073","MoKα","","0.0605","0.0433","","","0.1135","0.1271","","","","","","1.015","","","","has coordinates","230228","2020-10-21","18:00:00",""
"7056766","18.1618","0.0006","12.4595","0.0004","20.2872","0.0008","90","","101.442","0.001","90","","4499.5","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 N2 -","- C30 H24 N2 -","- C240 H192 N16 -","8","1","","Manickam, Saravanakumar; Balijapalli, Umamahesh; Sathiyanarayanan, Kulathu Iyer","SnCl2-catalyzed synthesis of dihydro-5H-benzo[f]pyrazolo[3,4-b]quinoline and dihydroindeno[2,1-b]pyrazolo[4,3-e]pyridine with high fluorescence and their photophysical properties","New Journal of Chemistry","2018","42","2","860","","10.1039/C7NJ03654J","","","0.71073","MoKα","","0.1165","0.072","","","0.2107","0.2507","","","","","","1.048","","","","has coordinates","230295","2020-10-21","18:00:00",""
"7056767","7.3474","0.0003","8.9699","0.0004","16.5075","0.0007","95.021","0.003","95.805","0.002","91.637","0.002","1077.43","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H0 N4 -","- C28 H20 N4 -","- C56 H40 N8 -","2","1","","Manickam, Saravanakumar; Balijapalli, Umamahesh; Sathiyanarayanan, Kulathu Iyer","SnCl2-catalyzed synthesis of dihydro-5H-benzo[f]pyrazolo[3,4-b]quinoline and dihydroindeno[2,1-b]pyrazolo[4,3-e]pyridine with high fluorescence and their photophysical properties","New Journal of Chemistry","2018","42","2","860","","10.1039/C7NJ03654J","","","0.71073","MoKα","","0.106","0.0545","","","0.1492","0.1918","","","","","","1.019","","","","has coordinates","230295","2020-10-21","18:00:00",""
"7056768","9.279","0.0005","9.6051","0.0005","14.5588","0.0008","90","","90.782","0.003","90","","1297.44","0.12","90","0.5","90","0.5","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 N3 O2 S -","- C13 H13 N3 O2 S -","- C52 H52 N12 O8 S4 -","4","1","","Kalaiarasi, G.; Rajkumar, S. Rex Jeya; Dharani, S.; Fronczek, Frank R.; Muthukumar Nadar, M. S. A.; Prabhakaran, R.","Cyclometallated ruthenium(ii) complexes with 3-acetyl-2[H]-chromene-2-one derived CNS chelating ligand systems: synthesis, X-ray characterization and biological evaluation","New Journal of Chemistry","2018","42","1","336","","10.1039/C7NJ02877F","","","0.71073","MoKα","","0.0427","0.0365","","","0.1013","0.1065","","","","","","1.054","","","","has coordinates","230223","2020-10-21","18:00:00",""
"7056769","17.2211","0.0008","8.0419","0.0004","20.7942","0.001","90","","106.004","0.003","90","","2768.2","0.2","90","0.5","90","0.5","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H15 N3 O2 S -","- C14 H15 N3 O2 S -","- C112 H120 N24 O16 S8 -","8","1","","Kalaiarasi, G.; Rajkumar, S. Rex Jeya; Dharani, S.; Fronczek, Frank R.; Muthukumar Nadar, M. S. A.; Prabhakaran, R.","Cyclometallated ruthenium(ii) complexes with 3-acetyl-2[H]-chromene-2-one derived CNS chelating ligand systems: synthesis, X-ray characterization and biological evaluation","New Journal of Chemistry","2018","42","1","336","","10.1039/C7NJ02877F","","","0.71073","MoKα","","0.0472","0.037","","","0.0988","0.1055","","","","","","1.045","","","","has coordinates","230223","2020-10-21","18:00:00",""
"7056770","12.809","0.0008","34.6852","0.0019","10.919","0.0005","90","","108.019","0.004","90","","4613.2","0.4","100","0.5","100","0.5","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C55 H43 N3 O3 P2 Ru S -","- C55 H43 N3 O3 P2 Ru S -","- C220 H172 N12 O12 P8 Ru4 S4 -","4","1","","Kalaiarasi, G.; Rajkumar, S. Rex Jeya; Dharani, S.; Fronczek, Frank R.; Muthukumar Nadar, M. S. A.; Prabhakaran, R.","Cyclometallated ruthenium(ii) complexes with 3-acetyl-2[H]-chromene-2-one derived CNS chelating ligand systems: synthesis, X-ray characterization and biological evaluation","New Journal of Chemistry","2018","42","1","336","","10.1039/C7NJ02877F","","","1.54184","CuKα","","0.1647","0.1113","","","0.2881","0.3223","","","","","","1.024","","","","has coordinates","230223","2020-10-21","18:00:00",""
"7056771","11.7445","0.0004","13.1594","0.0005","15.1515","0.0006","86.303","0.002","81.895","0.002","65.417","0.002","2108.11","0.14","100","0.5","100","0.5","","","","","","","","7","P -1","-P 1","2","","","","- C49 H39.92 N3 O3.46 P2 Ru S -","- C49 H39 N3 O3.461 P2 Ru S -","- C98 H78 N6 O6.922 P4 Ru2 S2 -","2","1","","Kalaiarasi, G.; Rajkumar, S. Rex Jeya; Dharani, S.; Fronczek, Frank R.; Muthukumar Nadar, M. S. A.; Prabhakaran, R.","Cyclometallated ruthenium(ii) complexes with 3-acetyl-2[H]-chromene-2-one derived CNS chelating ligand systems: synthesis, X-ray characterization and biological evaluation","New Journal of Chemistry","2018","42","1","336","","10.1039/C7NJ02877F","","","0.71073","MoKα","","0.0773","0.0479","","","0.1067","0.1193","","","","","","1.049","","","","has coordinates","230223","2020-10-21","18:00:00",""
"7056772","11.8754","0.0004","12.4147","0.0004","17.2352","0.0006","80.4346","0.0018","78.9857","0.0015","63.995","0.0015","2231.85","0.13","90","0.5","90","0.5","","","","","","","","7","P -1","-P 1","2","","","","- C50 H41 N3 O3 P2 Ru S -","- C50 H41 N3 O3 P2 Ru S -","- C100 H82 N6 O6 P4 Ru2 S2 -","2","1","","Kalaiarasi, G.; Rajkumar, S. Rex Jeya; Dharani, S.; Fronczek, Frank R.; Muthukumar Nadar, M. S. A.; Prabhakaran, R.","Cyclometallated ruthenium(ii) complexes with 3-acetyl-2[H]-chromene-2-one derived CNS chelating ligand systems: synthesis, X-ray characterization and biological evaluation","New Journal of Chemistry","2018","42","1","336","","10.1039/C7NJ02877F","","","0.71073","MoKα","","0.0418","0.0337","","","0.0847","0.0881","","","","","","1.072","","","","has coordinates,has disorder","230223","2020-10-21","18:00:00",""
"7056773","13.0418","0.0003","13.4769","0.0003","13.6076","0.0003","79.4942","0.0012","80.9076","0.0011","71.6378","0.0011","2218.88","0.09","90","0.5","90","0.5","","","","","","","","7","P -1","-P 1","2","","","","- C54 H46 N3 O3 P2 Ru S -","- C54 H46 N3 O3 P2 Ru S -","- C108 H92 N6 O6 P4 Ru2 S2 -","2","1","","Kalaiarasi, G.; Rajkumar, S. Rex Jeya; Dharani, S.; Fronczek, Frank R.; Muthukumar Nadar, M. S. A.; Prabhakaran, R.","Cyclometallated ruthenium(ii) complexes with 3-acetyl-2[H]-chromene-2-one derived CNS chelating ligand systems: synthesis, X-ray characterization and biological evaluation","New Journal of Chemistry","2018","42","1","336","","10.1039/C7NJ02877F","","","0.71073","MoKα","","0.0348","0.0261","","","0.0608","0.0644","","","","","","1.016","","","","has coordinates","230223","2020-10-21","18:00:00",""
"7056774","19.835","0.002","16.2476","0.0017","10.253","0.001","90","","99.974","0.006","90","","3254.3","0.6","100","2","99.99","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 F12 N4 O4 P2 -","- C28 H22 F12 N4 O4 P2 -","- C112 H88 F48 N16 O16 P8 -","4","1","","Villa-Pérez, C.; Cadavid-Vargas, J. F.; Di Virgilio, A. L.; Echeverría, G. A.; Camí, G. E.; Soria, D. B.","Crystal structure, Hirshfeld surface analysis, spectroscopic and biological studies on sulfamethazine and sulfaquinoxaline ternary complexes with 2,2′-biquinoline","New Journal of Chemistry","2018","42","2","891","","10.1039/C7NJ03624H","","","1.54178","CuKα","","0.0817","0.0686","","","0.1921","0.2023","","","","","","1.055","","","","has coordinates","230291","2020-10-21","18:00:00",""
"7056775","11.9807","0.0009","12.2072","0.0014","17.381","0.002","84.137","0.01","73.892","0.009","67.836","0.009","2261.7","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H38 N10 Ni O6 S2 -","- C46 H38 N10 Ni O6 S2 -","- C92 H76 N20 Ni2 O12 S4 -","2","1","","Villa-Pérez, C.; Cadavid-Vargas, J. F.; Di Virgilio, A. L.; Echeverría, G. A.; Camí, G. E.; Soria, D. B.","Crystal structure, Hirshfeld surface analysis, spectroscopic and biological studies on sulfamethazine and sulfaquinoxaline ternary complexes with 2,2′-biquinoline","New Journal of Chemistry","2018","42","2","891","","10.1039/C7NJ03624H","","x-ray","0.71073","MoKα","","0.1421","0.067","","","0.1638","0.2148","","","","","","0.998","","","","has coordinates","230291","2020-10-21","18:00:00",""
"7056776","10.0919","0.0009","10.1848","0.0006","17.0127","0.0011","81.383","0.005","75.712","0.007","63.935","0.007","1520.5","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C33 H27 Cl Cu N6 O3 S -","- C33 H27 Cl Cu N6 O3 S -","- C66 H54 Cl2 Cu2 N12 O6 S2 -","2","1","","Villa-Pérez, C.; Cadavid-Vargas, J. F.; Di Virgilio, A. L.; Echeverría, G. A.; Camí, G. E.; Soria, D. B.","Crystal structure, Hirshfeld surface analysis, spectroscopic and biological studies on sulfamethazine and sulfaquinoxaline ternary complexes with 2,2′-biquinoline","New Journal of Chemistry","2018","42","2","891","","10.1039/C7NJ03624H","","x-ray","1.54184","CuKα","","0.0635","0.0446","","","0.1055","0.1199","","","","","","1.028","","","","has coordinates","230291","2020-10-21","18:00:00",""
"7056777","10.0254","0.0007","16.5255","0.001","17.0838","0.0008","90","","95.697","0.006","90","","2816.4","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H25 Cl Cu N6 O2 S -","- C30 H25 Cl Cu N6 O2 S -","- C120 H100 Cl4 Cu4 N24 O8 S4 -","4","1","","Villa-Pérez, C.; Cadavid-Vargas, J. F.; Di Virgilio, A. L.; Echeverría, G. A.; Camí, G. E.; Soria, D. B.","Crystal structure, Hirshfeld surface analysis, spectroscopic and biological studies on sulfamethazine and sulfaquinoxaline ternary complexes with 2,2′-biquinoline","New Journal of Chemistry","2018","42","2","891","","10.1039/C7NJ03624H","","x-ray","1.54184","CuKα","","0.1051","0.064","","","0.1612","0.1912","","","","","","1.023","","","","has coordinates","230291","2020-10-21","18:00:00",""
"7056778","11.3453","0.0013","12.5873","0.0015","13.3419","0.0016","61.922","0.004","83.098","0.004","69.125","0.004","1568.1","0.3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H76 N24 O44 -","- C36 H36 N24 O44 -","- C36 H36 N24 O44 -","1","0.5","","Xia, Xi; Chen, Kai; Yao, Yu-Qing; Shan, Chun-Yan; Tao, Zhu; Zhang, Yun-Qian; Zhou, QingDi; Wei, Gang","Highly selective absorption of polychloromethanes in perhydroxylated cucurbit[6]uril-based supramolecular assemblies","New Journal of Chemistry","2018","42","2","802","","10.1039/C7NJ03446F","","","0.71073","MoKα","","0.1074","0.0956","","","0.3087","0.328","","","","","","1.479","","","","has coordinates,has disorder","230307","2020-10-21","18:00:00",""
"7056779","15.359","0.012","21.896","0.012","18.644","0.012","90","","100.105","0.012","90","","6173","7","223","2","223","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C36 H80 N24 O46 -","- C36 H36 N24 O46 -","- C144 H144 N96 O184 -","4","0.5","","Xia, Xi; Chen, Kai; Yao, Yu-Qing; Shan, Chun-Yan; Tao, Zhu; Zhang, Yun-Qian; Zhou, QingDi; Wei, Gang","Highly selective absorption of polychloromethanes in perhydroxylated cucurbit[6]uril-based supramolecular assemblies","New Journal of Chemistry","2018","42","2","802","","10.1039/C7NJ03446F","","","0.71073","MoKα","","0.1694","0.1295","","","0.3802","0.4026","","","","","","1.478","","","","has coordinates,has disorder","230307","2020-10-21","18:00:00",""
"7056780","11.4912","0.0009","7.2015","0.0005","16.5491","0.0013","90","","100.277","0.002","90","","1347.53","0.18","301","2","301","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","triazole","Ethyl 2-[5-(2,4-dichlorophenyl)-1H-1,2,3-triazol-4-yl]-2-hydroxyacetate","","- C12 H11 Cl2 N3 O3 -","- C12 H11 Cl2 N3 O3 -","- C48 H44 Cl8 N12 O12 -","4","1","","Jannapu Reddy, Raju; Waheed, Md.; Karthik, Thatikonda; Shankar, Angothu","An efficient synthesis of 4,5-disubstituted-2H-1,2,3-triazoles from nitroallylic derivatives via a cycloaddition‒denitration process","New Journal of Chemistry","2018","42","2","980","","10.1039/C7NJ03292G","","","0.71073","MoKα","","0.0465","0.0422","","","0.1138","0.1179","","","","","","1.057","","","","has coordinates","230303","2020-10-21","18:00:00",""
"7056781","6.979","0.0007","8.4645","0.0009","19.895","0.002","90","","90","","90","","1175.3","0.2","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H9 Cl2 N O2 S -","- C10 H9 Cl2 N O2 S -","- C40 H36 Cl8 N4 O8 S4 -","4","1","","Jagtap, Rohidas M.; Thorat, Shridhar H.; Gonnade, Rajesh G.; Khan, Ayesha A.; Pardeshi, Satish K.","X-ray crystal structures and anti-breast cancer property of 3-tert-butoxycarbonyl-2-arylthiazolidine-4-carboxylic acids","New Journal of Chemistry","2018","42","2","1078","","10.1039/C7NJ02961F","","","0.71073","MoKα","","0.0245","0.0239","","","0.0642","0.0648","","","","","","1.023","","","","has coordinates","230305","2020-10-21","18:00:00",""
"7056782","31.2006","0.0017","10.1101","0.0005","5.9607","0.0004","90","","93.505","0.004","90","","1876.73","0.19","296","2","296","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C16 H21 N O5 S -","- C16 H21 N O5 S -","- C64 H84 N4 O20 S4 -","4","1","","Jagtap, Rohidas M.; Thorat, Shridhar H.; Gonnade, Rajesh G.; Khan, Ayesha A.; Pardeshi, Satish K.","X-ray crystal structures and anti-breast cancer property of 3-tert-butoxycarbonyl-2-arylthiazolidine-4-carboxylic acids","New Journal of Chemistry","2018","42","2","1078","","10.1039/C7NJ02961F","","","0.71073","MoKα","","0.0537","0.0492","","","0.1182","0.121","","","","","","1.097","","","","has coordinates","230305","2020-10-21","18:00:00",""
"7056783","10.0776","0.0004","6.3731","0.0003","13.224","0.0006","90","","90.418","0.001","90","","849.3","0.06","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H18 N2 O6 S -","- C15 H18 N2 O6 S -","- C30 H36 N4 O12 S2 -","2","1","","Jagtap, Rohidas M.; Thorat, Shridhar H.; Gonnade, Rajesh G.; Khan, Ayesha A.; Pardeshi, Satish K.","X-ray crystal structures and anti-breast cancer property of 3-tert-butoxycarbonyl-2-arylthiazolidine-4-carboxylic acids","New Journal of Chemistry","2018","42","2","1078","","10.1039/C7NJ02961F","","","0.71073","MoKα","","0.0239","0.0237","","","0.0646","0.0648","","","","","","1.01","","","","has coordinates","230305","2020-10-21","18:00:00",""
"7056784","9.4352","0.0011","10.4526","0.0012","18.336","0.002","90","","90","","90","","1808.3","0.4","296","2","296","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H17 Cl2 N O4 S -","- C15 H17 Cl2 N O4 S -","- C60 H68 Cl8 N4 O16 S4 -","4","1","","Jagtap, Rohidas M.; Thorat, Shridhar H.; Gonnade, Rajesh G.; Khan, Ayesha A.; Pardeshi, Satish K.","X-ray crystal structures and anti-breast cancer property of 3-tert-butoxycarbonyl-2-arylthiazolidine-4-carboxylic acids","New Journal of Chemistry","2018","42","2","1078","","10.1039/C7NJ02961F","","","0.71073","MoKα","","0.0387","0.0372","","","0.0933","0.0945","","","","","","1.094","","","","has coordinates","230305","2020-10-21","18:00:00",""
"7056785","22.5029","0.0005","22.5029","0.0005","6.4423","0.0002","90","","90","","90","","3262.26","0.14","100","2","100","2","","","","","","","","5","I 4","I 4","79","","","","- C15 H19 N O5 S -","- C15 H19 N O5 S -","- C120 H152 N8 O40 S8 -","8","1","","Jagtap, Rohidas M.; Thorat, Shridhar H.; Gonnade, Rajesh G.; Khan, Ayesha A.; Pardeshi, Satish K.","X-ray crystal structures and anti-breast cancer property of 3-tert-butoxycarbonyl-2-arylthiazolidine-4-carboxylic acids","New Journal of Chemistry","2018","42","2","1078","","10.1039/C7NJ02961F","","","0.71073","MoKα","","0.0681","0.0596","","","0.1567","0.1608","","","","","","1.111","","","","has coordinates","230305","2020-10-21","18:00:00",""
"7056786","7.607","0.005","11.845","0.005","12.098","0.005","85.314","0.005","76.322","0.005","84.973","0.005","1053","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H60 Ag N9 O17 -","- C32 H60 Ag N9 O17 -","- C32 H60 Ag N9 O17 -","1","0.5","","Yousuf, Imtiyaz; Usman, Mohammad; Ahmad, Musheer; Tabassum, Sartaj; Arjmand, Farukh","Single X-ray crystal structure, DFT studies and topoisomerase I inhibition activity of a tailored ionic Ag(i) nalidixic acid‒piperazinium drug entity specific for pancreatic cancer cells","New Journal of Chemistry","2018","42","1","506","","10.1039/C7NJ03602G","","","0.71073","MoKα","","0.0319","0.0294","","","0.0701","0.0713","","","","","","1.0704","","","","has coordinates,has disorder","230227","2020-10-21","18:00:00",""
"7056787","15.7895","0.0002","18.862","0.0003","18.1257","0.0002","90","","98.459","0.001","90","","5339.5","0.12","130","0.1","130","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C39 H84 Mo3 N3 O20 V3 -","- C39 H84 Mo3 N3 O20 V3 -","- C156 H336 Mo12 N12 O80 V12 -","4","1","","Karoui, H.; Ritchie, C.","Microwave-assisted synthesis of organically functionalized hexa-molybdovanadates","New Journal of Chemistry","2018","42","1","25","","10.1039/C7NJ02820B","","x-ray","1.54184","CuKα","","0.037","0.0306","","","0.0804","0.0854","","","","","","1.028","","","","has coordinates,has disorder","230226","2020-10-21","18:00:00",""
"7056788","21.4889","0.0013","22.7196","0.0017","24.1556","0.0017","90.952","0.006","93.807","0.005","91.862","0.005","11758.9","1.4","130","0.1","130","0.1","","","","","","","","6","P -1","-P 1","2","","","","- C39 H83 Mo3 N2 O21 V3 -","- C7 H11 Mo3 O21 V3 -","- C56 H88 Mo24 O168 V24 -","8","4","","Karoui, H.; Ritchie, C.","Microwave-assisted synthesis of organically functionalized hexa-molybdovanadates","New Journal of Chemistry","2018","42","1","25","","10.1039/C7NJ02820B","","x-ray","1.54184","CuKα","","0.1909","0.1501","","","0.3839","0.4348","","","","","","1.281","","","","has coordinates,has disorder","230226","2020-10-21","18:00:00",""
"7056789","15.7948","0.0003","18.5129","0.0003","18.243","0.0003","90","","100.088","0.002","90","","5251.92","0.16","130","0.1","130","0.1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H82 Mo3 N4 O19 V3 -","- C38 H82 Mo3 N4 O19 V3 -","- C152 H328 Mo12 N16 O76 V12 -","4","1","","Karoui, H.; Ritchie, C.","Microwave-assisted synthesis of organically functionalized hexa-molybdovanadates","New Journal of Chemistry","2018","42","1","25","","10.1039/C7NJ02820B","","x-ray","1.54184","CuKα","","0.0758","0.0693","","","0.2428","0.2465","","","","","","1.157","","","","has coordinates,has disorder","230226","2020-10-21","18:00:00",""
"7056790","6.3565","0.0016","13.069","0.003","17.04","0.004","90.315","0.003","97.97","0.003","93.548","0.003","1399.1","0.6","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H30 La2 N2 O20 P2 -","- C18 H30 La2 N2 O20 P2 -","- C36 H60 La4 N4 O40 P4 -","2","1","","Wang, Ting-Ting; Su, Yu-Ming; Jiao, Cheng-Qi; Cai, Xiao-Ou; Sun, Hong-Mei; Zhu, Yan-Yu; Sun, Zhen-Gang","Lanthanide oxalatophosphonates with two types of layered structures: syntheses, structures, luminescence and magnetic properties","New Journal of Chemistry","2018","42","2","1235","","10.1039/C7NJ03690F","","","0.71073","MoKα","","0.0659","0.0433","","","0.1087","0.1237","","","","","","1","","","","has coordinates","230294","2020-10-21","18:00:00",""
"7056791","11.5659","0.0004","14.4845","0.0005","15.8549","0.0005","90","","109.415","0.001","90","","2505.07","0.15","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H26 Eu2 N O23 P -","- C13 H26 Eu2 N O23 P -","- C52 H104 Eu8 N4 O92 P4 -","4","1","","Wang, Ting-Ting; Su, Yu-Ming; Jiao, Cheng-Qi; Cai, Xiao-Ou; Sun, Hong-Mei; Zhu, Yan-Yu; Sun, Zhen-Gang","Lanthanide oxalatophosphonates with two types of layered structures: syntheses, structures, luminescence and magnetic properties","New Journal of Chemistry","2018","42","2","1235","","10.1039/C7NJ03690F","","","0.71073","MoKα","","0.0285","0.0217","","","0.0499","0.0525","","","","","","1.035","","","","has coordinates,has disorder","230294","2020-10-21","18:00:00",""
"7056792","6.3158","0.0007","12.9942","0.0013","17.0265","0.0018","90.405","0.001","98.044","0.001","93.494","0.001","1380.9","0.3","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H30 Ce2 N2 O20 P2 -","- C18 H30 Ce2 N2 O20 P2 -","- C36 H60 Ce4 N4 O40 P4 -","2","1","","Wang, Ting-Ting; Su, Yu-Ming; Jiao, Cheng-Qi; Cai, Xiao-Ou; Sun, Hong-Mei; Zhu, Yan-Yu; Sun, Zhen-Gang","Lanthanide oxalatophosphonates with two types of layered structures: syntheses, structures, luminescence and magnetic properties","New Journal of Chemistry","2018","42","2","1235","","10.1039/C7NJ03690F","","","0.71073","MoKα","","0.0524","0.0354","","","0.0954","0.1075","","","","","","1.014","","","","has coordinates","230294","2020-10-21","18:00:00",""
"7056793","11.4663","0.0004","14.3926","0.0005","15.8262","0.0006","90","","109.428","0.001","90","","2463.08","0.15","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H26 Dy2 N O23 P -","- C13 H26 Dy2 N O23 P -","- C52 H104 Dy8 N4 O92 P4 -","4","1","","Wang, Ting-Ting; Su, Yu-Ming; Jiao, Cheng-Qi; Cai, Xiao-Ou; Sun, Hong-Mei; Zhu, Yan-Yu; Sun, Zhen-Gang","Lanthanide oxalatophosphonates with two types of layered structures: syntheses, structures, luminescence and magnetic properties","New Journal of Chemistry","2018","42","2","1235","","10.1039/C7NJ03690F","","","0.71073","MoKα","","0.0324","0.0243","","","0.0538","0.0567","","","","","","1.009","","","","has coordinates,has disorder","230294","2020-10-21","18:00:00",""
"7056794","6.2863","0.0006","12.9372","0.0012","17.022","0.0015","90.348","0.001","98.056","0.001","93.498","0.001","1368","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H30 N2 O20 P2 Pr2 -","- C18 H30 N2 O20 P2 Pr2 -","- C36 H60 N4 O40 P4 Pr4 -","2","1","","Wang, Ting-Ting; Su, Yu-Ming; Jiao, Cheng-Qi; Cai, Xiao-Ou; Sun, Hong-Mei; Zhu, Yan-Yu; Sun, Zhen-Gang","Lanthanide oxalatophosphonates with two types of layered structures: syntheses, structures, luminescence and magnetic properties","New Journal of Chemistry","2018","42","2","1235","","10.1039/C7NJ03690F","","","0.71073","MoKα","","0.0614","0.0332","","","0.0706","0.082","","","","","","1.023","","","","has coordinates","230294","2020-10-21","18:00:00",""
"7056795","11.785","0.005","12.353","0.005","15.745","0.005","112.037","0.005","103.923","0.005","98.618","0.005","1987.5","1.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H33 Cl4 Cu4 N12 O -","- C38 H33 Cl4 Cu4 N12 O -","- C76 H66 Cl8 Cu8 N24 O2 -","2","1","","Zabierowski, Piotr; Hodorowicz, Maciej; Szklarzewicz, Janusz","Templated metalophilicity: synthesis of halometallic double salts directed by a dicopper(i) hydrazinyl-tetraimine nanocation","New Journal of Chemistry","2018","42","2","817","","10.1039/C7NJ03919K","","","0.71073","MoKα","","0.0573","0.0437","","","0.1126","0.122","","","","","","1.041","","","","has coordinates","230298","2020-10-21","18:00:00",""
"7056796","10.1182","0.0002","12.9469","0.0003","12.1513","0.0004","90","","99.671","0.002","90","","1569.19","0.07","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 N6 -","- C18 H16 N6 -","- C72 H64 N24 -","4","1","","Zabierowski, Piotr; Hodorowicz, Maciej; Szklarzewicz, Janusz","Templated metalophilicity: synthesis of halometallic double salts directed by a dicopper(i) hydrazinyl-tetraimine nanocation","New Journal of Chemistry","2018","42","2","817","","10.1039/C7NJ03919K","","","0.71073","MoKα","","0.0699","0.0407","","","0.1102","0.1301","","","","","","0.761","","","","has coordinates","230298","2020-10-21","18:00:00",""
"7056797","11.82","0.0003","12.8808","0.0003","15.647","0.0004","111.058","0.002","104.035","0.002","99.087","0.002","2076.29","0.1","120","2","120.8","0.6","","","","","","","","7","P -1","-P 1","2","","","","- C38 H38 Cl4 Cu2.5 La0.5 N12 O -","- C38 H38 Cl4 Cu2.5 La0.5 N12 O -","- C76 H76 Cl8 Cu5 La N24 O2 -","2","1","","Zabierowski, Piotr; Hodorowicz, Maciej; Szklarzewicz, Janusz","Templated metalophilicity: synthesis of halometallic double salts directed by a dicopper(i) hydrazinyl-tetraimine nanocation","New Journal of Chemistry","2018","42","2","817","","10.1039/C7NJ03919K","","x-ray","0.71073","MoKα","","0.061","0.0501","","","0.1356","0.1433","","","","","","1.067","","","","has coordinates","230298","2020-10-21","18:00:00",""
"7056798","11.6842","0.0003","12.3404","0.0004","15.7885","0.0003","112.226","0.003","102.317","0.002","98.889","0.003","1988","0.11","120","2","120","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H32 Cl4 Cu3 Mn0.5 N12 O0 -","- C36 H32 Cl4 Cu3 Mn0.5 N12 -","- C72 H64 Cl8 Cu6 Mn N24 -","2","1","","Zabierowski, Piotr; Hodorowicz, Maciej; Szklarzewicz, Janusz","Templated metalophilicity: synthesis of halometallic double salts directed by a dicopper(i) hydrazinyl-tetraimine nanocation","New Journal of Chemistry","2018","42","2","817","","10.1039/C7NJ03919K","","","0.71073","MoKα","","0.0982","0.0731","","","0.1984","0.2262","","","","","","1.034","","","","has coordinates","230298","2020-10-21","18:00:00",""
"7056799","10.0102","0.0003","9.8872","0.0003","38.8711","0.0014","90","","90","","90","","3847.2","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C19 H20 Co N2 O7 -","- C19 H20 Co N2 O7 -","- C152 H160 Co8 N16 O56 -","8","1","","Scaldini, Felipe Mageste; Ramalho Freitas, Maria Clara; De Souza Reis, Mario; Yoshida, Maria Irene; Krambrock, Klaus; Machado, Flávia Cavalieri","A Co(ii) 1D coordination polymer constructed from 1,3-bisbenzyl-2-oxoimidazoline-4,5-dicarboxylic acid: crystal structure and magnetic properties","New Journal of Chemistry","2018","42","2","1216","","10.1039/C7NJ04564F","","","0.71073","MoKα","","0.0685","0.0398","","","0.0845","0.0939","","","","","","1.037","","","","has coordinates","230301","2020-10-21","18:00:00",""
"7056800","9.3123","0.0019","10.147","0.002","16.201","0.003","83.79","0.03","76.06","0.03","67.55","0.03","1373","0.6","293","2","293.15","","","","","","","","","7","P -1","-P 1","2","","","","- C56 H50 F6 N2 O4 P2 Pt2 -","- C50 H36 F6 N2 O4 P2 Pt2 -","- C50 H36 F6 N2 O4 P2 Pt2 -","1","0.5","","Paziresh, Sareh; Babadi Aghakhanpour, Reza; Rashidi, Mehdi; Nabavizadeh, S. Masoud","Simple tuning of the luminescence properties of the double rollover cycloplatinated(ii) structure by halide ligands","New Journal of Chemistry","2018","42","2","1337","","10.1039/C7NJ03817H","","","0.71073","MoKα","","0.0446","0.0326","","","0.068","0.0696","","","","","","0.849","","","","has coordinates","230293","2020-10-21","18:00:00",""
"7056801","9.2377","0.0003","33.9062","0.0009","9.4263","0.0003","90","","97.036","0.003","90","","2930.23","0.16","200","2","200","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C50 H74 N2 O12 Sn4 -","- C50 H74 N2 O12 Sn4 -","- C100 H148 N4 O24 Sn8 -","2","1","","Singh, Navjot; Srivastav, Neha; Singh, Raghubir; Kaur, Varinder; Brendler, Erica; Wagler, Jörg; Kroke, Edwin","Fluorescent biogenic Schiff base compounds of dimethyltin","New Journal of Chemistry","2018","42","3","1655","","10.1039/C7NJ03731G","","","0.71073","MoKα","","0.0325","0.0265","","","0.0579","0.0624","","","","","","1.241","","","","has coordinates","230568","2020-10-21","18:00:00",""
"7056802","11.1773","0.0003","14.8332","0.0004","34.5406","0.0012","90","","90","","90","","5726.7","0.3","200","2","200","2","","","","","","","None","6","C 2 2 21","C 2c 2","20","","","","- C48 H70 N2 O12 S2 Sn4 -","- C48 H70 N2 O12 S2 Sn4 -","- C192 H280 N8 O48 S8 Sn16 -","4","0.5","","Singh, Navjot; Srivastav, Neha; Singh, Raghubir; Kaur, Varinder; Brendler, Erica; Wagler, Jörg; Kroke, Edwin","Fluorescent biogenic Schiff base compounds of dimethyltin","New Journal of Chemistry","2018","42","3","1655","","10.1039/C7NJ03731G","","","0.71073","MoKα","","0.0536","0.0372","","","0.0789","0.0871","","","","","","1.095","","","","has coordinates","230568","2020-10-21","18:00:00",""
"7056803","9.5407","0.0009","10.9474","0.0009","11.1232","0.0011","79.173","0.007","65.013","0.007","68.424","0.007","978.52","0.17","200","2","200","2","","","","","","","None","5","P -1","-P 1","2","","","","- C19 H23 N O5 Sn -","- C19 H23 N O5 Sn -","- C38 H46 N2 O10 Sn2 -","2","1","","Singh, Navjot; Srivastav, Neha; Singh, Raghubir; Kaur, Varinder; Brendler, Erica; Wagler, Jörg; Kroke, Edwin","Fluorescent biogenic Schiff base compounds of dimethyltin","New Journal of Chemistry","2018","42","3","1655","","10.1039/C7NJ03731G","","","0.71073","MoKα","","0.022","0.0204","","","0.0514","0.0523","","","","","","1.118","","","","has coordinates","230568","2020-10-21","18:00:00",""
"7056804","9.4379","0.0009","12.1544","0.0011","9.8277","0.0009","90","","96.861","0.001","90","","1119.28","0.18","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 O2 -","- C14 H14 O2 -","- C56 H56 O8 -","4","1","","Zuo, Youpeng; He, Xinwei; Ning, Yi; Zhang, Lanlan; Wu, Yuhao; Shang, Yongjia","Divergent synthesis of 3,4-dihydrodibenzo[b,d]furan-1(2H)-ones and isocoumarins via additive-controlled chemoselective C‒C or C‒N bond cleavage","New Journal of Chemistry","2018","42","3","1673","","10.1039/C7NJ03799F","","","0.71073","MoKα","","0.047","0.0426","","","0.1065","0.1112","","","","","","1.101","","","","has coordinates","230564","2020-10-21","18:00:00",""
"7056805","8.8746","0.0006","15.3282","0.0011","10.0135","0.0007","90","","95.182","0.002","90","","1356.59","0.16","273","2","273","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 O4 -","- C16 H16 O4 -","- C64 H64 O16 -","4","1","","Zuo, Youpeng; He, Xinwei; Ning, Yi; Zhang, Lanlan; Wu, Yuhao; Shang, Yongjia","Divergent synthesis of 3,4-dihydrodibenzo[b,d]furan-1(2H)-ones and isocoumarins via additive-controlled chemoselective C‒C or C‒N bond cleavage","New Journal of Chemistry","2018","42","3","1673","","10.1039/C7NJ03799F","","","0.71073","MoKα","","0.0583","0.0487","","","0.1189","0.1304","","","","","","1.025","","","","has coordinates","230564","2020-10-21","18:00:00",""
"7056806","9.6856","0.0003","9.6856","0.0003","51.069","0.0016","90","","90","","90","","4790.8","0.3","100","2","100","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C23 H33 N3 O6 -","- C23 H33 N3 O6 -","- C184 H264 N24 O48 -","8","1","","Kotmale, Amol S.; Sangtani, Ekta; Gonnade, Rajesh G.; Sarkar, Dhiman; Burade, Sachin; Rajamohanan, Pattuparambil R.; Sanjayan, Gangadhar J.","Conformational studies of Ant‒Pro motif-incorporated cyclic peptides: gramicidin S and avellanin","New Journal of Chemistry","2018","42","2","1197","","10.1039/C7NJ03701E","","","1.54178","CuKα","","0.0432","0.0384","","","0.0844","0.0869","","","","","","1.022","","","","has coordinates","230296","2020-10-21","18:00:00",""
"7056807","13.3238","0.0005","7.2153","0.0003","13.5409","0.0006","90","","114.187","0.001","90","","1187.48","0.09","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H33 N3 O6 -","- C23 H33 N3 O6 -","- C46 H66 N6 O12 -","2","1","","Kotmale, Amol S.; Sangtani, Ekta; Gonnade, Rajesh G.; Sarkar, Dhiman; Burade, Sachin; Rajamohanan, Pattuparambil R.; Sanjayan, Gangadhar J.","Conformational studies of Ant‒Pro motif-incorporated cyclic peptides: gramicidin S and avellanin","New Journal of Chemistry","2018","42","2","1197","","10.1039/C7NJ03701E","","","0.71073","MoKα","","0.0382","0.0352","","","0.0856","0.0872","","","","","","1.038","","","","has coordinates","230296","2020-10-21","18:00:00",""
"7056808","11.4708","0.0006","14.4673","0.0007","9.4198","0.0005","90","","98.641","0.002","90","","1545.49","0.14","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","S130","","","- C34 H38 Cu2 N6 O4 -","- C34 H38 Cu2 N6 O4 -","- C68 H76 Cu4 N12 O8 -","2","0.5","","Khan, Samim; Sproules, Stephen; Natrajan, Louise S.; Harms, Klaus; Chattopadhyay, Shouvik","End-on cyanate or end-to-end thiocyanate bridged dinuclear copper(ii) complexes with a tridentate Schiff base blocking ligand: synthesis, structure and magnetic studies","New Journal of Chemistry","2018","42","3","1634","","10.1039/C7NJ03990E","","","0.71073","MoKα","","0.0231","0.0207","","","0.055","0.0562","","","","","","1.084","","","","has coordinates","230571","2020-10-21","18:00:00",""
"7056809","15.51","0.0004","7.1497","0.0003","19.7873","0.0005","90","","101.121","0.002","90","","2153.05","0.12","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H56 Cu2 N8 O6 S2 -","- C40 H56 Cu2 N8 O6 S2 -","- C80 H112 Cu4 N16 O12 S4 -","2","0.5","","Khan, Samim; Sproules, Stephen; Natrajan, Louise S.; Harms, Klaus; Chattopadhyay, Shouvik","End-on cyanate or end-to-end thiocyanate bridged dinuclear copper(ii) complexes with a tridentate Schiff base blocking ligand: synthesis, structure and magnetic studies","New Journal of Chemistry","2018","42","3","1634","","10.1039/C7NJ03990E","","","0.71073","MoKα","","0.0281","0.0243","","","0.0738","0.0748","","","","","","1.079","","","","has coordinates","230571","2020-10-21","18:00:00",""
"7056810","14.6027","0.0007","7.1994","0.0004","18.1327","0.001","90","","107.694","0.002","90","","1816.12","0.17","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H15 F N4 O2 S -","- C20 H15 F N4 O2 S -","- C80 H60 F4 N16 O8 S4 -","4","1","","Grice, Kyle A.; Patil, Renukadevi; Ghosh, Anandita; Paner, Jesse D.; Guerrero, Michael A.; Camacho, Ehxciquiel Jaeroume M.; Sun Cao, Phoebus; Niyazi, Aeshah H.; Zainab, Sitwat; Sommer, Roger D.; Waris, Gulam; Patil, Shivaputra","Understanding the structure and reactivity of the C‒S linkage in biologically active 5-arylthio-5H-chromenopyridines","New Journal of Chemistry","2018","42","2","1151","","10.1039/C7NJ03724D","","","0.71073","MoKα","","0.0553","0.0377","","","0.093","0.1018","","","","","","1.025","","","","has coordinates","230290","2020-10-21","18:00:00",""
"7056811","21.6226","0.0004","14.4826","0.0004","13.0479","0.0003","90","","112.052","0.002","90","","3787.05","0.16","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","SP123","","","- C21 H18 N4 O3 S -","- C21 H18 N4 O3 S -","- C168 H144 N32 O24 S8 -","8","1","","Grice, Kyle A.; Patil, Renukadevi; Ghosh, Anandita; Paner, Jesse D.; Guerrero, Michael A.; Camacho, Ehxciquiel Jaeroume M.; Sun Cao, Phoebus; Niyazi, Aeshah H.; Zainab, Sitwat; Sommer, Roger D.; Waris, Gulam; Patil, Shivaputra","Understanding the structure and reactivity of the C‒S linkage in biologically active 5-arylthio-5H-chromenopyridines","New Journal of Chemistry","2018","42","2","1151","","10.1039/C7NJ03724D","","","0.71073","MoKα","","0.056","0.0393","","","0.0945","0.1053","","","","","","1.029","","","","has coordinates","230290","2020-10-21","18:00:00",""
"7056812","12.513","0.002","23.56","0.004","12.192","0.002","90","","113.435","0.002","90","","3297.8","0.9","293.15","","293.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H64 Co2 Dy2 N2 O20 -","- C66 H64 Co2 Dy2 N2 O20 -","- C132 H128 Co4 Dy4 N4 O40 -","2","0.5","","Chen, Sihuai; Mereacre, Valeriu; Zhao, Zhiying; Zhang, Wanwan; He, Zhangzhen","Synthesis, structures and magnetic properties of linear {CoII2LnIII2} coordination clusters","New Journal of Chemistry","2018","42","2","1284","","10.1039/C7NJ04022A","","","0.71073","MoKα","","0.0278","0.0261","","","0.0739","0.0748","","","","","","1.083","","","","has coordinates","230299","2020-10-21","18:00:00",""
"7056813","12.481","0.007","23.401","0.013","12.163","0.008","90","","113.477","0.011","90","","3258","3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H64 Co2 N2 O20 Y2 -","- C66 H64 Co2 N2 O20 Y2 -","- C132 H128 Co4 N4 O40 Y4 -","2","0.5","","Chen, Sihuai; Mereacre, Valeriu; Zhao, Zhiying; Zhang, Wanwan; He, Zhangzhen","Synthesis, structures and magnetic properties of linear {CoII2LnIII2} coordination clusters","New Journal of Chemistry","2018","42","2","1284","","10.1039/C7NJ04022A","","","0.71073","MoKα","","0.0592","0.0522","","","0.1297","0.134","","","","","","1.109","","","","has coordinates","230299","2020-10-21","18:00:00",""
"7056814","12.454","0.005","23.648","0.009","12.216","0.005","90","","113.724","0.007","90","","3294","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H64 Co2 Gd2 N2 O20 -","- C66 H64 Co2 Gd2 N2 O20 -","- C132 H128 Co4 Gd4 N4 O40 -","2","0.5","","Chen, Sihuai; Mereacre, Valeriu; Zhao, Zhiying; Zhang, Wanwan; He, Zhangzhen","Synthesis, structures and magnetic properties of linear {CoII2LnIII2} coordination clusters","New Journal of Chemistry","2018","42","2","1284","","10.1039/C7NJ04022A","","","0.71073","MoKα","","0.0537","0.0426","","","0.0874","0.0928","","","","","","1.05","","","","has coordinates","230299","2020-10-21","18:00:00",""
"7056815","11.7364","0.0003","11.7364","0.0003","11.7364","0.0003","90","","90","","90","","1616.61","0.07","293","2","293","2","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","(Hg6P4)(CrCl6)Cl","","- Cl7 Cr Hg6 P4 -","- Cl7 Cr Hg6 P4 -","- Cl28 Cr4 Hg24 P16 -","4","0.166667","","Peng, Si-Yan; Yang, Liu-Sai; Yao, Ming-Shui; Yu, Le-Shu","A new pnictidehalide with van der Waals host‒guest interactions exhibiting both geometric spin frustration and resistive humidity sensitivity","New Journal of Chemistry","2018","42","3","1787","","10.1039/C7NJ03351F","","","0.71073","MoKα","","0.0284","0.0264","","","0.0681","0.0687","","","","","","1.097","","","","has coordinates","230570","2020-10-21","18:00:00",""
"7056816","19.1652","0.0002","15.1252","0.0004","7.3394","0.0001","90","","90","","90","","2127.53","0.07","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Mn(2-MIm)2[Fe(CN)5NO]2H2O","Manganese bis-2-methylimidazole Nitrosylpentacyanoferrate (III) dihydrate","","- C26 Fe2 Mn2 N20 O6 -","- C13 Fe Mn N10 O3 -","- C52 Fe4 Mn4 N40 O12 -","4","1","","Di Santo, A.; Osiry, H.; Reguera, E.; Alborés, P.; Carbonio, R. E.; Ben Altabef, A.; Gil, Diego M.","New coordination polymers based on 2-methylimidazole and transition metal nitroprusside containing building blocks: synthesis, structure and magnetic properties","New Journal of Chemistry","2018","42","2","1347","","10.1039/C7NJ03585C","powder diffraction","","1.5406","CuKα","","","0.0922","","","","0.127","","13.671","1.449","","","","","","","has coordinates","230306","2020-10-21","18:00:00",""
"7056817","19.0005","0.0002","14.7563","0.0001","7.1233","0.0005","90","","90","","90","","1997.21","0.14","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Ni(2-MIm)2[Fe(CN)5NO]2H2O","Nikel bis-2-methylimidazole Nitrosylpentacyanoferrate (III) dihydrate","","- C26 Fe2 N20 Ni2 O6 -","- C26 Fe2 N20 Ni2 O6 -","- C52 Fe4 N40 Ni4 O12 -","2","0.5","","Di Santo, A.; Osiry, H.; Reguera, E.; Alborés, P.; Carbonio, R. E.; Ben Altabef, A.; Gil, Diego M.","New coordination polymers based on 2-methylimidazole and transition metal nitroprusside containing building blocks: synthesis, structure and magnetic properties","New Journal of Chemistry","2018","42","2","1347","","10.1039/C7NJ03585C","powder diffraction","","1.5406","CuKα","","","0.0922","","","","0.127","","7.253","1.769","","","","","","","has coordinates","230306","2020-10-21","18:00:00",""
"7056818","19","0.0005","14.9003","0.0005","7.1784","0.0002","90","","90","","90","","2032.25","0.1","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Co(2-MIm)2[Fe(CN)5NO]2H2O","Cobalt bis-2-methylimidazole Nitrosylpentacyanoferrate (III) dihydrate","","- C26 Co2 Fe2 N20 O6 -","- C13 Co Fe N10 O2 -","- C52 Co4 Fe4 N40 O8 -","4","1","","Di Santo, A.; Osiry, H.; Reguera, E.; Alborés, P.; Carbonio, R. E.; Ben Altabef, A.; Gil, Diego M.","New coordination polymers based on 2-methylimidazole and transition metal nitroprusside containing building blocks: synthesis, structure and magnetic properties","New Journal of Chemistry","2018","42","2","1347","","10.1039/C7NJ03585C","powder diffraction","","1.5406","CuKα","","","0.0922","","","","0.127","","13.219","1.2","","","","","","","has coordinates","230306","2020-10-21","18:00:00",""
"7056819","19.0271","0.0004","14.9773","0.0005","7.249","0.0001","90","","90","","90","","2065.78","0.09","298","","298","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Fe(2-MIm)2[Fe(CN)5NO]2H2O","Iron bis-2-methylimidazole Nitrosylpentacyanoferrate (III) dihydrate","","- C26 Fe4 N20 O6 -","- C13 Fe2 N10 O2 -","- C52 Fe8 N40 O8 -","4","1","","Di Santo, A.; Osiry, H.; Reguera, E.; Alborés, P.; Carbonio, R. E.; Ben Altabef, A.; Gil, Diego M.","New coordination polymers based on 2-methylimidazole and transition metal nitroprusside containing building blocks: synthesis, structure and magnetic properties","New Journal of Chemistry","2018","42","2","1347","","10.1039/C7NJ03585C","powder diffraction","","1.5406","CuKα","","","0.0922","","","","0.127","","11.633","1.191","","","","","","","has coordinates","230306","2020-10-21","18:00:00",""
"7056820","20.7006","0.0007","10.2318","0.0003","14.8913","0.0005","90","","133.694","0.001","90","","2280.5","0.13","298","2","298","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H11 N O2 -","- C15 H11 N O2 -","- C120 H88 N8 O16 -","8","1","","Lozano-Gonzalez, Mariana; Ramírez-Apan, María Teresa; Nieto-Camacho, Antonio; Toscano, Ruben Alfredo; Sanchez-Sandoval, Ana Laura; Alvarez-Toledano, Cecilio","Anticarcinogenic and metal chelation properties of novel hydroxybenzylidene-1-indanone derivatives in the U-251 glioblastoma cell line","New Journal of Chemistry","2018","42","5","3878","","10.1039/C7NJ04266C","","","0.71073","MoKα","","0.0638","0.0424","","","0.0973","0.113","","","","","","1.029","","","","has coordinates","230255","2020-10-21","18:00:00",""
"7056821","22.449","0.005","12.536","0.003","11.224","0.002","90","","99.98","0.004","90","","3110.9","1.2","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 Fe O2 -","- C20 H16 Fe O2 -","- C160 H128 Fe8 O16 -","8","2","","Lozano-Gonzalez, Mariana; Ramírez-Apan, María Teresa; Nieto-Camacho, Antonio; Toscano, Ruben Alfredo; Sanchez-Sandoval, Ana Laura; Alvarez-Toledano, Cecilio","Anticarcinogenic and metal chelation properties of novel hydroxybenzylidene-1-indanone derivatives in the U-251 glioblastoma cell line","New Journal of Chemistry","2018","42","5","3878","","10.1039/C7NJ04266C","","","0.71073","MoKα","","0.1906","0.1139","","","0.1075","0.1194","","","","","","1.134","","","","has coordinates,has disorder","230255","2020-10-21","18:00:00",""
"7056822","33.5336","0.0006","13.8058","0.0003","15.6001","0.0004","90","","111.439","0.002","90","","6722.5","0.3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H36 Cl2 Fe2 N7 P3 -","- C28 H36 Cl2 Fe2 N7 P3 -","- C224 H288 Cl16 Fe16 N56 P24 -","8","1","","Tümer, Yasemin; Asmafiliz, Nuran; Zeyrek, C. Tuğrul; Kılıç, Zeynel; Açık, Leyla; Çelik, S. Pınar; Türk, Mustafa; Çağdaş Tunalı, B.; Ünver, Hüseyin; Hökelek, Tuncer","Syntheses, spectroscopic and crystallographic characterizations of cis- and trans-dispirocyclic ferrocenylphosphazenes: molecular dockings, cytotoxic and antimicrobial activities","New Journal of Chemistry","2018","42","3","1740","","10.1039/C7NJ03643D","","","0.71073","MoKα","","0.1056","0.0725","","","0.1394","0.1595","","","","","","1.06","","","","has coordinates","230566","2020-10-21","18:00:00",""
"7056823","12.0597","0.0003","12.0704","0.0003","13.6777","0.0004","94.87","0.003","94.937","0.003","118.558","0.004","1724.11","0.11","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H40 Cl2 Fe2 N7 P3 -","- C30 H40 Cl2 Fe2 N7 P3 -","- C60 H80 Cl4 Fe4 N14 P6 -","2","1","","Tümer, Yasemin; Asmafiliz, Nuran; Zeyrek, C. Tuğrul; Kılıç, Zeynel; Açık, Leyla; Çelik, S. Pınar; Türk, Mustafa; Çağdaş Tunalı, B.; Ünver, Hüseyin; Hökelek, Tuncer","Syntheses, spectroscopic and crystallographic characterizations of cis- and trans-dispirocyclic ferrocenylphosphazenes: molecular dockings, cytotoxic and antimicrobial activities","New Journal of Chemistry","2018","42","3","1740","","10.1039/C7NJ03643D","","","0.71073","MoKα","","0.067","0.0547","","","0.1347","0.1457","","","","","","1.185","","","","has coordinates","230566","2020-10-21","18:00:00",""
"7056824","9.2205","0.0003","18.7632","0.0005","19.8553","0.0005","90","","97.007","0.003","90","","3409.43","0.17","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 Cl2 Fe2 N7 P3 -","- C30 H40 Cl2 Fe2 N7 P3 -","- C120 H160 Cl8 Fe8 N28 P12 -","4","1","","Tümer, Yasemin; Asmafiliz, Nuran; Zeyrek, C. Tuğrul; Kılıç, Zeynel; Açık, Leyla; Çelik, S. Pınar; Türk, Mustafa; Çağdaş Tunalı, B.; Ünver, Hüseyin; Hökelek, Tuncer","Syntheses, spectroscopic and crystallographic characterizations of cis- and trans-dispirocyclic ferrocenylphosphazenes: molecular dockings, cytotoxic and antimicrobial activities","New Journal of Chemistry","2018","42","3","1740","","10.1039/C7NJ03643D","","","0.71073","MoKα","","0.0546","0.0383","","","0.0818","0.0927","","","","","","1.09","","","","has coordinates","230566","2020-10-21","18:00:00",""
"7056825","14.6671","0.0003","16.1963","0.0004","17.2882","0.0004","85.935","0.004","69.201","0.003","64.861","0.003","3460.02","0.18","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H40 Cl2 Fe2 N7 P3 -","- C30 H40 Cl2 Fe2 N7 P3 -","- C120 H160 Cl8 Fe8 N28 P12 -","4","2","","Tümer, Yasemin; Asmafiliz, Nuran; Zeyrek, C. Tuğrul; Kılıç, Zeynel; Açık, Leyla; Çelik, S. Pınar; Türk, Mustafa; Çağdaş Tunalı, B.; Ünver, Hüseyin; Hökelek, Tuncer","Syntheses, spectroscopic and crystallographic characterizations of cis- and trans-dispirocyclic ferrocenylphosphazenes: molecular dockings, cytotoxic and antimicrobial activities","New Journal of Chemistry","2018","42","3","1740","","10.1039/C7NJ03643D","","","0.71073","MoKα","","0.0843","0.0531","","","0.1319","0.1562","","","","","","1.059","","","","has coordinates","230566","2020-10-21","18:00:00",""
"7056826","7.4895","0.0004","28.0652","0.0015","9.2016","0.0006","90","","91.862","0.002","90","","1933.1","0.19","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/a 1","-P 2yab","14","","","","- C17 H22 Cl3 N3 O Zr -","- C17 H22 Cl3 N3 O Zr -","- C68 H88 Cl12 N12 O4 Zr4 -","4","1","","Pinheiro, A. C.; da Silva, S. M.; Roisnel, T.; Kirillov, E.; Carpentier, J.-F.; Casagrande, Osvaldo L.","Synthesis and structural characterization of zirconium complexes supported by tridentate pyrrolide-imino ligands with pendant N-, O- and S-donor groups and their application in ethylene polymerization","New Journal of Chemistry","2018","42","2","1477","","10.1039/C7NJ04074A","","x-ray","0.71073","MoKα","","0.0458","0.0323","","","0.0654","0.0712","","","","","","1.049","","","","has coordinates","230302","2020-10-21","18:00:00",""
"7056827","15.6351","0.0004","7.2529","0.0002","16.5555","0.0003","90","","95.551","0.001","90","","1868.59","0.08","150","2","150","2","","","","","","","synthesis as described","6","P 1 21/a 1","-P 2yab","14","","","","- C17 H21 Cl2 N3 O Zr -","- C17 H21 Cl2 N3 O Zr -","- C68 H84 Cl8 N12 O4 Zr4 -","4","1","","Pinheiro, A. C.; da Silva, S. M.; Roisnel, T.; Kirillov, E.; Carpentier, J.-F.; Casagrande, Osvaldo L.","Synthesis and structural characterization of zirconium complexes supported by tridentate pyrrolide-imino ligands with pendant N-, O- and S-donor groups and their application in ethylene polymerization","New Journal of Chemistry","2018","42","2","1477","","10.1039/C7NJ04074A","","x-ray","0.71073","MoKα","","0.0342","0.0279","","","0.0717","0.0753","","","","","","1.053","","","","has coordinates","230302","2020-10-21","18:00:00",""
"7056828","16.5855","0.0007","15.671","0.0008","23.4002","0.0012","90","","90","","90","","6082","0.5","298","2","298","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C32 H37 Cl N3 O3 Rh -","- C32 H37 Cl N3 O3 Rh -","- C256 H296 Cl8 N24 O24 Rh8 -","8","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0437","0.0356","","","0.0732","0.0763","","","","","","1.111","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056829","11.5855","0.0007","20.6617","0.0011","15.7428","0.0009","90","","101.585","0.006","90","","3691.7","0.4","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C37 H38 F3 N6 O4 Rh -","- C37 H38 F3 N6 O4 Rh -","- C148 H152 F12 N24 O16 Rh4 -","4","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0934","0.0603","","","0.1151","0.1278","","","","","","1.083","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056830","8.07","0.005","15.118","0.005","24.291","0.005","90","","90","","90","","2964","2","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H28 Cl3 N6 Rh -","- C29 H28 Cl3 N6 Rh -","- C116 H112 Cl12 N24 Rh4 -","4","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0488","0.0425","","","0.0808","0.0833","","","","","","1.102","","","","has coordinates,has disorder","230567","2020-10-21","18:00:00",""
"7056831","8.5148","0.0005","23.9553","0.0015","15.3322","0.0009","90","","104.954","0.006","90","","3021.5","0.3","298","2","298","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C32 H37 Cl N3 Rh -","- C32 H37 Cl N3 Rh -","- C128 H148 Cl4 N12 Rh4 -","4","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0281","0.0258","","","0.0603","0.0615","","","","","","1.1","","","","has coordinates,has disorder","230567","2020-10-21","18:00:00",""
"7056832","9.108","0.005","15.326","0.007","15.923","0.003","70.18","0.03","76.95","0.03","91.43","0.04","2024.5","1.6","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H35 Cl6 N6 O4 Rh -","- C36 H35 Cl6 N6 O4 Rh -","- C72 H70 Cl12 N12 O8 Rh2 -","2","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.1041","0.0685","","","0.1493","0.1775","","","","","","1.052","","","","has coordinates,has disorder","230567","2020-10-21","18:00:00",""
"7056833","8.019","0.0013","15.4071","0.0012","12.3484","0.0018","90","","96.644","0.014","90","","1515.4","0.4","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C32 H37 Cl Ir N3 O3 -","- C32 H37 Cl Ir N3 O3 -","- C64 H74 Cl2 Ir2 N6 O6 -","2","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0371","0.0321","","","0.0531","0.0559","","","","","","1.016","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056834","8.8527","0.0008","20.0313","0.0013","16.1061","0.0009","90","","104.206","0.007","90","","2768.8","0.4","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H28 F3 N6 Rh -","- C29 H28 F3 N6 Rh -","- C116 H112 F12 N24 Rh4 -","4","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.1087","0.0737","","","0.1201","0.1308","","","","","","1.164","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056835","7.7877","0.0002","10.8878","0.0003","18.3953","0.0005","93.177","0.002","100.148","0.002","98.666","0.002","1512.43","0.07","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H37 N6 O3 Rh -","- C32 H37 N6 O3 Rh -","- C64 H74 N12 O6 Rh2 -","2","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0333","0.0303","","","0.0786","0.0804","","","","","","1.11","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056836","11.477","0.0004","21.3791","0.0006","12.3167","0.0004","90","","98.643","0.003","90","","2987.8","0.17","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H37 N6 Rh -","- C32 H37 N6 Rh -","- C128 H148 N24 Rh4 -","4","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0644","0.0457","","","0.088","0.0951","","","","","","1.068","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056837","9.2161","0.0004","25.0946","0.0009","16.4992","0.0006","90","","102.663","0.004","90","","3723","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H43 N6 O7 Rh -","- C38 H43 N6 O7 Rh -","- C152 H172 N24 O28 Rh4 -","4","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.1238","0.0738","","","0.1191","0.1362","","","","","","1.088","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056838","46.5307","0.001","8.6162","0.0003","15.9481","0.0003","90","","93.121","0.002","90","","6384.4","0.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H43 Cl N3 Rh -","- C35 H43 Cl N3 Rh -","- C280 H344 Cl8 N24 Rh8 -","8","1","","Kumar, Robin; Kishan, Ram; Thomas, Jisha Mary; Chinnappan, Sivasankar; Thirupathi, Natesan","Probing the factors that influence the conformation of a guanidinato ligand in [(η5-C5Me5)M(NN)X] (NN = chelating N,N′,N′′-tri(o-substituted aryl)guanidinate(1−); X = chloro, azido and triazolato)","New Journal of Chemistry","2018","42","3","1853","","10.1039/C7NJ03766J","","","0.71073","MoKα","","0.0566","0.0475","","","0.1047","0.1088","","","","","","1.15","","","","has coordinates","230567","2020-10-21","18:00:00",""
"7056839","3.9167","0.0005","12.712","0.002","27.168","0.004","90","","91.078","0.007","90","","1352.4","0.3","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C21 H13 N -","- C21 H13 N -","- C84 H52 N4 -","4","1","","Kachwal, Vishal; Alam, Parvej; Yadav, Hare Ram; Pasha, Sheik Saleem; Roy Choudhury, Angshuman; Laskar, Inamur Rahaman","Simple ratiometric push‒pull with an ‘aggregation induced enhanced emission’ active pyrene derivative: a multifunctional and highly sensitive fluorescent sensor","New Journal of Chemistry","2018","42","2","1133","","10.1039/C7NJ03964F","","","0.71075","MoKα","","0.1185","0.0722","","","0.1687","0.1985","","","","","","1.105","","","","has coordinates","230297","2020-10-21","18:00:00",""
"7056840","8.8094","0.0005","11.2917","0.0008","14.9528","0.0009","73.214","0.005","85.325","0.004","83.268","0.005","1412.43","0.16","296","2","296","2","","","","","","","","5","P -1","-P 1","2","<i>N</i>'-[(<i>E</i>)-(2-methoxyphenyl)methylidene]benzenesulfonohydrazide","<i>N</i>'-[(<i>E</i>)-(2-methoxyphenyl)methylidene]benzenesulfonohydrazide","","- C14 H14 N2 O3 S -","- C14 H14 N2 O3 S -","- C56 H56 N8 O12 S4 -","4","2","","Hussain, Mohammad Musarraf; Asiri, Abdullah M.; Arshad, Muhammad Nadeem; Rahman, Mohammed M.","Fabrication of a Ga3+ sensor probe based on methoxybenzylidenebenzenesulfonohydrazide (MBBSH) by an electrochemical approach","New Journal of Chemistry","2018","42","2","1169","","10.1039/C7NJ01891F","","","0.71073","MoKα","","0.0529","0.041","","","0.1098","0.1222","","","","","","0.963","","","","has coordinates","230292","2020-10-21","18:00:00",""
"7056841","12.1076","0.0009","8.003","0.0004","15.9338","0.0013","90","","110.86","0.009","90","","1442.74","0.19","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","<i>N</i>'-[(<i>E</i>)-(4-methoxyphenyl)methylidene]benzenesulfonohydrazide","<i>N</i>'-[(<i>E</i>)-(4-methoxyphenyl)methylidene]benzenesulfonohydrazide","","- C14 H14 N2 O3 S -","- C14 H14 N2 O3 S -","- C56 H56 N8 O12 S4 -","4","1","","Hussain, Mohammad Musarraf; Asiri, Abdullah M.; Arshad, Muhammad Nadeem; Rahman, Mohammed M.","Fabrication of a Ga3+ sensor probe based on methoxybenzylidenebenzenesulfonohydrazide (MBBSH) by an electrochemical approach","New Journal of Chemistry","2018","42","2","1169","","10.1039/C7NJ01891F","","","0.71073","MoKα","","0.0783","0.0538","","","0.1417","0.1697","","","","","","0.865","","","","has coordinates,has disorder","230292","2020-10-21","18:00:00",""
"7056842","10.662","0.005","9.759","0.005","12.764","0.006","90","","113.318","0.016","90","","1219.6","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Oxadiazaborinium","'1,1-difluoro-3-(p-tolyl)-1H-pyrido[1,2-C][1,3,5,2] oxadiazaborinin-9-ium-1-uide'","","- C13 H11 B F2 N2 O -","- C13 H11 B F2 N2 O -","- C52 H44 B4 F8 N8 O4 -","4","1","","Bonacorso, Helio G.; Calheiro, Tainara P.; Iglesias, Bernardo A.; Acunha, Thiago V.; Franceschini, Steffany Z.; Ketzer, Alex; Meyer, Alexandre R.; Rodrigues, Letícia V.; Nogara, Pablo A.; Rocha, João B. T.; Zanatta, Nilo; Martins, Marcos A. P.","1,1-Difluoro-3-aryl(heteroaryl)-1H-pyrido[1,2-c][1,3,5,2]oxadiazaborinin-9-ium-1-uides: synthesis; structure; and photophysical, electrochemical, and BSA-binding studies","New Journal of Chemistry","2018","42","3","1913","","10.1039/C7NJ04032F","","x-ray","0.71073","MoKα","","0.0691","0.0592","","","0.152","0.1592","","","","","","1.079","","","","has coordinates","230572","2020-10-21","18:00:00",""
"7056843","17.3115","0.0008","6.3966","0.0002","18.3592","0.0009","90","","111.585","0.006","90","","1890.43","0.16","298.5","","298.5","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1'-((1-benzyl-1H-tetrazol-5-yl)methyl)spiro[indoline-3,3'-pyrrolidin]-2-one","","- C20 H20 N6 O -","- C20 H20 N6 O -","- C80 H80 N24 O4 -","4","1","","Alvarez-Rodríguez, Nancy V.; Islas-Jácome, Alejandro; Rentería-Gómez, Angel; Cárdenas-Galindo, Luis E.; Unnamatla, M. V. Basavanag; Gámez-Montaño, Rocío","Synthesis of 1′-tetrazolylmethyl-spiro[pyrrolidine-3,3′-oxindoles] via two coupled one-pot processes Ugi-azide/Pictet‒Spengler and oxidative spiro-rearrangement","New Journal of Chemistry","2018","42","3","1600","","10.1039/C7NJ03829A","","x-ray","0.71073","MoKα","","0.101","0.075","","","0.2133","0.2298","","","","","","1.0505","","","","has coordinates","230563","2020-10-21","18:00:00",""
"7056844","8.22814","0.00016","32.213","0.0005","7.46549","0.00015","90","","109.201","0.002","90","","1868.67","0.06","294","","294","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-((1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl)methyl)-2,3,4,9-tetrahydro-1H-2l4-pyrido[3,4-b]indole","","- C21 H23 N6 -","- C21 H23 N6 -","- C84 H92 N24 -","4","1","","Alvarez-Rodríguez, Nancy V.; Islas-Jácome, Alejandro; Rentería-Gómez, Angel; Cárdenas-Galindo, Luis E.; Unnamatla, M. V. Basavanag; Gámez-Montaño, Rocío","Synthesis of 1′-tetrazolylmethyl-spiro[pyrrolidine-3,3′-oxindoles] via two coupled one-pot processes Ugi-azide/Pictet‒Spengler and oxidative spiro-rearrangement","New Journal of Chemistry","2018","42","3","1600","","10.1039/C7NJ03829A","","x-ray","1.54184","CuKα","","0.0554","0.0489","","","0.1366","0.1433","","","","","","1.054","","","","has coordinates","230563","2020-10-21","18:00:00",""
"7056845","9.386","0.0016","3.5384","0.0006","12.154","0.002","90","","109.139","0.006","90","","381.34","0.11","103","2","103","2","","","","","","","","4","C 1 c 1","C -2yc","9","3-amino-1,2,4-oxadiazol-5-one","amino oxadiazolone","","- C2 H3 N3 O2 -","- C2 H3 N3 O2 -","- C8 H12 N12 O8 -","4","1","","Kumar, A. Sudheer; Sasidharan, Nimesh; Ganguly, Rakesh; Leow, Dasheng; Hng, Huey Hoon","3-Amino-1,2,4(4H)-oxadiazol-5-one (AOD) and its nitrogen-rich salts: a class of insensitive energetic materials","New Journal of Chemistry","2018","42","3","1840","","10.1039/C7NJ03950F","","","0.71073","MoKα","","0.0417","0.0388","","","0.0862","0.0875","","","","","","1.113","","","","has coordinates","230573","2020-10-21","18:00:00",""
"7056846","8.5972","0.0003","9.4798","0.0003","14.2271","0.0005","90","","96.2613","0.0013","90","","1152.59","0.07","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Dioxime (4c)","Dioxime (4c)","","- C3 H8 N4 O2 -","- C3 H8 N4 O2 -","- C24 H64 N32 O16 -","8","1","","Kumar, A. Sudheer; Sasidharan, Nimesh; Ganguly, Rakesh; Leow, Dasheng; Hng, Huey Hoon","3-Amino-1,2,4(4H)-oxadiazol-5-one (AOD) and its nitrogen-rich salts: a class of insensitive energetic materials","New Journal of Chemistry","2018","42","3","1840","","10.1039/C7NJ03950F","","","0.71073","MoKα","","0.0589","0.0474","","","0.119","0.132","","","","","","1.085","","","","has coordinates","230573","2020-10-21","18:00:00",""
"7056847","7.0644","0.0002","6.1129","0.0002","12.3876","0.0005","90","","105.656","0.0012","90","","515.1","0.03","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","AOD-Hydroxylamine","AOD-HyAm","","- C2 H6 N4 O3 -","- C2 H6 N4 O3 -","- C8 H24 N16 O12 -","4","1","","Kumar, A. Sudheer; Sasidharan, Nimesh; Ganguly, Rakesh; Leow, Dasheng; Hng, Huey Hoon","3-Amino-1,2,4(4H)-oxadiazol-5-one (AOD) and its nitrogen-rich salts: a class of insensitive energetic materials","New Journal of Chemistry","2018","42","3","1840","","10.1039/C7NJ03950F","","","0.71073","MoKα","","0.0466","0.0384","","","0.0872","0.091","","","","","","1.077","","","","has coordinates","230573","2020-10-21","18:00:00",""
"7056848","13.3609","0.0004","10.8742","0.0004","3.7046","0.0001","90","","90","","90","","538.24","0.03","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","AOD-HY","AOD-Hydrazinium","","- C2 H7 N5 O2 -","- C2 H7 N5 O2 -","- C8 H28 N20 O8 -","4","1","","Kumar, A. Sudheer; Sasidharan, Nimesh; Ganguly, Rakesh; Leow, Dasheng; Hng, Huey Hoon","3-Amino-1,2,4(4H)-oxadiazol-5-one (AOD) and its nitrogen-rich salts: a class of insensitive energetic materials","New Journal of Chemistry","2018","42","3","1840","","10.1039/C7NJ03950F","","","0.71073","MoKα","","0.032","0.0296","","","0.0712","0.073","","","","","","1.079","","","","has coordinates","230573","2020-10-21","18:00:00",""
"7056849","16.9402","0.001","12.8694","0.0008","21.046","0.0013","90","","90","","90","","4588.2","0.5","296.15","","296.15","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C36 H40 Cl2 N10 O22 Zn2 -","- C36 H39.976 Cl2 N10 O21.976 Zn2 -","- C144 H159.904 Cl8 N40 O87.904 Zn8 -","4","0.5","","Joshi, Pooja; Hussain, Navid; Ali, Shah Raj; Rishu, Rishu; Bhardwaj, Vimal K.","Enhanced activity of trinuclear Zn(ii) complexes towards phosphate ester bond cleavage by introducing three-metal cooperativity","New Journal of Chemistry","2018","42","3","2204","","10.1039/C7NJ03759G","","","0.71073","MoKα","","0.0766","0.0553","","","0.1662","0.1786","","","","","","1.069","","","","has coordinates,has disorder","230562","2020-10-21","18:00:00",""
"7056850","24.6376","0.0011","13.3432","0.0005","22.2182","0.0009","90","","116.285","0.003","90","","6548.9","0.5","296.15","","296.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C60 H71 N16 O25 Zn3 -","- C60 H69 N16 O25 Zn3 -","- C240 H276 N64 O100 Zn12 -","4","0.5","","Joshi, Pooja; Hussain, Navid; Ali, Shah Raj; Rishu, Rishu; Bhardwaj, Vimal K.","Enhanced activity of trinuclear Zn(ii) complexes towards phosphate ester bond cleavage by introducing three-metal cooperativity","New Journal of Chemistry","2018","42","3","2204","","10.1039/C7NJ03759G","","","0.71073","MoKα","","0.0576","0.0382","","","0.0909","0.1027","","","","","","1.101","","","","has coordinates,has disorder","230562","2020-10-21","18:00:00",""
"7056851","14.083","0.0009","14.4192","0.0009","18.1214","0.0012","82.062","0.002","80.733","0.002","67.905","0.002","3353","0.4","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C60 H57 N17 O18 Zn3 -","- C60 H57 N17 O18 Zn3 -","- C120 H114 N34 O36 Zn6 -","2","1","","Joshi, Pooja; Hussain, Navid; Ali, Shah Raj; Rishu, Rishu; Bhardwaj, Vimal K.","Enhanced activity of trinuclear Zn(ii) complexes towards phosphate ester bond cleavage by introducing three-metal cooperativity","New Journal of Chemistry","2018","42","3","2204","","10.1039/C7NJ03759G","","","0.71073","MoKα","","0.0476","0.0371","","","0.1004","0.1054","","","","","","1.074","","","","has coordinates,has disorder","230562","2020-10-21","18:00:00",""
"7056852","9.6163","0.0019","10.933","0.002","15.489","0.003","82.36","0.03","79.31","0.03","72.56","0.03","1521.4","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H24 B Cu N4 P S2 -","- C32 H24 B Cu N4 P S2 -","- C64 H48 B2 Cu2 N8 P2 S4 -","2","1","","Neshat, Abdollah; Varestan, Solmaz; Halvagar, Mohammad Reza","Cu(i) complexes of dihydrobis(2-mercapto-benzimidazolyl)borate and dihydrobis(2-mercapto-benzothiazolyl)borate ligands: structural, photophysical and computational studies","New Journal of Chemistry","2018","42","3","2036","","10.1039/C7NJ03521G","","","0.71073","MoKα","","0.3028","0.066","","","0.1114","0.1742","","","","","","0.565","","","","has coordinates","230569","2020-10-21","18:00:00",""
"7056853","10.495","0.002","23.223","0.005","14.166","0.003","90","","90.5","0.03","90","","3452.5","1.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H43 B Cu N2 P S4 -","- C32 H43 B Cu N2 P S4 -","- C128 H172 B4 Cu4 N8 P4 S16 -","4","1","","Neshat, Abdollah; Varestan, Solmaz; Halvagar, Mohammad Reza","Cu(i) complexes of dihydrobis(2-mercapto-benzimidazolyl)borate and dihydrobis(2-mercapto-benzothiazolyl)borate ligands: structural, photophysical and computational studies","New Journal of Chemistry","2018","42","3","2036","","10.1039/C7NJ03521G","","","0.71073","MoKα","","0.128","0.0589","","","0.1233","0.1345","","","","","","0.816","","","","has coordinates","230569","2020-10-21","18:00:00",""
"7056854","10.0889","0.0019","12.557","0.002","14.792","0.003","90","","99.009","0.002","90","","1850.8","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H22 F2 N4 O11 U2 -","- C34 H22 F2 N4 O11 U2 -","- C68 H44 F4 N8 O22 U4 -","2","0.5","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.044","0.0346","","","0.0815","0.0877","","","","","","1.101","","","","has coordinates,has disorder","230561","2020-10-21","18:00:00",""
"7056855","8.3678","0.0018","9.0091","0.0019","12.351","0.003","108.014","0.004","90.369","0.002","107.51","0.003","839.3","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H24 Cl2 N4 O10 U2 -","- C34 H24 Cl2 N4 O10 U2 -","- C34 H24 Cl2 N4 O10 U2 -","1","0.5","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.0373","0.0277","","","0.0549","0.057","","","","","","1.096","","","","has coordinates","230561","2020-10-21","18:00:00",""
"7056856","9.8501","0.0008","12.573","0.001","14.8854","0.0011","90","","100.432","0.004","90","","1813","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H24 I2 N4 O10 U2 -","- C34 H24 I2 N4 O10 U2 -","- C68 H48 I4 N8 O20 U4 -","2","0.5","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.0494","0.0433","","","0.1121","0.1166","","","","","","1.047","","","","has coordinates,has disorder","230561","2020-10-21","18:00:00",""
"7056857","10.732","0.003","10.901","0.003","11.2","0.003","66.59","0.004","89.273","0.005","61.239","0.004","1027.8","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H24 Br6 N4 O10 U2 -","- C36 H24 Br6 N4 O10 U2 -","- C36 H24 Br6 N4 O10 U2 -","1","0.5","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.0641","0.0424","","","0.0837","0.091","","","","","","1.015","","","","has coordinates,has disorder","230561","2020-10-21","18:00:00",""
"7056858","10.209","0.004","10.899","0.005","16.989","0.005","107.023","0.003","101.547","0.005","97.572","0.004","1734","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H30 N4 O10 U2 -","- C36 H30 N4 O10 U2 -","- C72 H60 N8 O20 U4 -","2","1","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.0824","0.0443","","","0.0905","0.1034","","","","","","1.029","","","","has coordinates","230561","2020-10-21","18:00:00",""
"7056859","13.883","0.004","9.735","0.003","23.617","0.007","90","","96.254","0.005","90","","3172.9","1.6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C30 H22 N4 O10 S2 U2 -","- C30 H22 N4 O10 S2 U2 -","- C120 H88 N16 O40 S8 U8 -","4","0.5","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.0703","0.046","","","0.079","0.0847","","","","","","1.147","","","","has coordinates","230561","2020-10-21","18:00:00",""
"7056860","10.521","0.004","10.766","0.005","11.35","0.004","95.865","0.005","105.083","0.004","116.297","0.003","1077.2","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H28 Br4 N4 O14 U2 -","- C38 H28 Br4 N4 O14 U2 -","- C38 H28 Br4 N4 O14 U2 -","1","0.5","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.0325","0.0257","","","0.0557","0.0577","","","","","","1.038","","","","has coordinates","230561","2020-10-21","18:00:00",""
"7056861","8.172","0.005","20.318","0.013","10.369","0.007","90","","111.78","0.009","90","","1598.8","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H18 Br4 N4 O10 U2 -","- C24 H18 Br4 N4 O10 U2 -","- C48 H36 Br8 N8 O20 U4 -","2","0.5","","Ridenour, J. August; Cahill, Christopher L.","Synthesis, structural analysis, and supramolecular assembly of a series of in situ generated uranyl‒peroxide complexes with functionalized 2,2′-bipyridine and varied carboxylic acid ligands","New Journal of Chemistry","2018","42","3","1816","","10.1039/C7NJ03828C","","x-ray","0.71073","MoKα","","0.0244","0.0192","","","0.0377","0.0389","","","","","","1.047","","","","has coordinates","230561","2020-10-21","18:00:00",""
"7056862","8.586","0.001","8.607","0.001","9.1858","0.0012","85.11","0.014","84.7","0.013","78.652","0.016","661.15","0.14","100","2","100","2","","","","","","","","4","P -1","-P 1","2","[Cu2(Et3en)2(N3)4]","","","- C16 H40 Cu2 N16 -","- C16 H40 Cu2 N16 -","- C16 H40 Cu2 N16 -","1","0.5","","Massoud, Salah S.; Henary, Maher M.; Maxwell, Lindley; Martín, Alejandro; Ruiz, Eliseo; Vicente, Ramon; Fischer, Roland C.; Mautner, Franz A.","Structure, magnetic properties and DFT calculations of azido-copper(ii) complexes with different azido-bonding, nuclearity and dimensionality","New Journal of Chemistry","2018","42","4","2627","","10.1039/C7NJ04150K","","","0.71073","MoKα","","0.0389","0.0355","","","0.0931","0.0958","","","","","","1.058","","","","has coordinates","230281","2020-10-21","18:00:00",""
"7056863","11.873","0.001","12.0334","0.0011","19.5852","0.0014","90","","107.191","0.009","90","","2673.2","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Cu(N3)(en(isopropyl)2]2","","","- C16 H40 Cu2 N16 -","- C16 H40 Cu2 N16 -","- C64 H160 Cu8 N64 -","4","1","","Massoud, Salah S.; Henary, Maher M.; Maxwell, Lindley; Martín, Alejandro; Ruiz, Eliseo; Vicente, Ramon; Fischer, Roland C.; Mautner, Franz A.","Structure, magnetic properties and DFT calculations of azido-copper(ii) complexes with different azido-bonding, nuclearity and dimensionality","New Journal of Chemistry","2018","42","4","2627","","10.1039/C7NJ04150K","","","0.71073","MoKα","","0.0451","0.0407","","","0.0936","0.095","","","","","","1.115","","","","has coordinates","230281","2020-10-21","18:00:00",""
"7056864","12.326","0.0014","6.81","0.001","13.466","0.0016","90","","117.036","0.003","90","","1006.8","0.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","[Cu(ambza)(N3)2]n","","","- C7 H10 Cu N8 -","- C7 H10 Cu N8 -","- C28 H40 Cu4 N32 -","4","1","","Massoud, Salah S.; Henary, Maher M.; Maxwell, Lindley; Martín, Alejandro; Ruiz, Eliseo; Vicente, Ramon; Fischer, Roland C.; Mautner, Franz A.","Structure, magnetic properties and DFT calculations of azido-copper(ii) complexes with different azido-bonding, nuclearity and dimensionality","New Journal of Chemistry","2018","42","4","2627","","10.1039/C7NJ04150K","","","0.71073","MoKα","","0.056","0.0457","","","0.0992","0.1034","","","","","","1.117","","","","has coordinates","230281","2020-10-21","18:00:00",""
"7056865","7.8921","0.0009","12.8529","0.0012","13.2899","0.0014","70.941","0.013","82.294","0.014","82.146","0.014","1256.5","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","[Cu2(N3)3(Et2,Me-en)2]n(ClO4)n","","","- C14 H36 Cl Cu2 N13 O4 -","- C14 H36 Cl Cu2 N13 O4 -","- C28 H72 Cl2 Cu4 N26 O8 -","2","1","","Massoud, Salah S.; Henary, Maher M.; Maxwell, Lindley; Martín, Alejandro; Ruiz, Eliseo; Vicente, Ramon; Fischer, Roland C.; Mautner, Franz A.","Structure, magnetic properties and DFT calculations of azido-copper(ii) complexes with different azido-bonding, nuclearity and dimensionality","New Journal of Chemistry","2018","42","4","2627","","10.1039/C7NJ04150K","","","0.71073","MoKα","","0.0437","0.0406","","","0.1047","0.1072","","","","","","1.024","","","","has coordinates","230281","2020-10-21","18:00:00",""
"7056866","5.1221","0.0001","17.608","0.0002","22.7903","0.0003","90","","90","","90","","2055.46","0.05","285","1","285","1","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C22 H10 F3 I3 -","- C22 H10 F3 I3 -","- C88 H40 F12 I12 -","4","0.5","","Li, Lili; Wu, Wen Xin; Liu, Zheng Fei; Jin, Wei Jun","Effect of geometry factors on the priority of σ-hole⋯π and π-hole⋯π bond in phosphorescent cocrystals formed by pyrene or phenanthrene and trihaloperfluorobenzenes","New Journal of Chemistry","2018","42","13","10633","","10.1039/C7NJ04536K","","x-ray","1.54184","CuKα","","0.0542","0.0511","","","0.1382","0.1425","","","","","","1.072","","","","has coordinates","230374","2020-10-21","18:00:00",""
"7056867","7.8395","0.0003","14.7083","0.0004","17.2969","0.0005","90","","102.132","0.003","90","","1949.89","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pyr-TBrPB","","- C22 H10 Br3 F3 -","- C22 H10 Br3 F3 -","- C88 H40 Br12 F12 -","4","1","","Li, Lili; Wu, Wen Xin; Liu, Zheng Fei; Jin, Wei Jun","Effect of geometry factors on the priority of σ-hole⋯π and π-hole⋯π bond in phosphorescent cocrystals formed by pyrene or phenanthrene and trihaloperfluorobenzenes","New Journal of Chemistry","2018","42","13","10633","","10.1039/C7NJ04536K","","x-ray","1.54184","CuKα","","0.091","0.0824","","","0.2335","0.2438","","","","","","1.063","","","","has coordinates","230374","2020-10-21","18:00:00",""
"7056868","10.9583","0.0001","14.3685","0.0001","11.3862","0.0001","90","","98.885","0.001","90","","1771.29","0.03","100.01","0.1","100.01","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H10 Br3 F3 -","- C20 H10 Br3 F3 -","- C80 H40 Br12 F12 -","4","1","","Li, Lili; Wu, Wen Xin; Liu, Zheng Fei; Jin, Wei Jun","Effect of geometry factors on the priority of σ-hole⋯π and π-hole⋯π bond in phosphorescent cocrystals formed by pyrene or phenanthrene and trihaloperfluorobenzenes","New Journal of Chemistry","2018","42","13","10633","","10.1039/C7NJ04536K","","x-ray","1.54184","CuKα","","0.0192","0.0176","","","0.0428","0.0435","","","","","","1.087","","","","has coordinates","230374","2020-10-21","18:00:00",""
"7056869","6.7866","0.0004","24.3582","0.0014","9.1687","0.0005","90","","99.93","0.006","90","","1492.97","0.15","100.01","0.15","100.01","0.15","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H5 F3 I3 -","- C13 H5 F3 I3 -","- C52 H20 F12 I12 -","4","1","","Li, Lili; Wu, Wen Xin; Liu, Zheng Fei; Jin, Wei Jun","Effect of geometry factors on the priority of σ-hole⋯π and π-hole⋯π bond in phosphorescent cocrystals formed by pyrene or phenanthrene and trihaloperfluorobenzenes","New Journal of Chemistry","2018","42","13","10633","","10.1039/C7NJ04536K","","x-ray","0.71073","MoKα","","0.036","0.028","","","0.0477","0.0508","","","","","","1.071","","","","has coordinates,has disorder","230374","2020-10-21","18:00:00",""
"7056870","6.0295","0.0003","9.1751","0.0005","11.9172","0.0007","94.105","0.004","100.519","0.004","96.335","0.004","641.39","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","imidazolium diphenylacetate diphenylacetic acid","","- C31 H28 N2 O4 -","- C30.996 H28 N2 O4 -","- C30.996 H28 N2 O4 -","1","0.5","","Jauhar, RO. MU.; Era, Paavai; Viswanathan, V.; Vivek, P.; Vinitha, G.; D., Velmurugan; Murugakoothan, P.","Crystal structure, molecular packing, FMO, NBO, nonlinear optical and optical limiting properties of an organic imidazolium diphenylacetate diphenylacetic acid single crystal","New Journal of Chemistry","2018","42","4","2439","","10.1039/C7NJ03693K","","","0.71073","MoKα","","0.0941","0.0693","","","0.1729","0.1996","","","","","","1.026","","","","has coordinates,has disorder","230280","2020-10-21","18:00:00",""
"7056871","7.3568","0.0004","14.9891","0.0009","21.0736","0.0011","90","","96.417","0.004","90","","2309.3","0.2","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H26 I N2 O P Pt -","- C25 H26 I N2 O P Pt -","- C100 H104 I4 N8 O4 P4 Pt4 -","4","1","","Shahsavari, Hamid R.; Babadi Aghakhanpour, Reza; Fereidoonnezhad, Masood","An in-depth investigation on the C‒I bond activation by rollover cycloplatinated(ii) complexes bearing monodentate phosphane ligands: kinetic and kinetic isotope effect","New Journal of Chemistry","2018","42","4","2564","","10.1039/C7NJ04159D","","","0.71073","MoKα","","0.0819","0.0636","","","0.1739","0.1823","","","","","","0.984","","","","has coordinates","230275","2020-10-21","18:00:00",""
"7056872","9.0622","0.0007","16.381","0.0013","19.4841","0.0016","90","0.07","102.514","0.007","90","0.06","2823.7","0.4","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","GS-68","","- C34 H20 Cl3 N5 -","- C34 H20 Cl3 N5 -","- C136 H80 Cl12 N20 -","4","1","","Gupta, Shalu; Milton, Marilyn D.","Synthesis of novel AIEE active pyridopyrazines and their applications as chromogenic and fluorogenic probes for Hg2+ detection in aqueous media","New Journal of Chemistry","2018","42","4","2838","","10.1039/C7NJ04573E","","","0.71073","MoKα","","0.2076","0.0923","","","0.1803","0.2316","","","","","","1.022","","","","has coordinates","230269","2020-10-21","18:00:00",""
"7056873","18.857","0.0006","4.9822","0.0001","21.8645","0.0007","90","","115.277","0.001","90","","1857.48","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Sup","","- C18 H23 Br N4 O2 -","- C18 H23 Br N4 O2 -","- C72 H92 Br4 N16 O8 -","4","1","","Gaonkar, Supreet; Savanur, Mohammed Azharuddin; Sunagar, Manjunath G.; Puthusseri, Bijesh; Deshapande, Narahari; Nadaf, Afra A.; Khazi, Imtiyaz Ahmed M.","Exploring the potential of newly synthesized 4-methyl-6-morpholino-pyrimidine derivatives as antiproliferative agents","New Journal of Chemistry","2018","42","4","2790","","10.1039/C7NJ04157H","","x-ray","0.71073","MoKα","","0.0437","0.0393","","","0.1106","0.1144","","","","","","1.131","","","","has coordinates","230270","2020-10-21","18:00:00",""
"7056874","15.986","0.007","8.403","0.003","28.487","0.013","90","","96.253","0.005","90","","3804","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H35 N2 Nd O11 -","- C37 H29 N2 Nd O8 -","- C148 H116 N8 Nd4 O32 -","4","1","","Chen, Dong-Hui; Lin, Ling; Sheng, Tian-Lu; Wen, Yue-Hong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Hu, Sheng-Min; Fu, Rui-Biao; Wu, Xin-Tao","Syntheses, structures, luminescence and magnetic properties of seven isomorphous metal‒organic frameworks based on 2,7-bis(4-benzoic acid)-N-(4-benzoic acid)carbazole","New Journal of Chemistry","2018","42","4","2830","","10.1039/C7NJ04048B","","","0.71073","MoKα","","0.1089","0.0879","","","0.1979","0.2108","","","","","","1.169","","","","has coordinates,has disorder","230278","2020-10-21","18:00:00",""
"7056875","15.682","0.005","8.316","0.003","28.526","0.011","90","","96.325","0.009","90","","3697","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H35 Ho N2 O11 -","- C37 H29 Ho N2 O8 -","- C148 H116 Ho4 N8 O32 -","4","1","","Chen, Dong-Hui; Lin, Ling; Sheng, Tian-Lu; Wen, Yue-Hong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Hu, Sheng-Min; Fu, Rui-Biao; Wu, Xin-Tao","Syntheses, structures, luminescence and magnetic properties of seven isomorphous metal‒organic frameworks based on 2,7-bis(4-benzoic acid)-N-(4-benzoic acid)carbazole","New Journal of Chemistry","2018","42","4","2830","","10.1039/C7NJ04048B","","","0.71073","MoKα","","0.1053","0.0842","","","0.1685","0.1804","","","","","","1.183","","","","has coordinates,has disorder","230278","2020-10-21","18:00:00",""
"7056876","15.793","0.007","8.363","0.003","28.515","0.012","90","","96.516","0.007","90","","3742","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H33 N2 O10 Sm -","- C37 H29 N2 O8 Sm -","- C148 H116 N8 O32 Sm4 -","4","1","","Chen, Dong-Hui; Lin, Ling; Sheng, Tian-Lu; Wen, Yue-Hong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Hu, Sheng-Min; Fu, Rui-Biao; Wu, Xin-Tao","Syntheses, structures, luminescence and magnetic properties of seven isomorphous metal‒organic frameworks based on 2,7-bis(4-benzoic acid)-N-(4-benzoic acid)carbazole","New Journal of Chemistry","2018","42","4","2830","","10.1039/C7NJ04048B","","","0.71073","MoKα","","0.0935","0.077","","","0.1846","0.1976","","","","","","1.125","","","","has coordinates,has disorder","230278","2020-10-21","18:00:00",""
"7056877","15.776","0.003","8.3587","0.0016","28.529","0.005","90","","96.501","0.004","90","","3737.8","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H33 Eu N2 O10 -","- C37 H29 Eu N2 O8 -","- C148 H116 Eu4 N8 O32 -","4","1","","Chen, Dong-Hui; Lin, Ling; Sheng, Tian-Lu; Wen, Yue-Hong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Hu, Sheng-Min; Fu, Rui-Biao; Wu, Xin-Tao","Syntheses, structures, luminescence and magnetic properties of seven isomorphous metal‒organic frameworks based on 2,7-bis(4-benzoic acid)-N-(4-benzoic acid)carbazole","New Journal of Chemistry","2018","42","4","2830","","10.1039/C7NJ04048B","","","0.71073","MoKα","","0.0645","0.053","","","0.1253","0.1325","","","","","","1.108","","","","has coordinates,has disorder","230278","2020-10-21","18:00:00",""
"7056878","15.735","0.007","8.29","0.003","28.436","0.012","90","","96.414","0.008","90","","3686","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H33 Dy N2 O10 -","- C37 H29 Dy N2 O8 -","- C148 H116 Dy4 N8 O32 -","4","1","","Chen, Dong-Hui; Lin, Ling; Sheng, Tian-Lu; Wen, Yue-Hong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Hu, Sheng-Min; Fu, Rui-Biao; Wu, Xin-Tao","Syntheses, structures, luminescence and magnetic properties of seven isomorphous metal‒organic frameworks based on 2,7-bis(4-benzoic acid)-N-(4-benzoic acid)carbazole","New Journal of Chemistry","2018","42","4","2830","","10.1039/C7NJ04048B","","","0.71073","MoKα","","0.0609","0.0511","","","0.125","0.1319","","","","","","1.094","","","","has coordinates,has disorder","230278","2020-10-21","18:00:00",""
"7056879","15.696","0.004","8.307","0.002","28.47","0.008","90","","96.418","0.005","90","","3688.8","1.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H33 Gd N2 O10 -","- C37 H29 Gd N2 O8 -","- C148 H116 Gd4 N8 O32 -","4","1","","Chen, Dong-Hui; Lin, Ling; Sheng, Tian-Lu; Wen, Yue-Hong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Hu, Sheng-Min; Fu, Rui-Biao; Wu, Xin-Tao","Syntheses, structures, luminescence and magnetic properties of seven isomorphous metal‒organic frameworks based on 2,7-bis(4-benzoic acid)-N-(4-benzoic acid)carbazole","New Journal of Chemistry","2018","42","4","2830","","10.1039/C7NJ04048B","","","0.71073","MoKα","","0.0598","0.0496","","","0.1199","0.1264","","","","","","1.133","","","","has coordinates,has disorder","230278","2020-10-21","18:00:00",""
"7056880","15.729","0.004","8.3089","0.0018","28.483","0.007","90","","96.448","0.004","90","","3698.9","1.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C37 H33 N2 O10 Tb -","- C37 H29 N2 O8 Tb -","- C148 H116 N8 O32 Tb4 -","4","1","","Chen, Dong-Hui; Lin, Ling; Sheng, Tian-Lu; Wen, Yue-Hong; Zhu, Xiao-Quan; Zhang, Lin-Tao; Hu, Sheng-Min; Fu, Rui-Biao; Wu, Xin-Tao","Syntheses, structures, luminescence and magnetic properties of seven isomorphous metal‒organic frameworks based on 2,7-bis(4-benzoic acid)-N-(4-benzoic acid)carbazole","New Journal of Chemistry","2018","42","4","2830","","10.1039/C7NJ04048B","","","0.71073","MoKα","","0.0678","0.0573","","","0.1373","0.1448","","","","","","1.119","","","","has coordinates,has disorder","230278","2020-10-21","18:00:00",""
"7056881","22.2","0.0015","15.2908","0.001","27.5057","0.0019","90","","95.473","0.001","90","","9294.4","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2-naphthoxy)phosphorus(V)- tris 5,10,15-(pentafluorophenyl) corrole","","- C57 H22 F15 N4 O2 P -","- C57 H22 F15 N4 O2 P -","- C456 H176 F120 N32 O16 P8 -","8","1","","Achary, B. Shivaprasad; Ramya, A. R.; Nanubolu, Jagadeesh Babu; Seetharaman, Sairaman; Lim, Gary N.; Jang, Youngwoo; D’Souza, Francis; Giribabu, Lingamallu","Axially substituted phosphorous(v) corrole with polycyclic aromatic hydrocarbons: syntheses, X-ray structures, and photoinduced energy and electron transfer studies","New Journal of Chemistry","2018","42","10","8230","","10.1039/C7NJ04363E","","","0.71073","MoKα","","0.068","0.0546","","","0.135","0.1455","","","","","","1.057","","","","has coordinates","230197","2020-10-21","18:00:00",""
"7056882","6.7603","0.0007","13.0051","0.0007","16.5751","0.0009","90","","97.889","0.007","90","","1443.46","0.19","270","2","270","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 Ag N4 O4 -","- C14 H13 Ag N4 O4 -","- C56 H52 Ag4 N16 O16 -","4","1","","Santos, Ane F.; Ferreira, Isabella P.; Takahashi, Jacqueline A.; Rodrigues, Gabriel L. S.; Pinheiro, Carlos B.; Teixeira, Letícia R.; Rocha, Willian R.; Beraldo, Heloisa","Silver(i) complexes with 2-acetylpyridinebenzoylhydrazones exhibit antimicrobial effects against yeast and filamentous fungi","New Journal of Chemistry","2018","42","3","2125","","10.1039/C7NJ04280A","","","0.71073","MoKα","","0.1019","0.0625","","","0.1508","0.1764","","","","","","1.079","","","","has coordinates","230560","2020-10-21","18:00:00",""
"7056883","7.2535","0.0004","13.2543","0.0007","17.9111","0.0008","90","","99.214","0.004","90","","1699.76","0.15","270","2","270","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 Ag N5 O7 -","- C14 H14 Ag N5 O7 -","- C56 H56 Ag4 N20 O28 -","4","1","","Santos, Ane F.; Ferreira, Isabella P.; Takahashi, Jacqueline A.; Rodrigues, Gabriel L. S.; Pinheiro, Carlos B.; Teixeira, Letícia R.; Rocha, Willian R.; Beraldo, Heloisa","Silver(i) complexes with 2-acetylpyridinebenzoylhydrazones exhibit antimicrobial effects against yeast and filamentous fungi","New Journal of Chemistry","2018","42","3","2125","","10.1039/C7NJ04280A","","","0.71073","MoKα","","0.0932","0.0623","","","0.1419","0.1617","","","","","","1.023","","","","has coordinates","230560","2020-10-21","18:00:00",""
"7056884","8.4416","0.0006","12.9864","0.0005","14.7636","0.0006","112.115","0.004","99.194","0.004","95.337","0.004","1459.23","0.14","270","2","270","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H30 Ag N7 O5 -","- C30 H30 Ag N7 O5 -","- C60 H60 Ag2 N14 O10 -","2","1","","Santos, Ane F.; Ferreira, Isabella P.; Takahashi, Jacqueline A.; Rodrigues, Gabriel L. S.; Pinheiro, Carlos B.; Teixeira, Letícia R.; Rocha, Willian R.; Beraldo, Heloisa","Silver(i) complexes with 2-acetylpyridinebenzoylhydrazones exhibit antimicrobial effects against yeast and filamentous fungi","New Journal of Chemistry","2018","42","3","2125","","10.1039/C7NJ04280A","","","0.71073","MoKα","","0.0409","0.0293","","","0.0655","0.0708","","","","","","1.032","","","","has coordinates,has disorder","230560","2020-10-21","18:00:00",""
"7056885","8.2925","0.0004","13.1239","0.0007","14.7518","0.0007","112.238","0.005","98.638","0.004","96.159","0.004","1445.35","0.14","270","2","270","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H24 Ag Cl2 N7 O5 -","- C28 H24 Ag Cl2 N7 O5 -","- C56 H48 Ag2 Cl4 N14 O10 -","2","1","","Santos, Ane F.; Ferreira, Isabella P.; Takahashi, Jacqueline A.; Rodrigues, Gabriel L. S.; Pinheiro, Carlos B.; Teixeira, Letícia R.; Rocha, Willian R.; Beraldo, Heloisa","Silver(i) complexes with 2-acetylpyridinebenzoylhydrazones exhibit antimicrobial effects against yeast and filamentous fungi","New Journal of Chemistry","2018","42","3","2125","","10.1039/C7NJ04280A","","","0.71073","MoKα","","0.0735","0.0452","","","0.1024","0.1204","","","","","","1.037","","","","has coordinates,has disorder","230560","2020-10-21","18:00:00",""
"7056886","9.631","0.0004","9.5059","0.0004","12.459","0.0004","90","","93.923","0.003","90","","1137.97","0.08","110","2","110","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H14 Cl2 Ga N O -","- C8 H14 Cl2 Ga N O -","- C32 H56 Cl8 Ga4 N4 O4 -","4","1","","O’Donoghue, Richard; Rahman, Shafiqur; Mallick, Bert; Winter, Manuela; Rogalla, Detlef; Becker, Hans-Werner; Devi, Anjana","Molecular engineering of Ga-ketoiminates: synthesis, structure and evaluation as precursors for the additive-free spin-coated deposition of gallium oxide thin films","New Journal of Chemistry","2018","42","5","3196","","10.1039/C7NJ04334A","","","1.54178","CuKα","","0.0292","0.0239","","","0.0558","0.0592","","","","","","1.029","","","","has coordinates","230264","2020-10-21","18:00:00",""
"7056887","9.6212","0.0002","13.9767","0.0003","17.2781","0.0005","90","","91.153","0.002","90","","2322.96","0.1","99.8","0.2","99.8","0.2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H36 Cl Ga N2 O4 -","- C20 H36 Cl Ga N2 O4 -","- C80 H144 Cl4 Ga4 N8 O16 -","4","1","","O’Donoghue, Richard; Rahman, Shafiqur; Mallick, Bert; Winter, Manuela; Rogalla, Detlef; Becker, Hans-Werner; Devi, Anjana","Molecular engineering of Ga-ketoiminates: synthesis, structure and evaluation as precursors for the additive-free spin-coated deposition of gallium oxide thin films","New Journal of Chemistry","2018","42","5","3196","","10.1039/C7NJ04334A","","x-ray","1.54184","CuKα","","0.0351","0.0281","","","0.0759","0.0806","","","","","","1.056","","","","has coordinates","230264","2020-10-21","18:00:00",""
"7056888","7.7637","0.0002","14.6029","0.0004","13.3304","0.0004","90","","99.544","0.003","90","","1490.38","0.07","101.3","0.2","101.3","0.2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H26 Ga N3 O -","- C12 H26 Ga N3 O -","- C48 H104 Ga4 N12 O4 -","4","1","","O’Donoghue, Richard; Rahman, Shafiqur; Mallick, Bert; Winter, Manuela; Rogalla, Detlef; Becker, Hans-Werner; Devi, Anjana","Molecular engineering of Ga-ketoiminates: synthesis, structure and evaluation as precursors for the additive-free spin-coated deposition of gallium oxide thin films","New Journal of Chemistry","2018","42","5","3196","","10.1039/C7NJ04334A","","x-ray","1.54184","CuKα","","0.0405","0.0324","","","0.0797","0.0853","","","","","","1.091","","","","has coordinates","230264","2020-10-21","18:00:00",""
"7056889","18.4543","0.0004","8.6596","0.0001","22.4511","0.0009","90","","122.791","0.002","90","","3016.12","0.16","111.1","0.3","111.1","0.3","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H48 Ga N3 O6 -","- C27 H48 Ga N3 O6 -","- C108 H192 Ga4 N12 O24 -","4","1","","O’Donoghue, Richard; Rahman, Shafiqur; Mallick, Bert; Winter, Manuela; Rogalla, Detlef; Becker, Hans-Werner; Devi, Anjana","Molecular engineering of Ga-ketoiminates: synthesis, structure and evaluation as precursors for the additive-free spin-coated deposition of gallium oxide thin films","New Journal of Chemistry","2018","42","5","3196","","10.1039/C7NJ04334A","","x-ray","1.54178","CuKα","","0.0376","0.0311","","","0.0777","0.0823","","","","","","1.036","","","","has coordinates","230264","2020-10-21","18:00:00",""
"7056890","21.0903","0.0013","4.5204","0.0003","17.9165","0.001","90","","90","","90","","1708.1","0.18","296","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C14 H16 N6 O2 Se2 -","- C14 H16 N6 O2 Se2 -","- C56 H64 N24 O8 Se8 -","4","1","","Sharma, Nidhi; Kumar, Sanjeev; Kumar, Sangit; Mehta, S. K.; Bhasin, K. K.","Synthesis and characterization of fused imidazole heterocyclic selenoesters and their application for chemical detoxification of HgCl2","New Journal of Chemistry","2018","42","4","2702","","10.1039/C7NJ03908E","","","0.71073","MoKα","","0.0465","0.0319","","","0.0591","0.0628","","","","","","0.988","","","","has coordinates","230272","2020-10-21","18:00:00",""
"7056891","13.9786","0.0018","5.8864","0.0006","22.939","0.003","90","","98.038","0.004","90","","1869","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H21 N3 O -","- C22 H21 N3 O -","- C88 H84 N12 O4 -","4","1","","İnan, Ayşe; İkiz, Mesut; Tayhan, Seçil Erden; Bilgin, Sema; Genç, Nusret; Sayın, Koray; Ceyhan, Gökhan; Köse, Muhammet; Dağ, Ayşe; İspir, Esin","Antiproliferative, antioxidant, computational and electrochemical studies of new azo-containing Schiff base ruthenium(ii) complexes","New Journal of Chemistry","2018","42","4","2952","","10.1039/C7NJ04420H","","","0.71073","MoKα","","0.0967","0.0596","","","0.1399","0.1727","","","","","","1.042","","","","has coordinates","230277","2020-10-21","18:00:00",""
"7056892","26.761","0.005","4.7207","0.0007","12.577","0.002","90","","91.88","0.006","90","","1588","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H17 N3 O -","- C20 H17 N3 O -","- C80 H68 N12 O4 -","4","1","","İnan, Ayşe; İkiz, Mesut; Tayhan, Seçil Erden; Bilgin, Sema; Genç, Nusret; Sayın, Koray; Ceyhan, Gökhan; Köse, Muhammet; Dağ, Ayşe; İspir, Esin","Antiproliferative, antioxidant, computational and electrochemical studies of new azo-containing Schiff base ruthenium(ii) complexes","New Journal of Chemistry","2018","42","4","2952","","10.1039/C7NJ04420H","","","0.71073","MoKα","","0.0968","0.0551","","","0.1244","0.144","","","","","","1.034","","","","has coordinates","230277","2020-10-21","18:00:00",""
"7056893","10.5213","0.0012","11.9176","0.0015","12.2605","0.0016","61.411","0.004","85.811","0.004","88.731","0.004","1346.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H30 Cl N3 O2 Ru -","- C30 H30 Cl N3 O2 Ru -","- C60 H60 Cl2 N6 O4 Ru2 -","2","1","","İnan, Ayşe; İkiz, Mesut; Tayhan, Seçil Erden; Bilgin, Sema; Genç, Nusret; Sayın, Koray; Ceyhan, Gökhan; Köse, Muhammet; Dağ, Ayşe; İspir, Esin","Antiproliferative, antioxidant, computational and electrochemical studies of new azo-containing Schiff base ruthenium(ii) complexes","New Journal of Chemistry","2018","42","4","2952","","10.1039/C7NJ04420H","","","0.71073","MoKα","","0.0367","0.0298","","","0.0667","0.0721","","","","","","1.117","","","","has coordinates","230277","2020-10-21","18:00:00",""
"7056894","6.372","0.0006","9.3611","0.0009","14.5803","0.0011","90","","90","","90","","869.7","0.13","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C4 H5 F N6 O4 -","- C4 H5 F N6 O4 -","- C16 H20 F4 N24 O16 -","4","1","","Wang, Weixia; Cheng, Guangbin; Xiong, Hualin; Yang, Hongwei","Functionalization of fluorodinitroethylamino derivatives based on azole: a new family of insensitive energetic materials","New Journal of Chemistry","2018","42","4","2994","","10.1039/C7NJ05009G","","","0.71073","MoKα","","0.0601","0.0384","","","0.0599","0.0652","","","","","","1.086","","","","has coordinates,has disorder","230276","2020-10-21","18:00:00",""
"7056895","5.0674","0.0007","22.537","0.003","8.318","0.001","90","","102.747","0.004","90","","926.5","0.2","172","2","172","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H4 F N7 O6 -","- C3.998 H3.998 F0.999 N6.998 O5.996 -","- C15.992 H15.992 F3.996 N27.992 O23.984 -","4","1","","Wang, Weixia; Cheng, Guangbin; Xiong, Hualin; Yang, Hongwei","Functionalization of fluorodinitroethylamino derivatives based on azole: a new family of insensitive energetic materials","New Journal of Chemistry","2018","42","4","2994","","10.1039/C7NJ05009G","","","0.71073","MoKα","","0.1278","0.0812","","","0.1619","0.1797","","","","","","1.103","","","","has coordinates,has disorder","230276","2020-10-21","18:00:00",""
"7056896","9.4897","0.0015","7.522","0.0011","11.9071","0.0018","90","","105.455","0.005","90","","819.2","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H5 F N6 O4 -","- C4 H5 F N6 O4 -","- C16 H20 F4 N24 O16 -","4","1","","Wang, Weixia; Cheng, Guangbin; Xiong, Hualin; Yang, Hongwei","Functionalization of fluorodinitroethylamino derivatives based on azole: a new family of insensitive energetic materials","New Journal of Chemistry","2018","42","4","2994","","10.1039/C7NJ05009G","","","0.71073","MoKα","","0.1046","0.0515","","","0.0821","0.0963","","","","","","1.018","","","","has coordinates","230276","2020-10-21","18:00:00",""
"7056897","11.4591","0.0005","16.6924","0.0005","13.1556","0.0005","90","","101.234","0.004","90","","2468.19","0.16","100","0.3","100","0.3","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 N8 O6 Zn -","- C18 H20 N8 O6 Zn -","- C72 H80 N32 O24 Zn4 -","4","0.5","","Jin, Jun-Cheng; Wu, Jian; Liu, Wei-Cong; Ma, Ai-Qing; Liu, Jian-Qiang; Singh, Amita; Kumar, Abhinav","A new Zn(ii) metal‒organic framework having 3D CdSO4 topology as luminescent sensor and photocatalyst for degradation of organic dyes","New Journal of Chemistry","2018","42","4","2767","","10.1039/C7NJ04355D","","x-ray","1.54184","CuKα","","0.0538","0.0478","","","0.1223","0.1258","","","","","","1.02","","","","has coordinates","230279","2020-10-21","18:00:00",""
"7056898","26.4924","0.0003","17.347","0.0002","27.3768","0.0003","90","","106.53","0.001","90","","12061.4","0.2","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H108 Fe6 N12 O42 P12 -","- C36 H108 Fe6 N12 O42 P12 -","- C144 H432 Fe24 N48 O168 P48 -","4","1","","Doroshenko, Iaroslav; Babiak, Michal; Buchholz, Axel; Tucek, Jiri; Plass, Winfried; Pinkas, Jiri","Hexanuclear iron(iii) α-aminophosphonate: synthesis, structure, and magnetic properties of a molecular wheel","New Journal of Chemistry","2018","42","3","1931","","10.1039/C7NJ03606J","","","0.71075","MolybdenumKα","","0.0468","0.0447","","","0.121","0.1224","","","","","","1.058","","","","has coordinates","230565","2020-10-21","18:00:00",""
"7056899","8.181","0.002","9.014","0.002","11.892","0.004","86.414","0.006","70.448","0.005","69.436","0.004","772.2","0.4","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C38 H44 N2 -","- C38 H44 N2 -","- C38 H44 N2 -","1","0.5","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0789","0.0461","","","0.1048","0.121","","","","","","1.021","","","","has coordinates,has disorder","230268","2020-10-21","18:00:00",""
"7056900","8.234","0.007","9.416","0.006","13.972","0.011","82.68","0.05","76.62","0.07","69.13","0.07","983.5","1.4","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H56 N2 Si2 -","- C44 H56 N2 Si2 -","- C44 H56 N2 Si2 -","1","0.5","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0807","0.0684","","","0.2201","0.2512","","","","","","1.043","","","","has coordinates","230268","2020-10-21","18:00:00",""
"7056901","8.3622","0.0004","8.7201","0.0005","11.3838","0.0006","69.821","0.002","81.103","0.002","70.285","0.002","732.79","0.07","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H40 N2 -","- C36 H40 N2 -","- C36 H40 N2 -","1","0.5","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0567","0.0416","","","0.103","0.1136","","","","","","1.025","","","","has coordinates,has disorder","230268","2020-10-21","18:00:00",""
"7056902","9.937","0.003","13.257","0.004","22","0.007","90","","96.887","0.007","90","","2877.3","1.5","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C36 H38 N2 -","- C36 H38 N2 -","- C144 H152 N8 -","4","1","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.2371","0.0794","","","0.1934","0.2926","","","","","","0.947","","","","has coordinates,has disorder","230268","2020-10-21","18:00:00",""
"7056903","8.839","0.003","12.054","0.004","16.055","0.007","90","","100.7","0.04","90","","1680.8","1.1","223","2","223","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C40 H48 N2 -","- C40 H48 N2 -","- C80 H96 N4 -","2","0.5","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0716","0.0502","","","0.1244","0.138","","","","","","1.039","","","","has coordinates","230268","2020-10-21","18:00:00",""
"7056904","10.558","0.003","13.688","0.005","12.845","0.004","90","","90.115","0.006","90","","1856.3","1","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C42 H50.5 N2 Si2 -","- C42 H50.58 N2 Si2 -","- C84 H101.16 N4 Si4 -","2","0.5","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.1062","0.0614","","","0.1629","0.1931","","","","","","1.003","","","","has coordinates,has disorder","230268","2020-10-21","18:00:00",""
"7056905","10.2057","0.001","11.4873","0.0011","12.1715","0.0011","66.232","0.002","83.013","0.002","83.378","0.002","1292.8","0.2","200","2","200","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H32 N2 -","- C32 H32 N2 -","- C64 H64 N4 -","2","1","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0648","0.043","","","0.102","0.1158","","","","","","1.022","","","","has coordinates","230268","2020-10-21","18:00:00",""
"7056906","10.129","0.002","11.495","0.003","12.113","0.003","66.334","0.005","82.721","0.004","83.176","0.005","1277.7","0.5","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H30.7 N2 -","- C32 H30.7 N2 -","- C64 H61.4 N4 -","2","1","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0946","0.0478","","","0.1038","0.1241","","","","","","0.978","","","","has coordinates,has disorder","230268","2020-10-21","18:00:00",""
"7056907","12.4574","0.0012","13.7387","0.0013","20.538","0.002","90","","95.175","0.002","90","","3500.7","0.6","200","2","200","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C40 H47.5 N2 Si2 -","- C40 H47.5 N2 Si2 -","- C160 H190 N8 Si8 -","4","2","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0839","0.07","","","0.1871","0.2","","","","","","1.038","","","","has coordinates","230268","2020-10-21","18:00:00",""
"7056908","10.7045","0.0012","12.8727","0.0015","11.9991","0.0014","90","","92.607","0.002","90","","1651.7","0.3","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H44 N2 Si2 -","- C38 H44 N2 Si2 -","- C76 H88 N4 Si4 -","2","0.5","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0439","0.036","","","0.099","0.1068","","","","","","1.029","","","","has coordinates","230268","2020-10-21","18:00:00",""
"7056909","10.093","0.002","12.721","0.003","11.827","0.002","90","","92.34","0.03","90","","1517.2","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 N2 Si2 -","- C36 H40 N2 Si2 -","- C72 H80 N4 Si4 -","2","0.5","","Yuan, Shifang; Wang, Lijing; Huang, Chuanbing; Niu, Chunxia; Xiang, Kai; Xu, Caihong; Solan, Gregory A.; Ma, Hongwei; Sun, Wen-Hua","Azasilicon-bridged heterocyclic arylamines: syntheses, structures and photophysical properties","New Journal of Chemistry","2018","42","4","3102","","10.1039/C7NJ03876C","","","0.71073","MoKα","","0.0796","0.0686","","","0.2064","0.2209","","","","","","1.035","","","","has coordinates","230268","2020-10-21","18:00:00",""
"7056910","22.2982","0.0018","8.5917","0.0008","26.0739","0.0014","90","","112.116","0.005","90","","4627.7","0.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","sulfonamide chalcone","chalcone2,5-dichloro-N-{3-[(2E)-3-(4-nitrophenyl)prop-2-enoyl]phenyl}benzenesulfonamide","","- C21 H14 Cl2 N2 O5 S -","- C21 H14 Cl2 N2 O5 S -","- C168 H112 Cl16 N16 O40 S8 -","8","1","","Custodio, Jean M. F.; Michelini, Lidiane J.; de Castro, Mirian Rita C.; Vaz, Wesley F.; Neves, Bruno J.; Cravo, Pedro V. L.; Barreto, Francisco S.; Filho, Manoel O. M.; Perez, Caridad N.; Napolitano, Hamilton B.","Structural insights into a novel anticancer sulfonamide chalcone","New Journal of Chemistry","2018","42","5","3426","","10.1039/C7NJ03523C","","","0.71073","MoKα","","0.0923","0.0579","","","0.149","0.1699","","","","","","1.047","","","","has coordinates,has disorder","230263","2020-10-21","18:00:00",""
"7056911","6.9409","0.0013","5.1266","0.001","16.585","0.003","90","","98.805","0.003","90","","583.19","0.19","133","2","133","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H12 N6 O6 -","- C8 H12 N6 O6 -","- C16 H24 N12 O12 -","2","0.5","","Ma, Qing; Gu, Hao; Huang, Jinglun; Nie, Fude; Fan, Guijuan; Liao, Longyu; Yang, Wei","Formation of trinitromethyl functionalized 1,2,4-triazole-based energetic ionic salts and a zwitterionic salt directed by an intermolecular and intramolecular metathesis strategy","New Journal of Chemistry","2018","42","4","2376","","10.1039/C7NJ03939E","","","0.71073","MoKα","","0.0645","0.0396","","","0.0917","0.1004","","","","","","1.064","","","","has coordinates","230273","2020-10-21","18:00:00",""
"7056912","11.8413","0.0013","10.444","0.0011","13.822","0.0014","90","","91.458","0.002","90","","1708.8","0.3","130","","130","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H6 N12 O14 -","- C6 H6 N12 O14 -","- C24 H24 N48 O56 -","4","0.5","","Ma, Qing; Gu, Hao; Huang, Jinglun; Nie, Fude; Fan, Guijuan; Liao, Longyu; Yang, Wei","Formation of trinitromethyl functionalized 1,2,4-triazole-based energetic ionic salts and a zwitterionic salt directed by an intermolecular and intramolecular metathesis strategy","New Journal of Chemistry","2018","42","4","2376","","10.1039/C7NJ03939E","","","0.71073","MoKα","","0.0503","0.0359","","","0.0878","0.0953","","","","","","1.015","","","","has coordinates","230273","2020-10-21","18:00:00",""
"7056913","7.7188","0.001","16.867","0.002","6.4384","0.0008","90","","90","","90","","838.23","0.18","130","","130","","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C3 N8 O6 -","- C3 N8 O6 -","- C12 N32 O24 -","4","1","","Ma, Qing; Gu, Hao; Huang, Jinglun; Nie, Fude; Fan, Guijuan; Liao, Longyu; Yang, Wei","Formation of trinitromethyl functionalized 1,2,4-triazole-based energetic ionic salts and a zwitterionic salt directed by an intermolecular and intramolecular metathesis strategy","New Journal of Chemistry","2018","42","4","2376","","10.1039/C7NJ03939E","","","0.71073","MoKα","","0.0444","0.0341","","","0.0735","0.0776","","","","","","1.023","","","","has coordinates","230273","2020-10-21","18:00:00",""
"7056914","28.422","0.0006","9.0408","0.0002","20.3084","0.0004","90","","99.281","0.002","90","","5150.09","0.19","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C120 H112 Cu3 N12 O6 -","- C120 H112 Cu3 N12 O6 -","- C240 H224 Cu6 N24 O12 -","2","0.5","","Saini, Anoop Kumar; Saraf, Mohit; Kumari, Pratibha; Mobin, Shaikh M.","A highly selective and sensitive chemosensor forl-tryptophan by employing a Schiff based Cu(ii) complex","New Journal of Chemistry","2018","42","5","3509","","10.1039/C7NJ04595F","","","0.71073","MoKα","","0.0864","0.067","","","0.1637","0.1801","","","","","","1.031","","","","has coordinates,has disorder","230252","2020-10-21","18:00:00",""
"7056915","7.5332","0.0015","44.989","0.009","9.6294","0.0019","90","","105.58","0.03","90","","3143.6","1.2","170","2","170","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H17 Fe N -","- C21 H17 Fe N -","- C168 H136 Fe8 N8 -","8","4","","Rosa, Vitor; Gaspari, Ana P. S.; Folgosa, Filipe; Cordas, Cristina M.; Tavares, Pedro; Santos-Silva, Teresa; Barroso, Sónia; Avilés, Teresa","Imine ligands based on ferrocene: synthesis, structural and Mössbauer characterization and evaluation as chromogenic and electrochemical sensors for Hg2+","New Journal of Chemistry","2018","42","5","3334","","10.1039/C7NJ04319H","","","0.71073","MoKα","","0.0735","0.0544","","","0.102","0.1079","","","","","","1.079","","","","has coordinates","230266","2020-10-21","18:00:00",""
"7056916","20.003","0.004","7.5328","0.0015","22.945","0.005","90","","108.63","0.03","90","","3276.2","1.3","170","2","170","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H19 Fe N -","- C22 H19 Fe N -","- C176 H152 Fe8 N8 -","8","1","","Rosa, Vitor; Gaspari, Ana P. S.; Folgosa, Filipe; Cordas, Cristina M.; Tavares, Pedro; Santos-Silva, Teresa; Barroso, Sónia; Avilés, Teresa","Imine ligands based on ferrocene: synthesis, structural and Mössbauer characterization and evaluation as chromogenic and electrochemical sensors for Hg2+","New Journal of Chemistry","2018","42","5","3334","","10.1039/C7NJ04319H","","","0.71073","MoKα","","0.0505","0.0338","","","0.0808","0.0864","","","","","","1.018","","","","has coordinates","230266","2020-10-21","18:00:00",""
"7056917","14.807","0.004","14.807","0.004","14.807","0.004","90","","90","","90","","3246.4","1.5","293","2","293","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ba1.75 Na0.5 S4 Sn -","- Ba1.74998 Na0.500025 S4 Sn -","- Ba27.9996 Na8.0004 S64 Sn16 -","16","0.333333","","Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie","Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation","New Journal of Chemistry","2018","42","5","3350","","10.1039/C7NJ04288D","","","0.71073","MoKα","","0.0362","0.0352","","","0.0905","0.0909","","","","","","1.104","","","","has coordinates","230253","2020-10-21","18:00:00",""
"7056918","15.1628","0.0005","15.1628","0.0005","15.1628","0.0005","90","","90","","90","","3486.1","0.2","296","2","296","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ba1.75 Li0.5 Se4 Sn -","- Ba1.7475 Li0.5025 Se4 Sn -","- Ba27.96 Li8.04 Se64 Sn16 -","16","0.333333","","Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie","Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation","New Journal of Chemistry","2018","42","5","3350","","10.1039/C7NJ04288D","","","0.71073","MoKα","","0.0233","0.0217","","","0.0491","0.0496","","","","","","1.095","","","","has coordinates","230253","2020-10-21","18:00:00",""
"7056919","15.4163","0.0013","15.4163","0.0013","15.4163","0.0013","90","","90","","90","","3663.9","0.5","296","2","296","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ba1.75 Na0.5 Se4 Sn -","- Ba1.7475 Na0.5025 Se4 Sn -","- Ba27.96 Na8.04 Se64 Sn16 -","16","0.333333","","Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie","Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation","New Journal of Chemistry","2018","42","5","3350","","10.1039/C7NJ04288D","","","0.71073","MoKα","","0.0396","0.037","","","0.0997","0.1019","","","","","","1.118","","","","has coordinates","230253","2020-10-21","18:00:00",""
"7056920","14.577","0.002","14.577","0.002","14.577","0.002","90","","90","","90","","3097.5","0.7","293","2","293","2","","","","","","","","4","I -4 3 d","I -4bd 2c 3","220","","","","- Ba1.75 Li0.5 S4 Sn -","- Ba1.74998 Li0.500025 S4 Sn -","- Ba27.9996 Li8.0004 S64 Sn16 -","16","0.333333","","Abudurusuli, Ailijiang; Wu, Kui; Pan, Shilie","Four new quaternary chalcogenides A2Ba7Sn4Q16 (A = Li, Na; Q = S, Se): syntheses, crystal structures determination, nonlinear optical performances investigation","New Journal of Chemistry","2018","42","5","3350","","10.1039/C7NJ04288D","","","0.71073","MoKα","","0.036","0.0347","","","0.09","0.0906","","","","","","1.198","","","","has coordinates","230253","2020-10-21","18:00:00",""
"7056921","6.8499","0.0004","25.8041","0.0017","9.4897","0.0005","90","","90","","90","","1677.36","0.17","296","2","296","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C17 H12 B F6 N3 -","- C17 H12 B F6 N3 -","- C68 H48 B4 F24 N12 -","4","0.5","","Prasannan, Dijo; Arunkumar, Chellaiah","A “turn-on-and-off” pH sensitive BODIPY fluorescent probe for imaging E. coli cells","New Journal of Chemistry","2018","42","5","3473","","10.1039/C7NJ04313A","","","0.71073","MoKα","","0.061","0.0502","","","0.1467","0.1565","","","","","","1.122","","","","has coordinates","230258","2020-10-21","18:00:00",""
"7056922","12.2654","0.0011","10.5756","0.001","13.3074","0.0012","90","","116.339","0.002","90","","1547","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H16 B F2 N3 -","- C17 H16 B F2 N3 -","- C68 H64 B4 F8 N12 -","4","1","","Prasannan, Dijo; Arunkumar, Chellaiah","A “turn-on-and-off” pH sensitive BODIPY fluorescent probe for imaging E. coli cells","New Journal of Chemistry","2018","42","5","3473","","10.1039/C7NJ04313A","","","0.71073","MoKα","","0.0751","0.0392","","","0.0882","0.1122","","","","","","1.084","","","","has coordinates","230258","2020-10-21","18:00:00",""
"7056923","20.9","0.004","4.9614","0.001","24.079","0.005","90","","102.14","0.03","90","","2441","0.9","277","2","277","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H8 Cl6 N8 S2 -","- C16 H8 Cl6 N8 S2 -","- C64 H32 Cl24 N32 S8 -","4","0.5","","Thakur, Neha; Pandey, Mrituanjay D.; Pandey, Rampal","A uniquely fabricated Cu(ii)-metallacycle as a reusable highly sensitive dual-channel and practically functional metalloreceptor for Fe3+ and Ca2+ ions: an inorganic site of cation detection","New Journal of Chemistry","2018","42","5","3582","","10.1039/C7NJ03294C","","","0.71073","","","0.12122","0.072842","","","","0.243618","","","","","","1.01752","","","","has coordinates","230259","2020-10-21","18:00:00",""
"7056924","8.442","0.004","6.727","0.0013","14.467","0.003","90","","90","","90","","821.6","0.5","277","2","277","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C6 H11 N3 O3 -","- C6 H11 N3 O3 -","- C24 H44 N12 O12 -","4","0.5","","Thakur, Neha; Pandey, Mrituanjay D.; Pandey, Rampal","A uniquely fabricated Cu(ii)-metallacycle as a reusable highly sensitive dual-channel and practically functional metalloreceptor for Fe3+ and Ca2+ ions: an inorganic site of cation detection","New Journal of Chemistry","2018","42","5","3582","","10.1039/C7NJ03294C","","","0.71073","MoKα","","0.1679","0.1516","","","0.4348","0.4455","","","","","","1.776","","","","has coordinates","230259","2020-10-21","18:00:00",""
"7056925","7.2021","0.0013","9.469","0.003","11.699","0.003","66.533","0.013","80.57","0.03","81.58","0.03","719","0.3","277","2","277","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H14 Cu N2 O7 S2 -","- C10 H14 Cu N2 O7 S2 -","- C20 H28 Cu2 N4 O14 S4 -","2","1","","Thakur, Neha; Pandey, Mrituanjay D.; Pandey, Rampal","A uniquely fabricated Cu(ii)-metallacycle as a reusable highly sensitive dual-channel and practically functional metalloreceptor for Fe3+ and Ca2+ ions: an inorganic site of cation detection","New Journal of Chemistry","2018","42","5","3582","","10.1039/C7NJ03294C","","","0.71073","MoKα","","0.0716","0.0627","","","0.1744","0.2029","","","","","","1.042","","","","has coordinates","230259","2020-10-21","18:00:00",""
"7056926","12.289","0.003","7.6775","0.0015","14.314","0.003","90","","110.8","0.03","90","","1262.5","0.5","277","2","277","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 Cl2 Co N2 S -","- C10 H8 Cl2 Co N2 S -","- C40 H32 Cl8 Co4 N8 S4 -","4","1","","Thakur, Neha; Pandey, Mrituanjay D.; Pandey, Rampal","A uniquely fabricated Cu(ii)-metallacycle as a reusable highly sensitive dual-channel and practically functional metalloreceptor for Fe3+ and Ca2+ ions: an inorganic site of cation detection","New Journal of Chemistry","2018","42","5","3582","","10.1039/C7NJ03294C","","","0.71073","","","0.036159","0.028651","","","","0.113488","","","","","","0.873674","","","","has coordinates","230259","2020-10-21","18:00:00",""
"7056927","9.9976","0.0017","13.561","0.002","14.593","0.003","89.719","0.004","71.759","0.004","80.909","0.004","1853.4","0.6","273.15","","273.15","","","","","","","","","5","P -1","-P 1","2","","","","- C34 H48 N6 O10 Zn -","- C34 H48 N6 O10 Zn -","- C68 H96 N12 O20 Zn2 -","2","1","","Liu, Yan; Liu, Wei; Xu, Cong; Dou, Wei; Ju, Zhenghua; Liu, Weisheng","Temperature-induced self-assembly of two kinds Zn(ii)-based coordination polymers with luminescence properties for application in sensing and adsorption","New Journal of Chemistry","2018","42","5","3885","","10.1039/C7NJ04698G","","","0.71073","MoKα","","0.1316","0.0678","","","0.1402","0.1727","","","","","","0.983","","","","has coordinates","230257","2020-10-21","18:00:00",""
"7056928","12.9","0.008","5.117","0.003","36.695","0.019","90","","109.44","0.018","90","","2284","2","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H20 N2 O6 Zn0.81 -","- C22 H20 N2 O6 Zn0.805 -","- C88 H80 N8 O24 Zn3.22 -","4","1","","Liu, Yan; Liu, Wei; Xu, Cong; Dou, Wei; Ju, Zhenghua; Liu, Weisheng","Temperature-induced self-assembly of two kinds Zn(ii)-based coordination polymers with luminescence properties for application in sensing and adsorption","New Journal of Chemistry","2018","42","5","3885","","10.1039/C7NJ04698G","","","0.71073","MoKα","","0.2559","0.2314","","","0.5155","0.5282","","","","","","1.15","","","","has coordinates,has disorder","230257","2020-10-21","18:00:00",""
"7056929","17.855","0.004","19.68","0.004","20.206","0.004","65.56","0.03","66.4","0.03","64.63","0.03","5622","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C84 H50 N10 O16 Zn4 -","- C84 H50 N10 O16 Zn4 -","- C168 H100 N20 O32 Zn8 -","2","1","","Wang, Jun-Jie; Zhang, Ren-Chun; Cao, Ya-Li; Li, Yan-Ang; Wang, Yi-Ran; Wang, Qing-Lun","Selective fluorescent sensing and photocatalytic properties of three MOFs based on naphthalene-1,4-dicarboxylic acid and 2,4,5-tri(4-pyridyl)-imidazole","New Journal of Chemistry","2018","42","5","3551","","10.1039/C7NJ03530F","","","0.71073","MoKα","","0.0829","0.0472","","","0.1244","0.1342","","","","","","0.892","","","","has coordinates,has disorder","230260","2020-10-21","18:00:00",""
"7056930","17.0707","0.0002","20.2756","0.0003","20.5249","0.0003","91.6837","0.0014","107.867","0.0013","94.2364","0.0012","6732.81","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C90 H64 Cd4 N12 O18 -","- C90 H64 Cd4 N12 O18 -","- C180 H128 Cd8 N24 O36 -","2","1","","Wang, Jun-Jie; Zhang, Ren-Chun; Cao, Ya-Li; Li, Yan-Ang; Wang, Yi-Ran; Wang, Qing-Lun","Selective fluorescent sensing and photocatalytic properties of three MOFs based on naphthalene-1,4-dicarboxylic acid and 2,4,5-tri(4-pyridyl)-imidazole","New Journal of Chemistry","2018","42","5","3551","","10.1039/C7NJ03530F","","","1.54184","CuKα","","0.0662","0.0637","","","0.1795","0.1858","","","","","","1.018","","","","has coordinates","230260","2020-10-21","18:00:00",""
"7056931","10.3","0.002","11.877","0.002","16.851","0.003","74","0.03","85.73","0.03","85.08","0.03","1971.5","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H30 Mn N10 O4 -","- C48 H30 Mn N10 O4 -","- C96 H60 Mn2 N20 O8 -","2","1","","Wang, Jun-Jie; Zhang, Ren-Chun; Cao, Ya-Li; Li, Yan-Ang; Wang, Yi-Ran; Wang, Qing-Lun","Selective fluorescent sensing and photocatalytic properties of three MOFs based on naphthalene-1,4-dicarboxylic acid and 2,4,5-tri(4-pyridyl)-imidazole","New Journal of Chemistry","2018","42","5","3551","","10.1039/C7NJ03530F","","","0.71073","MoKα","","0.0775","0.0634","","","0.1387","0.1441","","","","","","1.127","","","","has coordinates","230260","2020-10-21","18:00:00",""
"7056932","11.5086","0.0003","13.443","0.0004","11.8588","0.0003","90","","90","","90","","1834.68","0.09","120","2","120","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C13 H8 Ag F3 N8 O3 S -","- C13 H8 Ag F3 N8 O3 S -","- C52 H32 Ag4 F12 N32 O12 S4 -","4","0.5","","Jääskeläinen, Sirpa; Appiah, Nana Sakyibea; Koshevoy, Igor; Hirva, Pipsa","Impacts of the counter ions on 4,5-dicyano-1-methylimidazole silver coordination","New Journal of Chemistry","2018","42","5","3363","","10.1039/C7NJ03763E","","","0.71073","MoKα","","0.0281","0.0205","","","0.0492","0.0531","","","","","","1.031","","","","has coordinates","230267","2020-10-21","18:00:00",""
"7056933","28.5595","0.0019","5.7123","0.0004","12.7499","0.0008","90","","113.076","0.002","90","","1913.6","0.2","120","2","120","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C6 H4 Ag Cl N4 O3 -","- C6 H4 Ag Cl N4 O3 -","- C48 H32 Ag8 Cl8 N32 O24 -","8","1","","Jääskeläinen, Sirpa; Appiah, Nana Sakyibea; Koshevoy, Igor; Hirva, Pipsa","Impacts of the counter ions on 4,5-dicyano-1-methylimidazole silver coordination","New Journal of Chemistry","2018","42","5","3363","","10.1039/C7NJ03763E","","","0.71073","MoKα","","0.0182","0.0159","","","0.0386","0.0396","","","","","","1.083","","","","has coordinates","230267","2020-10-21","18:00:00",""
"7056934","5.8782","0.0002","8.5137","0.0003","17.6073","0.0006","90","","93.106","0.001","90","","879.87","0.05","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H4 Ag N5 O3 -","- C6 H4 Ag N5 O3 -","- C24 H16 Ag4 N20 O12 -","4","1","","Jääskeläinen, Sirpa; Appiah, Nana Sakyibea; Koshevoy, Igor; Hirva, Pipsa","Impacts of the counter ions on 4,5-dicyano-1-methylimidazole silver coordination","New Journal of Chemistry","2018","42","5","3363","","10.1039/C7NJ03763E","","","0.71073","MoKα","","0.0228","0.0194","","","0.0431","0.0444","","","","","","1.061","","","","has coordinates","230267","2020-10-21","18:00:00",""
"7056935","8.0945","0.0016","7.3937","0.0015","27.724","0.006","90","","93.02","0.03","90","","1656.9","0.6","153","2","153.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H25 B12 N3 O -","- C5 H25 B12 N3 O -","- C20 H100 B48 N12 O4 -","4","1","","Li, Hao; Zhang, Yanqiang; Liu, Long; Jiao, Nianming; Meng, Xianghai; Zhang, Suojiang","Amino functionalized [B12H12]2− salts as hypergolic fuels","New Journal of Chemistry","2018","42","5","3568","","10.1039/C7NJ04225F","","","0.71073","MoKα","","0.1939","0.1826","","","0.3444","0.3543","","","","","","1.14","","","","has coordinates,has disorder","230256","2020-10-21","18:00:00",""
"7056936","23.2777","0.0007","10.3096","0.0002","25.1059","0.0008","90","","110.776","0.004","90","","5633.2","0.3","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H32.04 B9 Cl2.04 P -","- C24 H32.0441 B9 Cl2.0441 P -","- C192 H256.353 B72 Cl16.3528 P8 -","8","1","","Schlüter, Florian; Bernhardt, Eduard; Zhizhin, Konstantin","Diverse chemistry of the dianion [closo-B9H9]2−: synthesis and reactivity of its mono-anionic derivative [arachno-B9H12-4,8-Cl2]−","New Journal of Chemistry","2018","42","4","2553","","10.1039/C7NJ04251E","","","0.71073","MoKα","","0.0435","0.0368","","","0.0942","0.0986","","","","","","1.071","","","","has coordinates","230271","2020-10-21","18:00:00",""
"7056937","15.9036","0.0004","11.4442","0.0003","17.4141","0.0005","90","","90","","90","","3169.44","0.15","100","","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H18 Cu N2 O2 -","- C18 H18 Cu N2 O2 -","- C144 H144 Cu8 N16 O16 -","8","1","","Costes, Jean-Pierre; Duhayon, Carine; Vendier, Laure; Mota, Antonio J.","Reactions of a series of ZnL, CuL and NiL Schiff base and non-Schiff base complexes with MCl2 salts (M = Cu, Ni, Mn): syntheses, structures, magnetic properties and DFT calculations","New Journal of Chemistry","2018","42","5","3683","","10.1039/C7NJ04347C","","","1.5418","CuKα","","0.026","0.0259","","0.0324","0.0324","0.0324","","","","","","0.9698","","","","has coordinates","230251","2020-10-21","18:00:00",""
"7056938","24.927","0.005","47.25","0.01","14.055","0.003","90","","90","","90","","16554","6","100","","100","","","","","","","","","8","F d d 2","F 2 -2d","43","","","","- C36 H37 Cl4 Cu K2 N4 Ni2 O8.5 -","- C36 H36 Cl4 Cu K2 N4 Ni2 O8.5 -","- C576 H576 Cl64 Cu16 K32 N64 Ni32 O136 -","16","1","","Costes, Jean-Pierre; Duhayon, Carine; Vendier, Laure; Mota, Antonio J.","Reactions of a series of ZnL, CuL and NiL Schiff base and non-Schiff base complexes with MCl2 salts (M = Cu, Ni, Mn): syntheses, structures, magnetic properties and DFT calculations","New Journal of Chemistry","2018","42","5","3683","","10.1039/C7NJ04347C","","","0.71073","MoKα","","0.0404","0.0329","","0.0464","0.0345","0.0342","","","","","","1.069","","","","has coordinates","230251","2020-10-21","18:00:00",""
"7056939","17.2244","0.0002","7.40088","0.00008","18.7657","0.0002","90","","107.501","0.0014","90","","2281.45","0.05","100","","100","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 Cl2 Cu2 N2 O6 -","- C20 H26 Cl2 Cu2 N2 O6 -","- C80 H104 Cl8 Cu8 N8 O24 -","4","1","","Costes, Jean-Pierre; Duhayon, Carine; Vendier, Laure; Mota, Antonio J.","Reactions of a series of ZnL, CuL and NiL Schiff base and non-Schiff base complexes with MCl2 salts (M = Cu, Ni, Mn): syntheses, structures, magnetic properties and DFT calculations","New Journal of Chemistry","2018","42","5","3683","","10.1039/C7NJ04347C","","","1.5418","CuKα","","0.0246","0.0245","","0.0278","0.0278","0.0278","","","","","","0.9411","","","","has coordinates","230251","2020-10-21","18:00:00",""
"7056940","11.6765","0.0003","17.0328","0.0004","14.5948","0.0004","90","","99.753","0.002","90","","2860.71","0.13","180","","180","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H31 Cl Mn Ni O12 -","- C26 H31 Cl Mn Ni O12 -","- C104 H124 Cl4 Mn4 Ni4 O48 -","4","1","","Costes, Jean-Pierre; Duhayon, Carine; Vendier, Laure; Mota, Antonio J.","Reactions of a series of ZnL, CuL and NiL Schiff base and non-Schiff base complexes with MCl2 salts (M = Cu, Ni, Mn): syntheses, structures, magnetic properties and DFT calculations","New Journal of Chemistry","2018","42","5","3683","","10.1039/C7NJ04347C","","","0.71073","MoKα","","0.0409","0.0264","","0.0351","0.0309","0.0299","","","","","","1.0872","","","","has coordinates","230251","2020-10-21","18:00:00",""
"7056941","5.875","0.0002","7.3536","0.0003","14.1683","0.0005","76.132","0.002","79.333","0.001","79.249","0.001","577.47","0.04","295","","295","","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C12 H9 Fe N3 O3 -","- C12 H9 Fe N3 O3 -","- C24 H18 Fe2 N6 O6 -","2","1","","Erb, William; Levanen, Gael; Roisnel, Thierry; Dorcet, Vincent","Application of the Curtius rearrangement to the synthesis of 1′-aminoferrocene-1-carboxylic acid derivatives","New Journal of Chemistry","2018","42","5","3808","","10.1039/C7NJ05020H","","x-ray","0.71073","MoKα","","0.0418","0.0324","","","0.0744","0.0797","","","","","","1.096","","","","has coordinates","230261","2020-10-21","18:00:00",""
"7056942","5.8627","0.0006","16.8493","0.0016","25.022","0.002","90","","90","","90","","2471.7","0.4","150","","150","","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","","","","- C12 H8 Fe N6 O2 -","- C12 H8 Fe N6 O2 -","- C96 H64 Fe8 N48 O16 -","8","1","","Erb, William; Levanen, Gael; Roisnel, Thierry; Dorcet, Vincent","Application of the Curtius rearrangement to the synthesis of 1′-aminoferrocene-1-carboxylic acid derivatives","New Journal of Chemistry","2018","42","5","3808","","10.1039/C7NJ05020H","","x-ray","0.71073","MoKα","","0.0564","0.0448","","","0.0925","0.0965","","","","","","1.171","","","","has coordinates","230261","2020-10-21","18:00:00",""
"7056943","14.4756","0.0006","7.4476","0.0003","17.2948","0.0008","90","","114.161","0.002","90","","1701.19","0.13","150","","150","","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 Fe N O5 -","- C19 H19 Fe N O5 -","- C76 H76 Fe4 N4 O20 -","4","1","","Erb, William; Levanen, Gael; Roisnel, Thierry; Dorcet, Vincent","Application of the Curtius rearrangement to the synthesis of 1′-aminoferrocene-1-carboxylic acid derivatives","New Journal of Chemistry","2018","42","5","3808","","10.1039/C7NJ05020H","","x-ray","0.71073","MoKα","","0.039","0.0289","","","0.068","0.0729","","","","","","1.037","","","","has coordinates","230261","2020-10-21","18:00:00",""
"7056944","8.432","0.0009","11.1582","0.0011","15.5903","0.0015","69.828","0.003","85.294","0.004","85.8","0.004","1370.6","0.2","150","2","150","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C15 H15 Fe N O4 -","- C15 H15 Fe N O4 -","- C60 H60 Fe4 N4 O16 -","4","2","","Erb, William; Levanen, Gael; Roisnel, Thierry; Dorcet, Vincent","Application of the Curtius rearrangement to the synthesis of 1′-aminoferrocene-1-carboxylic acid derivatives","New Journal of Chemistry","2018","42","5","3808","","10.1039/C7NJ05020H","","x-ray","0.71073","MoKα","","0.0548","0.0452","","","0.1152","0.1192","","","","","","1.141","","","","has coordinates","230261","2020-10-21","18:00:00",""
"7056945","21.36","0.0013","10.0652","0.0005","9.5245","0.0006","90","","96.112","0.002","90","","2036.1","0.2","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 Fe N2 O6 -","- C20 H22 Fe N2 O6 -","- C80 H88 Fe4 N8 O24 -","4","1","","Erb, William; Levanen, Gael; Roisnel, Thierry; Dorcet, Vincent","Application of the Curtius rearrangement to the synthesis of 1′-aminoferrocene-1-carboxylic acid derivatives","New Journal of Chemistry","2018","42","5","3808","","10.1039/C7NJ05020H","","x-ray","0.71073","MoKα","","0.0768","0.062","","","0.1664","0.1731","","","","","","1.258","","","","has coordinates","230261","2020-10-21","18:00:00",""
"7056946","14.193","0.007","11.681","0.004","21.035","0.01","90","","90","","90","","3487","3","150","2","150","2","","","","","","","synthesis as described","5","P b c a","-P 2ac 2ab","61","","","","- C18 H25 Fe N O4 -","- C18 H25 Fe N O4 -","- C144 H200 Fe8 N8 O32 -","8","1","","Erb, William; Levanen, Gael; Roisnel, Thierry; Dorcet, Vincent","Application of the Curtius rearrangement to the synthesis of 1′-aminoferrocene-1-carboxylic acid derivatives","New Journal of Chemistry","2018","42","5","3808","","10.1039/C7NJ05020H","","x-ray","0.71073","MoKα","","0.0591","0.0493","","","0.1203","0.131","","","","","","1.072","","","","has coordinates","230261","2020-10-21","18:00:00",""
"7056947","21.508","0.0005","21.508","0.0005","7.9027","0.0003","90","","90","","90","","3655.74","0.18","293","2","293","2","","","","","","","","6","P 42/n","-P 4bc","86","","","","- C12 H11.2 F4 N3 O7.6 V -","- C12 H8 F4 N3 O7.595 V -","- C96 H64 F32 N24 O60.76 V8 -","8","","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","0.71073","MoKα","","0.1361","0.0938","","","0.2439","0.2729","","","","","","1.024","","","","has coordinates","205871","2020-10-21","18:00:00",""
"7056948","8.0697","0.0003","13.0146","0.0005","15.4733","0.0006","90","","104.392","0.002","90","","1574.07","0.1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H14 N3 O9 V -","- C12 H14 N3 O9 V -","- C48 H56 N12 O36 V4 -","4","0.5","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","0.71073","MoKα","","0.0766","0.0714","","","0.1905","0.1929","","","","","","1.17","","","","has coordinates","205871","2020-10-21","18:00:00",""
"7056949","26.2936","0.0003","24.352","0.0003","26.5498","0.0003","90","","90","","90","","16999.9","0.3","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H25.33333 F4 N6 O4.66667 Zn -","- C26 H24 F4 N6 O4.66667 Zn -","- C624 H576 F96 N144 O112 Zn24 -","24","3","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","0.71073","MoKα","","0.0955","0.0486","","","0.1178","0.1409","","","","","","1.006","","","","has coordinates","206540","2020-10-21","18:00:00",""
"7056950","12.9576","0.0008","28.0951","0.0007","10.7178","0.0005","90","","126.182","0.008","90","","3149.3","0.4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C26 H14 Cl6 F4 N4 O4 Zn -","- C26 H14 Cl6 F4 N4 O4 Zn -","- C104 H56 Cl24 F16 N16 O16 Zn4 -","4","0.5","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","0.71073","MoKα","","0.0699","0.0521","","","0.122","0.1335","","","","","","1.053","","","","has coordinates,has disorder","205871","2020-10-21","18:00:00",""
"7056951","14.0406","0.0002","10.5121","0.0002","13.961","0.0002","90","","92.836","0.001","90","","2058.07","0.06","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 N4 O6 Zn -","- C24 H16 N4 O6 Zn -","- C96 H64 N16 O24 Zn4 -","4","1","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","1.54184","CuKα","","0.03","0.0265","","","0.0683","0.0709","","","","","","1.033","","","","has coordinates","205871","2020-10-21","18:00:00",""
"7056952","18.0287","0.0004","10.3166","0.0002","14.9805","0.0003","90","","106.022","0.001","90","","2678.06","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H19 F4 N5 O4 Zn -","- C27 H19 F4 N5 O4 Zn -","- C108 H76 F16 N20 O16 Zn4 -","4","1","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","0.71073","MoKα","","0.0685","0.042","","","0.1038","0.118","","","","","","1.02","","","","has coordinates","205871","2020-10-21","18:00:00",""
"7056953","7.9159","0.0004","18.3331","0.001","13.4273","0.0007","90","","90","","90","","1948.61","0.18","150","2","150","2","","","","","","","","5","P n n a","-P 2a 2bc","52","","","","- C19 H20 N4 O7 Zn -","- C19 H20 N4 O7 Zn -","- C76 H80 N16 O28 Zn4 -","4","0.5","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","0.71073","MoKα","","0.0353","0.0278","","","0.0735","0.079","","","","","","1.045","","","","has coordinates","205871","2020-10-21","18:00:00",""
"7056954","6.5421","0.0003","6.9212","0.0003","8.7493","0.0004","97.521","0.003","101.906","0.002","114.749","0.003","341.35","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H8 F4 N2 O6 Zn -","- C12 H8 F4 N2 O6 Zn -","- C12 H8 F4 N2 O6 Zn -","1","0.5","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","0.71073","MoKα","","0.0277","0.0268","","","0.0698","0.0704","","","","","","1.133","","","","has coordinates","205871","2020-10-21","18:00:00",""
"7056955","19.6242","0.0009","6.4863","0.0002","15.5404","0.0006","90","","126.316","0.006","90","","1593.89","0.16","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H16 N2 O8 Zn -","- C14 H16 N2 O8 Zn -","- C56 H64 N8 O32 Zn4 -","4","0.5","","Koleša Dobravc, Tanja; Maejima, Keiichi; Yoshikawa, Yutaka; Meden, Anton; Yasui, Hiroyuki; Perdih, Franc","Bis(picolinato) complexes of vanadium and zinc as potential antidiabetic agents: synthesis, structural elucidation and in vitro insulin-mimetic activity study","New Journal of Chemistry","2018","","","","","10.1039/C7NJ04189F","","","1.54184","CuKα","","0.0283","0.0274","","","0.0756","0.0763","","","","","","1.073","","","","has coordinates","205871","2020-10-21","18:00:00",""
"7056956","11.401","0.005","12.131","0.006","20.955","0.01","90","","97.285","0.005","90","","2875","2","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H35 N3 -","- C36 H35 N3 -","- C144 H140 N12 -","4","1","","Liu, Zhaodi; Hao, Fuying; Liu, Jie; Zhu, Yingzhong; Du, Wei; Zhang, Qiong; Wu, Jieying","Synthesis, crystal structures, one/two-photon optical properties and bioimaging application of two organic molecules with D‒A and D‒π‒A models containing 6-phenyl-2,2′-bipyridine","New Journal of Chemistry","2018","42","5","3947","","10.1039/C7NJ04812B","","","0.71073","MoKα","","0.0754","0.0631","","","0.1812","0.1952","","","","","","1.044","","","","has coordinates","230254","2020-10-21","18:00:00",""
"7056957","9.7012","0.0012","15.2517","0.0018","15.9105","0.0019","90","","99.164","0.002","90","","2324.1","0.5","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H29 N3 -","- C28 H29 N3 -","- C112 H116 N12 -","4","1","","Liu, Zhaodi; Hao, Fuying; Liu, Jie; Zhu, Yingzhong; Du, Wei; Zhang, Qiong; Wu, Jieying","Synthesis, crystal structures, one/two-photon optical properties and bioimaging application of two organic molecules with D‒A and D‒π‒A models containing 6-phenyl-2,2′-bipyridine","New Journal of Chemistry","2018","42","5","3947","","10.1039/C7NJ04812B","","","0.71073","MoKα","","0.11","0.0767","","","0.2203","0.2559","","","","","","1.05","","","","has coordinates,has disorder","230254","2020-10-21","18:00:00",""
"7056958","11.0704","0.0009","14.3596","0.0011","17.1745","0.001","79.77","0.006","87.148","0.006","69.427","0.008","2515.2","0.3","100","","100","","","","","","","","","3","P -1","-P 1","2","","","","- C65 H64 N2 -","- C65 H64 N2 -","- C130 H128 N4 -","2","1","","Zheng, Zheng; Ayhan, Mehmet Menaf; Liao, Yuan-Yuan; Calin, Nathalie; Bucher, Christophe; Andraud, Chantal; Bretonnière, Yann","Design of two-photon absorbing fluorophores for FRET antenna-core oxygen probes","New Journal of Chemistry","2018","42","10","7914","","10.1039/C7NJ05073A","","","1.54184","CuKα","","0.1069","0.0884","","","0.2748","0.2911","","","","","","1.069","","","","has coordinates","230195","2020-10-21","18:00:00",""
"7056959","18.5324","0.0013","7.4286","0.0005","27.642","0.002","90","","102.721","0.007","90","","3712.1","0.5","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C45 H50 S2 -","- C45 H50 S2 -","- C180 H200 S8 -","4","1","","Zheng, Zheng; Ayhan, Mehmet Menaf; Liao, Yuan-Yuan; Calin, Nathalie; Bucher, Christophe; Andraud, Chantal; Bretonnière, Yann","Design of two-photon absorbing fluorophores for FRET antenna-core oxygen probes","New Journal of Chemistry","2018","42","10","7914","","10.1039/C7NJ05073A","","","1.54184","CuKα","","0.0459","0.0402","","","0.1022","0.108","","","","","","1.018","","","","has coordinates","230195","2020-10-21","18:00:00",""
"7056960","19.7298","0.0007","19.7298","0.0007","19.036","0.0007","90","","90","","120","","6417.3","0.4","293","2","293","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C12 H10 Cl0.04 N2 O2 -","- C12.75 H7.5 Cl0.75 N2.25 O0.75 -","- C306 H180 Cl18 N54 O18 -","24","1.33333","","Singh, Jay Bahadur; Mishra, Kalpana; Gupta, Tanu; Singh, Radhey M.","Copper-catalyzed cascade reaction: synthesis of pyrimido[4,5-b]quinolinones from 2-chloroquinoline-3-carbonitriles with (aryl)methanamines","New Journal of Chemistry","2018","42","5","3310","","10.1039/C7NJ04689H","","","0.71073","MoKα","","0.0646","0.0458","","","0.0959","0.1033","","","","","","1.022","","","","has coordinates","230265","2020-10-21","18:00:00",""
"7056961","9.3941","0.0002","15.6006","0.0004","11.3901","0.0003","90","","110.569","0.003","90","","1562.84","0.07","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H15 N3 O -","- C19 H15 N3 O -","- C76 H60 N12 O4 -","4","1","","Patel, Ram N.; Singh, Yogendra; Singh, Yogendra Pratap; Patel, Abhay K.; Patel, Neetu; Singh, Rita; Butcher, Raymond J.; Jasinski, Jerry P.; Colacio, Enrique; Palacios, Maria A.","Varying structural motifs, unusual X-band electron paramagnetic spectra, DFT studies and superoxide dismutase enzymatic activity of copper(ii) complexes with N′-[(E)-phenyl(pyridin-2-yl)methylidene]benzohydrazide","New Journal of Chemistry","2018","42","4","3112","","10.1039/C7NJ04182A","","","1.54184","CuKα","","0.0415","0.0385","","","0.0999","0.1024","","","","","","1.046","","","","has coordinates","230274","2020-10-21","18:00:00",""
"7056962","18.5582","0.0004","7.2193","0.0001","29.697","0.0005","90","","97.879","0.002","90","","3941.16","0.12","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H16 Cl Cu N3 O6 -","- C19 H16 Cl Cu N3 O6 -","- C152 H128 Cl8 Cu8 N24 O48 -","8","1","","Patel, Ram N.; Singh, Yogendra; Singh, Yogendra Pratap; Patel, Abhay K.; Patel, Neetu; Singh, Rita; Butcher, Raymond J.; Jasinski, Jerry P.; Colacio, Enrique; Palacios, Maria A.","Varying structural motifs, unusual X-band electron paramagnetic spectra, DFT studies and superoxide dismutase enzymatic activity of copper(ii) complexes with N′-[(E)-phenyl(pyridin-2-yl)methylidene]benzohydrazide","New Journal of Chemistry","2018","42","4","3112","","10.1039/C7NJ04182A","","","1.54184","CuKα","","0.0361","0.035","","","0.0999","0.1009","","","","","","1.061","","","","has coordinates","230274","2020-10-21","18:00:00",""
"7056963","10.8813","0.0009","9.9859","0.0009","18.908","0.002","90","","92.166","0.009","90","","2053.1","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H36 Cu2 N11 O10 -","- C42 H36 Cu2 N11 O10 -","- C84 H72 Cu4 N22 O20 -","2","0.5","","Patel, Ram N.; Singh, Yogendra; Singh, Yogendra Pratap; Patel, Abhay K.; Patel, Neetu; Singh, Rita; Butcher, Raymond J.; Jasinski, Jerry P.; Colacio, Enrique; Palacios, Maria A.","Varying structural motifs, unusual X-band electron paramagnetic spectra, DFT studies and superoxide dismutase enzymatic activity of copper(ii) complexes with N′-[(E)-phenyl(pyridin-2-yl)methylidene]benzohydrazide","New Journal of Chemistry","2018","42","4","3112","","10.1039/C7NJ04182A","","","0.71073","MoKα","","0.1573","0.1231","","","0.2349","0.2542","","","","","","1.213","","","","has coordinates,has disorder","230274","2020-10-21","18:00:00",""
"7056964","10.79","0.002","19.988","0.004","16.376","0.003","90","","95.718","0.003","90","","3514.2","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C38 H29.75 Cl Cu N6 O6.36 -","- C38 H29.754 Cl0.996 Cu N6 O6.361 -","- C152 H119.016 Cl3.984 Cu4 N24 O25.444 -","4","1","","Patel, Ram N.; Singh, Yogendra; Singh, Yogendra Pratap; Patel, Abhay K.; Patel, Neetu; Singh, Rita; Butcher, Raymond J.; Jasinski, Jerry P.; Colacio, Enrique; Palacios, Maria A.","Varying structural motifs, unusual X-band electron paramagnetic spectra, DFT studies and superoxide dismutase enzymatic activity of copper(ii) complexes with N′-[(E)-phenyl(pyridin-2-yl)methylidene]benzohydrazide","New Journal of Chemistry","2018","42","4","3112","","10.1039/C7NJ04182A","","","0.71073","MoKα","","0.0494","0.0398","","","0.1047","0.1093","","","","","","1.03","","","","has coordinates,has disorder","230274","2020-10-21","18:00:00",""
"7056965","12.4219","0.0005","10.6123","0.0004","19.5746","0.0009","90","","101.469","0.005","90","","2528.9","0.19","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H22 Cu N6 O4 -","- C29 H22 Cu N6 O4 -","- C116 H88 Cu4 N24 O16 -","4","1","","Patel, Ram N.; Singh, Yogendra; Singh, Yogendra Pratap; Patel, Abhay K.; Patel, Neetu; Singh, Rita; Butcher, Raymond J.; Jasinski, Jerry P.; Colacio, Enrique; Palacios, Maria A.","Varying structural motifs, unusual X-band electron paramagnetic spectra, DFT studies and superoxide dismutase enzymatic activity of copper(ii) complexes with N′-[(E)-phenyl(pyridin-2-yl)methylidene]benzohydrazide","New Journal of Chemistry","2018","42","4","3112","","10.1039/C7NJ04182A","","","0.71073","MoKα","","0.0799","0.0522","","","0.1234","0.1413","","","","","","1.046","","","","has coordinates","230274","2020-10-21","18:00:00",""
"7056966","16.3675","0.0012","19.9703","0.0015","21.5735","0.0016","90","","95.567","0.001","90","","7018.3","0.9","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C76 H60 Cl2 Cu2 N12 O13 -","- C76 H60 Cl2 Cu2 N12 O13 -","- C304 H240 Cl8 Cu8 N48 O52 -","4","1","","Patel, Ram N.; Singh, Yogendra; Singh, Yogendra Pratap; Patel, Abhay K.; Patel, Neetu; Singh, Rita; Butcher, Raymond J.; Jasinski, Jerry P.; Colacio, Enrique; Palacios, Maria A.","Varying structural motifs, unusual X-band electron paramagnetic spectra, DFT studies and superoxide dismutase enzymatic activity of copper(ii) complexes with N′-[(E)-phenyl(pyridin-2-yl)methylidene]benzohydrazide","New Journal of Chemistry","2018","42","4","3112","","10.1039/C7NJ04182A","","","0.71073","MoKα","","0.1184","0.0602","","","0.1534","0.1836","","","","","","0.999","","","","has coordinates,has disorder","230274","2020-10-21","18:00:00",""
"7056967","27.4912","0.0007","11.5671","0.0003","11.9907","0.0003","90","","110.344","0.002","90","","3575.12","0.16","200","1","200","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17 H21 Br N2 O5 -","- C17 H21 Br N2 O5 -","- C136 H168 Br8 N16 O40 -","8","1","","Ye, Fei; Boukattaya, Fatma; Haddad, Mansour; Ratovelomanana-Vidal, Virginie; Michelet, Véronique","Synthesis of 2-aminopyridines via ruthenium-catalyzed [2+2+2] cycloaddition of 1,6- and 1,7-diynes with cyanamides: scope and limitations","New Journal of Chemistry","2018","42","5","3222","","10.1039/C7NJ04933A","","","0.71073","MoKα","","0.0308","0.0236","","","0.0582","0.0611","","","","","","1.029","","","","has coordinates","230262","2020-10-21","18:00:00",""
"7056968","7.1178","0.0002","17.9132","0.0005","19.8302","0.0006","90","","90","","90","","2528.4","0.13","200","1","200","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H38 N2 O3 -","- C30 H38 N2 O3 -","- C120 H152 N8 O12 -","4","1","","Ye, Fei; Boukattaya, Fatma; Haddad, Mansour; Ratovelomanana-Vidal, Virginie; Michelet, Véronique","Synthesis of 2-aminopyridines via ruthenium-catalyzed [2+2+2] cycloaddition of 1,6- and 1,7-diynes with cyanamides: scope and limitations","New Journal of Chemistry","2018","42","5","3222","","10.1039/C7NJ04933A","","","1.54178","CuKα","","0.0421","0.0405","","","0.0983","0.0998","","","","","","1.062","","","","has coordinates","230262","2020-10-21","18:00:00",""
"7056969","16.0345","0.0007","17.0024","0.0007","13.3898","0.0006","90","","90","","90","","3650.4","0.3","100","2","100","2","","","","","","","","5","C 2 2 21","C 2c 2","20","Sn(1,2-HOPO) trihydrate","","","- C34 H40 N8 O15 Sn -","- C34 H38 N8 O15 Sn -","- C136 H152 N32 O60 Sn4 -","4","0.5","","Deblonde, Gauthier J.-P.; Lohrey, Trevor D.; An, Dahlia D.; Abergel, Rebecca J.","Toxic heavy metal ‒ Pb, Cd, Sn ‒ complexation by the octadentate hydroxypyridinonate ligand archetype 3,4,3-LI(1,2-HOPO)","New Journal of Chemistry","2018","42","10","7649","","10.1039/C7NJ04559J","","","0.7749","synchrotron","","0.0395","0.0318","","","0.0733","0.0765","","","","","","1.044","","","","has coordinates","230188","2020-10-21","18:00:00",""
"7056970","6.928","0.002","7.487","0.003","20.058","0.007","96.78","0.006","91.281","0.006","95.55","0.006","1027.7","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 Cl2 O10 Sr -","- C16 H20 Cl2 O10 Sr -","- C32 H40 Cl4 O20 Sr2 -","2","1","","Xu, Xiuling; Hu, Fan; Ma, Yuwei; Gao, Jinming; Shuai, Qi","Facile microwave synthesis, structural diversity and herbicidal activity of six novel alkaline-earth metal complexes (AECs) based on skeletal isomerization chlorophenoxyacetic acids","New Journal of Chemistry","2018","42","6","4155","","10.1039/C8NJ00107C","","","0.71073","MoKα","","0.1093","0.0896","","","0.2432","0.2702","","","","","","1.004","","","","has coordinates","230317","2020-10-21","18:00:00",""
"7056971","6.837","0.002","7.377","0.003","20.863","0.007","95.035","0.006","95.389","0.005","91.338","0.006","1043","0.6","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 Cl2 O10 Sr -","- C16 H20 Cl2 O10 Sr -","- C32 H40 Cl4 O20 Sr2 -","2","1","","Xu, Xiuling; Hu, Fan; Ma, Yuwei; Gao, Jinming; Shuai, Qi","Facile microwave synthesis, structural diversity and herbicidal activity of six novel alkaline-earth metal complexes (AECs) based on skeletal isomerization chlorophenoxyacetic acids","New Journal of Chemistry","2018","42","6","4155","","10.1039/C8NJ00107C","","","0.71073","MoKα","","0.0832","0.0674","","","0.1955","0.211","","","","","","1.066","","","","has coordinates","230317","2020-10-21","18:00:00",""
"7056972","6.598","","7.511","","19.292","","90","","96.99","","90","","948.959","","298","2","298","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H14 Ba Cl2 O7 -","- C16 H14 Ba Cl2 O7 -","- C32 H28 Ba2 Cl4 O14 -","2","1","","Xu, Xiuling; Hu, Fan; Ma, Yuwei; Gao, Jinming; Shuai, Qi","Facile microwave synthesis, structural diversity and herbicidal activity of six novel alkaline-earth metal complexes (AECs) based on skeletal isomerization chlorophenoxyacetic acids","New Journal of Chemistry","2018","42","6","4155","","10.1039/C8NJ00107C","","","0.71073","MoKα","","0.0269","0.0262","","","0.0727","0.0734","","","","","","1.106","","","","has coordinates,has disorder","230317","2020-10-21","18:00:00",""
"7056973","6.4624","0.0006","7.1964","0.0007","38.762","0.004","90","","90.898","0.001","90","","1802.4","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Cl2 O7 Sr -","- C16 H14 Cl2 O7 Sr -","- C64 H56 Cl8 O28 Sr4 -","4","1","","Xu, Xiuling; Hu, Fan; Ma, Yuwei; Gao, Jinming; Shuai, Qi","Facile microwave synthesis, structural diversity and herbicidal activity of six novel alkaline-earth metal complexes (AECs) based on skeletal isomerization chlorophenoxyacetic acids","New Journal of Chemistry","2018","42","6","4155","","10.1039/C8NJ00107C","","","0.71073","MoKα","","0.0583","0.044","","","0.1435","0.1553","","","","","","1.115","","","","has coordinates","230317","2020-10-21","18:00:00",""
"7056974","16.999","0.003","7.709","0.0014","13.979","0.003","90","","92.294","0.003","90","","1830.4","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Ba Cl2 O8 -","- C16 H16 Ba Cl2 O8 -","- C64 H64 Ba4 Cl8 O32 -","4","1","","Xu, Xiuling; Hu, Fan; Ma, Yuwei; Gao, Jinming; Shuai, Qi","Facile microwave synthesis, structural diversity and herbicidal activity of six novel alkaline-earth metal complexes (AECs) based on skeletal isomerization chlorophenoxyacetic acids","New Journal of Chemistry","2018","42","6","4155","","10.1039/C8NJ00107C","","","0.71073","MoKα","","0.0418","0.0399","","","0.1043","0.1057","","","","","","1.162","","","","has coordinates","230317","2020-10-21","18:00:00",""
"7056975","7.109","0.001","7.478","0.001","21.187","0.004","82.464","0.003","89.801","0.002","87.715","0.003","1115.7","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H22 Ba Cl2 O11 -","- C16 H22 Ba Cl2 O11 -","- C32 H44 Ba2 Cl4 O22 -","2","1","","Xu, Xiuling; Hu, Fan; Ma, Yuwei; Gao, Jinming; Shuai, Qi","Facile microwave synthesis, structural diversity and herbicidal activity of six novel alkaline-earth metal complexes (AECs) based on skeletal isomerization chlorophenoxyacetic acids","New Journal of Chemistry","2018","42","6","4155","","10.1039/C8NJ00107C","","","0.71073","MoKα","","0.0564","0.0524","","","0.1412","0.1558","","","","","","1.051","","","","has coordinates,has disorder","230317","2020-10-21","18:00:00",""
"7056976","18.078","0.003","19.791","0.004","27.758","0.005","89.91","0.004","89.021","0.003","64.574","0.003","8968","3","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C222 H123 Ir3 N12 -","- C222 H123 Ir3 N12 -","- C444 H246 Ir6 N24 -","2","1","","To, Ching Tat; Chan, Kin Shing","Complexes of guest‒host type between C60 and group 9 metalloporphyrins","New Journal of Chemistry","2018","42","10","7599","","10.1039/C7NJ05081J","","","0.71073","MoKα","","0.1301","0.1","","","0.3003","0.3239","","","","","","1.15","","","","has coordinates","230204","2020-10-21","18:00:00",""
"7056977","16.3792","0.0007","22.5894","0.001","21.6432","0.001","90","","94.058","0.001","90","","7987.8","0.6","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C114 H41 Ir N4 -","- C114 H41 Ir N4 -","- C456 H164 Ir4 N16 -","4","0.5","","To, Ching Tat; Chan, Kin Shing","Complexes of guest‒host type between C60 and group 9 metalloporphyrins","New Journal of Chemistry","2018","42","10","7599","","10.1039/C7NJ05081J","","","0.71073","MoKα","","0.0303","0.0262","","","0.0641","0.0652","","","","","","1.038","","","","has coordinates,has disorder","230204","2020-10-21","18:00:00",""
"7056978","16.367","0.003","22.892","0.004","21.508","0.004","90","","93.794","0.004","90","","8041","3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","C60-Co(ttp)Ph","","","- C121 H49 Co N4 -","- C117 H49 Co N4 -","- C468 H196 Co4 N16 -","4","0.5","","To, Ching Tat; Chan, Kin Shing","Complexes of guest‒host type between C60 and group 9 metalloporphyrins","New Journal of Chemistry","2018","42","10","7599","","10.1039/C7NJ05081J","","","0.71073","MoKα","","0.1419","0.1127","","","0.3073","0.3307","","","","","","1.235","","","","has coordinates","230204","2020-10-21","18:00:00",""
"7056979","10.4271","0.0008","10.9326","0.001","12.6606","0.001","82.471","0.003","87.024","0.002","89.204","0.003","1428.8","0.2","123","2","123","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H54 Au2 F12 N12 O P2 -","- C52 H54 Au2 F12 N12 O P2 -","- C52 H54 Au2 F12 N12 O P2 -","1","0.5","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0905","0.0603","","","0.1414","0.1538","","","","","","1.065","","","","has coordinates,has disorder","230309","2020-10-21","18:00:00",""
"7056980","9.0425","0.0015","9.3574","0.0016","9.7188","0.0017","63.038","0.003","85.745","0.003","71.462","0.003","692.5","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H28 F12 N6 P2 -","- C22 H28 F12 N6 P2 -","- C22 H28 F12 N6 P2 -","1","0.5","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.1146","0.1014","","","0.3087","0.329","","","","","","1.404","","","","has coordinates,has disorder","230309","2020-10-21","18:00:00",""
"7056981","16.844","0.0018","18.928","0.002","11.487","0.0013","90","","90","","90","","3662.3","0.7","150","2","150","2","","","","","","","","6","C m m m","-C 2 2","65","","","","- C44 H52 Au2 F12 N12 P2 -","- C44 H52 Au2 F12 N12 P2 -","- C88 H104 Au4 F24 N24 P4 -","2","0.125","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0611","0.0558","","","0.1632","0.1692","","","","","","1.487","","","","has coordinates","230309","2020-10-21","18:00:00",""
"7056982","8.2979","0.0009","12.1995","0.0013","16.345","0.0018","75.187","0.002","89.641","0.002","71.594","0.002","1512.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H31 F12 N7 P2 -","- C25 H31 F12 N7 P2 -","- C50 H62 F24 N14 P4 -","2","1","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0549","0.0501","","","0.1319","0.1361","","","","","","1.052","","","","has coordinates,has disorder","230309","2020-10-21","18:00:00",""
"7056983","12.3","0.003","12.549","0.003","12.557","0.003","101.682","0.004","105.479","0.004","107.42","0.004","1696.1","0.7","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H68 F24 N16 P4 -","- C54 H68 F24 N16 P4 -","- C54 H68 F24 N16 P4 -","1","0.5","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0865","0.0526","","","0.1418","0.1594","","","","","","1.024","","","","has coordinates","230309","2020-10-21","18:00:00",""
"7056984","13.2791","0.0008","15.8555","0.001","13.7001","0.0008","90","","91.707","0.002","90","","2883.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H26 F12 N6 P2 -","- C25 H26 F12 N6 P2 -","- C100 H104 F48 N24 P8 -","4","1","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0806","0.0619","","","0.1347","0.143","","","","","","1.068","","","","has coordinates,has disorder","230309","2020-10-21","18:00:00",""
"7056985","16.3158","0.0009","21.8651","0.0012","15.697","0.0009","90","","107.662","0.002","90","","5335.9","0.5","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H46 Au2 F12 N10 P2 -","- C42 H46 Au2 F12 N10 P2 -","- C168 H184 Au8 F48 N40 P8 -","4","1","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.1185","0.0692","","","0.1741","0.1957","","","","","","1.086","","","","has coordinates,has disorder","230309","2020-10-21","18:00:00",""
"7056986","19.8816","0.0015","19.6411","0.0015","17.4125","0.0013","90","","111.78","0.002","90","","6314.1","0.8","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H54 Ag3 F18 N14 P3 -","- C54 H54 Ag3 F18 N14 P3 -","- C216 H216 Ag12 F72 N56 P12 -","4","0.5","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0877","0.0594","","","0.1423","0.1535","","","","","","1.055","","","","has coordinates","230309","2020-10-21","18:00:00",""
"7056987","11.581","0.001","13.0142","0.0011","14.4842","0.0012","111.816","0.002","94.973","0.002","101.746","0.002","1952.3","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H76 Ag4 F24 N20 P4 -","- C60 H76 Ag4 F24 N20 P4 -","- C60 H76 Ag4 F24 N20 P4 -","1","0.5","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0499","0.0377","","","0.0834","0.0878","","","","","","1.029","","","","has coordinates,has disorder","230309","2020-10-21","18:00:00",""
"7056988","16.413","0.003","31.614","0.006","17.239","0.003","90","","115.306","0.003","90","","8087","3","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H64 Ag3 F18 N16 P3 -","- C54 H64 Ag3 F18 N16 P3 -","- C216 H256 Ag12 F72 N64 P12 -","4","0.5","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.1981","0.103","","","0.2584","0.298","","","","","","1.198","","","","has coordinates,has disorder","230309","2020-10-21","18:00:00",""
"7056989","16.284","0.002","21.324","0.003","17.361","0.002","90","","90","","90","","6028.4","1.3","150","2","150","2","","","","","","","","6","C m c m","-C 2c 2","63","","","","- C46 H52 Ag3 F18 N12 P3 -","- C46 H52 Ag3 F18 N12 P3 -","- C184 H208 Ag12 F72 N48 P12 -","4","0.25","","Lu, Taotao; Yang, Chu-Fan; Steren, Carlos A.; Fei, Fan; Chen, Xue-Tai; Xue, Zi-Ling","Synthesis and characterization of Ag(i) and Au(i) complexes with macrocyclic hybrid amine N-heterocyclic carbene ligands","New Journal of Chemistry","2018","42","6","4700","","10.1039/C7NJ04020B","","","0.71073","MoKα","","0.0955","0.0703","","","0.1646","0.1767","","","","","","1.167","","","","has coordinates","230309","2020-10-21","18:00:00",""
"7056990","8.868","0.0003","15.558","0.0005","23.326","0.0006","90","","100.659","0.002","90","","3162.72","0.17","153.15","","153.15","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C35 H38 Co I N P3 -","- C35 H38 Co I N P3 -","- C140 H152 Co4 I4 N4 P12 -","4","1","","Zhang, Hua; Xing, Junyang; Dong, Yanhong; Xie, Shangqing; Ren, Shishuai; Qi, Xinghao; Sun, Hongjian; Li, Xiaoyan; Fuhr, Olaf; Fenske, Dieter","Phosphine-assisted C‒H bond activation in Schiff bases and formation of novel organo cobalt complexes bearing Schiff base ligands","New Journal of Chemistry","2018","42","6","4646","","10.1039/C7NJ03480F","","x-ray","0.71073","MoKα","","0.0303","0.0228","","","0.051","0.053","","","","","","0.973","","","","has coordinates","230308","2020-10-21","18:00:00",""
"7056991","40.6142","0.0016","9.1256","0.0003","15.9365","0.0006","90","","105.127","0.005","90","","5701.9","0.4","174.15","","174.15","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C31 H37 Co N P3 -","- C31 H37 Co N P3 -","- C248 H296 Co8 N8 P24 -","8","1","","Zhang, Hua; Xing, Junyang; Dong, Yanhong; Xie, Shangqing; Ren, Shishuai; Qi, Xinghao; Sun, Hongjian; Li, Xiaoyan; Fuhr, Olaf; Fenske, Dieter","Phosphine-assisted C‒H bond activation in Schiff bases and formation of novel organo cobalt complexes bearing Schiff base ligands","New Journal of Chemistry","2018","42","6","4646","","10.1039/C7NJ03480F","","x-ray","0.71073","MoKα","","0.0516","0.0382","","","0.0935","0.0997","","","","","","1.024","","","","has coordinates","230308","2020-10-21","18:00:00",""
"7056992","8.7562","0.0003","16.0052","0.0004","23.0007","0.0009","90","","99.977","0.003","90","","3174.68","0.19","173.15","","173.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C35 H40 Co N P3 -","- C35 H40 Co N P3 -","- C140 H160 Co4 N4 P12 -","4","1","","Zhang, Hua; Xing, Junyang; Dong, Yanhong; Xie, Shangqing; Ren, Shishuai; Qi, Xinghao; Sun, Hongjian; Li, Xiaoyan; Fuhr, Olaf; Fenske, Dieter","Phosphine-assisted C‒H bond activation in Schiff bases and formation of novel organo cobalt complexes bearing Schiff base ligands","New Journal of Chemistry","2018","42","6","4646","","10.1039/C7NJ03480F","","x-ray","0.71073","MoKα","","0.0317","0.0265","","","0.0684","0.0717","","","","","","1.027","","","","has coordinates","230308","2020-10-21","18:00:00",""
"7056993","10.289","0.002","15.896","0.003","18.982","0.004","90","","104.414","0.002","90","","3006.9","1","297","","296.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","2017Li01","","- C34 H30 Co N O2 P2 -","- C34 H30 Co N O2 P2 -","- C136 H120 Co4 N4 O8 P8 -","4","1","","Zhang, Hua; Xing, Junyang; Dong, Yanhong; Xie, Shangqing; Ren, Shishuai; Qi, Xinghao; Sun, Hongjian; Li, Xiaoyan; Fuhr, Olaf; Fenske, Dieter","Phosphine-assisted C‒H bond activation in Schiff bases and formation of novel organo cobalt complexes bearing Schiff base ligands","New Journal of Chemistry","2018","42","6","4646","","10.1039/C7NJ03480F","","","0.71","synchrotron","","0.1045","0.0483","","","0.0835","0.1048","","","","","","1.043","","","","has coordinates,has disorder","230308","2020-10-21","18:00:00",""
"7056994","23.561","0.004","5.5343","0.0007","33.019","0.007","90","","105.037","0.013","90","","4158","1.3","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H30 N4 O2 P2 -","- C20 H30 N4 O2 P2 -","- C160 H240 N32 O16 P16 -","8","1","","Wolf, Florian F.; Neudörfl, Jörg-M.; Goldfuss, Bernd","Hydrogen-bonding cyclodiphosphazanes: superior effects of 3,5-(CF3)2-substitution in anion-recognition and counter-ion catalysis","New Journal of Chemistry","2018","42","7","4854","","10.1039/C7NJ04660J","","","1.54178","CuKα","","0.0449","0.0432","","","0.0975","0.0982","","","","","","1.246","","","","has coordinates","230420","2020-10-21","18:00:00",""
"7056995","15.3034","0.0003","17.1558","0.0003","17.7407","0.0003","90","","90","","90","","4657.68","0.15","100","2","100","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H30 N4 P2 S2 -","- C20 H30 N4 P2 S2 -","- C160 H240 N32 P16 S16 -","8","1","","Wolf, Florian F.; Neudörfl, Jörg-M.; Goldfuss, Bernd","Hydrogen-bonding cyclodiphosphazanes: superior effects of 3,5-(CF3)2-substitution in anion-recognition and counter-ion catalysis","New Journal of Chemistry","2018","42","7","4854","","10.1039/C7NJ04660J","","","1.54178","CuKα","","0.0306","0.0277","","","0.0729","0.0752","","","","","","1.08","","","","has coordinates","230420","2020-10-21","18:00:00",""
"7056996","21.6468","0.0005","14.6286","0.0003","16.9134","0.0004","90","","112.636","0.001","90","","4943.3","0.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H34 N4 O2 P2 S -","- C21 H34 N4 O2 P2 S -","- C168 H272 N32 O16 P16 S8 -","8","2","","Wolf, Florian F.; Neudörfl, Jörg-M.; Goldfuss, Bernd","Hydrogen-bonding cyclodiphosphazanes: superior effects of 3,5-(CF3)2-substitution in anion-recognition and counter-ion catalysis","New Journal of Chemistry","2018","42","7","4854","","10.1039/C7NJ04660J","","","1.54178","CuKα","","0.0649","0.0532","","","0.1249","0.1317","","","","","","1.058","","","","has coordinates","230420","2020-10-21","18:00:00",""
"7056997","14.0313","0.0004","21.65","0.0006","12.1766","0.0003","90","","90","","90","","3698.98","0.17","100","2","100","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C28 H36 F12 N4 O4 P2 S -","- C28 H36 F12 N4 O4 P2 S -","- C112 H144 F48 N16 O16 P8 S4 -","4","1","","Wolf, Florian F.; Neudörfl, Jörg-M.; Goldfuss, Bernd","Hydrogen-bonding cyclodiphosphazanes: superior effects of 3,5-(CF3)2-substitution in anion-recognition and counter-ion catalysis","New Journal of Chemistry","2018","42","7","4854","","10.1039/C7NJ04660J","","","1.54178","CuKα","","0.0439","0.0416","","","0.1115","0.1129","","","","","","0.994","","","","has coordinates","230420","2020-10-21","18:00:00",""
"7056998","9.148","0.0006","17.8831","0.0019","22.334","0.002","90","","93.484","0.009","90","","3647","0.6","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H34 F12 N4 O2 P2 S2 -","- C28 H34 F12 N4 O2 P2 S2 -","- C112 H136 F48 N16 O8 P8 S8 -","4","1","","Wolf, Florian F.; Neudörfl, Jörg-M.; Goldfuss, Bernd","Hydrogen-bonding cyclodiphosphazanes: superior effects of 3,5-(CF3)2-substitution in anion-recognition and counter-ion catalysis","New Journal of Chemistry","2018","42","7","4854","","10.1039/C7NJ04660J","","","1.54178","CuKα","","0.0391","0.0371","","","0.0884","0.0897","","","","","","1.036","","","","has coordinates","230420","2020-10-21","18:00:00",""
"7056999","11.177","0.002","13.8549","0.0018","14.3529","0.0016","78.106","0.009","79.722","0.019","75.226","0.015","2084.3","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H45 F12 N6 P3 S3 -","- C32 H45 F12 N6 P3 S3 -","- C64 H90 F24 N12 P6 S6 -","2","1","","Wolf, Florian F.; Neudörfl, Jörg-M.; Goldfuss, Bernd","Hydrogen-bonding cyclodiphosphazanes: superior effects of 3,5-(CF3)2-substitution in anion-recognition and counter-ion catalysis","New Journal of Chemistry","2018","42","7","4854","","10.1039/C7NJ04660J","","","1.54178","CuKα","","0.0321","0.0311","","","0.0757","0.0762","","","","","","1.068","","","","has coordinates","230420","2020-10-21","18:00:00",""
"7057000","14.2556","0.0014","9.1252","0.0007","24.169","0.002","90","","90","","90","","3144","0.5","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","<i>N</i>-(naphthalen-1-yl)benzenesulfonamidee","<i>N</i>-(naphthalen-1-yl)benzenesulfonamide","","- C17 H14 N2 O2 S -","- C17 H14 N2 O2 S -","- C136 H112 N16 O16 S8 -","8","1","","Asiri, Abdullah M.; Hussain, Mohammad Musarraf; Arshad, Muhammad Nadeem; Rahman, Mohammed M.","A Ce2+ sensor based on napthalen-1-yl-methylene-benzenesulfonohydrazide (NMBSH) molecules: ecological sample analysis","New Journal of Chemistry","2018","42","6","4465","","10.1039/C7NJ05109C","","","0.71073","MoKα","","0.1505","0.0661","","","0.1718","0.219","","","","","","1.035","","","","has coordinates","230315","2020-10-21","18:00:00",""
"7057001","9.9621","0.0009","11.8993","0.0012","14.2532","0.0013","90","","95.48","0.008","90","","1681.9","0.3","296","2","296","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","4-Methyl-<i>N</i>-(naphthalen-1-yl)benzenesulfonamidee","4-Methyl-<i>N</i>-(naphthalen-1-yl)benzenesulfonamide","","- C18 H16 N2 O2 S -","- C18 H16 N2 O2 S -","- C72 H64 N8 O8 S4 -","4","1","","Asiri, Abdullah M.; Hussain, Mohammad Musarraf; Arshad, Muhammad Nadeem; Rahman, Mohammed M.","A Ce2+ sensor based on napthalen-1-yl-methylene-benzenesulfonohydrazide (NMBSH) molecules: ecological sample analysis","New Journal of Chemistry","2018","42","6","4465","","10.1039/C7NJ05109C","","","0.71073","MoKα","","0.0826","0.049","","","0.1227","0.1438","","","","","","1.029","","","","has coordinates","230315","2020-10-21","18:00:00",""
"7057002","28.787","0.002","8.9631","0.0007","21.4722","0.0015","90","","131.572","0.002","90","","4144.8","0.5","150","2","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H26 Mn N4 Si2 -","- C16 H26 Mn N4 Si2 -","- C128 H208 Mn8 N32 Si16 -","8","1","","Du, Liyong; Yu, Shaoshan; Liu, Xinfang; Ding, Yuqiang","An aminopyridinato Mn(ii) compound as a novel CVD precursor for manganese-containing films","New Journal of Chemistry","2018","42","6","4553","","10.1039/C8NJ00062J","","","0.71073","MoKα","","0.1242","0.084","","","0.2449","0.2868","","","","","","1.044","","","","has coordinates,has disorder","230318","2020-10-21","18:00:00",""
"7057003","16.7872","0.0009","24.9663","0.0013","26.3075","0.0013","90","","91.737","0.002","90","","11020.8","1","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C54 H36 F15 N4 O2 -","- C54 H29 F15 N4 O2 -","- C432 H232 F120 N32 O16 -","8","1","","Almeida, José; Silva, André M. N.; Rebelo, Susana L. H.; Cunha-Silva, Luís; Rangel, Maria; de Castro, Baltazar; Leite, Andreia; Silva, Ana M. G.","Synthesis and coordination studies of 5-(4′-carboxyphenyl)-10,15,20-tris(pentafluorophenyl)porphyrin and its pyrrolidine-fused chlorin derivative","New Journal of Chemistry","2018","42","10","8169","","10.1039/C7NJ05165D","","","0.71073","MoKα","","0.0758","0.0626","","","0.2499","0.2696","","","","","","1.183","","","","has coordinates","230193","2020-10-21","18:00:00",""
"7057004","8.9864","0.0005","11.0902","0.0004","11.4091","0.0006","91.56","0.004","113.048","0.005","105.14","0.004","999.18","0.1","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C19 H12 Au Cl0 F5 P S -","- C19 H12 Au F5 P S -","- C38 H24 Au2 F10 P2 S2 -","2","1","","Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo","Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds","New Journal of Chemistry","2018","42","10","7845","","10.1039/C7NJ04354F","","","0.71073","MoKα","","0.0354","0.029","","","0.0569","0.0605","","","","","","1.018","","","","has coordinates","230185","2020-10-21","18:00:00",""
"7057005","8.985","0.0005","10.8789","0.0005","11.1836","0.0006","76.038","0.004","67.746","0.005","75.977","0.004","967.88","0.09","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H30 Au2 F4 P2 S2 -","- C38 H30 Au2 F4 P2 S2 -","- C38 H30 Au2 F4 P2 S2 -","1","0.5","","Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo","Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds","New Journal of Chemistry","2018","42","10","7845","","10.1039/C7NJ04354F","","","0.71073","MoKα","","0.0288","0.0247","","","0.0486","0.0507","","","","","","1.045","","","","has coordinates","230185","2020-10-21","18:00:00",""
"7057006","8.97","0.0005","10.9988","0.0007","11.4532","0.0007","75.894","0.005","67.698","0.005","75.461","0.005","997.96","0.11","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H26 Au2 F8 P2 S2 -","- C38 H26 Au2 F8 P2 S2 -","- C38 H26 Au2 F8 P2 S2 -","1","0.5","","Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo","Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds","New Journal of Chemistry","2018","42","10","7845","","10.1039/C7NJ04354F","","","0.71073","MoKα","","0.0525","0.0402","","","0.0821","0.0892","","","","","","1.04","","","","has coordinates","230185","2020-10-21","18:00:00",""
"7057007","9.7553","0.0004","14.6526","0.0008","15.2724","0.001","64.407","0.006","77.001","0.005","83.625","0.004","1918.2","0.2","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H32 Au2 F6 P2 S2 -","- C40 H32 Au2 F6 P2 S2 -","- C80 H64 Au4 F12 P4 S4 -","2","1","","Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo","Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds","New Journal of Chemistry","2018","42","10","7845","","10.1039/C7NJ04354F","","","0.71073","MoKα","","0.0569","0.0363","","","0.0787","0.0904","","","","","","1.057","","","","has coordinates","230185","2020-10-21","18:00:00",""
"7057008","11.8084","0.0007","19.9316","0.001","15.9884","0.0008","90","","110.408","0.006","90","","3526.8","0.4","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H30 Au2 F4 P2 S2 -","- C38 H30 Au2 F4 P2 S2 -","- C152 H120 Au8 F16 P8 S8 -","4","1","","Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo","Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds","New Journal of Chemistry","2018","42","10","7845","","10.1039/C7NJ04354F","","","0.71073","MoKα","","0.0493","0.0322","","","0.0586","0.066","","","","","","1.047","","","","has coordinates","230185","2020-10-21","18:00:00",""
"7057009","11.5947","0.0005","19.9982","0.001","15.8994","0.0007","90","","108.857","0.005","90","","3488.8","0.3","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H32 Au2 F2 P2 S2 -","- C38 H32 Au2 F2 P2 S2 -","- C152 H128 Au8 F8 P8 S8 -","4","1","","Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo","Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds","New Journal of Chemistry","2018","42","10","7845","","10.1039/C7NJ04354F","","","0.71073","MoKα","","0.078","0.0552","","","0.1113","0.1239","","","","","","1.071","","","","has coordinates,has disorder","230185","2020-10-21","18:00:00",""
"7057010","12.5426","0.0005","12.7737","0.0004","13.3107","0.0005","84.665","0.003","67.65","0.004","74.963","0.003","1904.8","0.13","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H64 Au4 F12 P4 S4 -","- C80 H64 Au4 F12 P4 S4 -","- C80 H64 Au4 F12 P4 S4 -","1","0.5","","Moreno-Alcántar, Guillermo; Romo-Islas, Guillermo; Flores-Álamo, Marcos; Torrens, Hugo","Aurophilicity vs. thiophilicity: directing the crystalline supramolecular arrangement in luminescent gold compounds","New Journal of Chemistry","2018","42","10","7845","","10.1039/C7NJ04354F","","","0.71073","MoKα","","0.0573","0.0399","","","0.0813","0.0929","","","","","","1.032","","","","has coordinates","230185","2020-10-21","18:00:00",""
"7057011","13.4139","0.0016","19.1246","0.0019","9.4516","0.0009","90","","103.255","0.01","90","","2360.1","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H22 Cl2 N4 O4 -","- C22 H22 Cl2 N4 O4 -","- C88 H88 Cl8 N16 O16 -","4","1","","Canard, Gabriel; Chen, Zhongrui; Suryaningtias, Aprilliyani; Jean, Marion; Vanthuyne, Nicolas; Giorgi, Michel; Roussel, Christian; Siri, Olivier","Regioselective addition of DDQ on a quinoid ring: an entry into chiral zwitterionic bridging ligands","New Journal of Chemistry","2018","42","10","8247","","10.1039/C7NJ03765A","","x-ray","1.54184","CuKα","","0.1383","0.082","","","0.2048","0.2342","","","","","","1.032","","","","has coordinates,has disorder","230198","2020-10-21","18:00:00",""
"7057012","7.9128","0.0006","16.8566","0.0012","17.3103","0.0012","88.592","0.002","88.414","0.002","82.929","0.002","2289.9","0.3","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H40 F12 N4 P2 -","- C50 H40 F12 N4 P2 -","- C100 H80 F24 N8 P4 -","2","1","","Gosset, A.; Xu, Z.; Maurel, F.; Chamoreau, L.-M.; Nowak, S.; Vives, G.; Perruchot, C.; Heitz, V.; Jacquot de Rouville, H.-P.","A chemically-responsive bis-acridinium receptor","New Journal of Chemistry","2018","42","6","4728","","10.1039/C7NJ03712K","","","0.71073","MoKα","","0.0628","0.047","","","0.1289","0.1414","","","","","","1.039","","","","has coordinates,has disorder","230316","2020-10-21","18:00:00",""
"7057013","10.579","0.0006","11.3818","0.0006","11.6474","0.0007","108.722","0.003","103.837","0.003","111.593","0.003","1128.81","0.13","296","2","296","2","","","","","","","","4","P -1","-P 1","2","Polyoxoometallate","Na6(H2O)22(V10O28).2H2O","","- H48 Na6 O52 V10 -","- H48 Na6 O52 V10 -","- H48 Na6 O52 V10 -","1","0.5","","Sharma, Mitu; Saikia, Gangutri; Ahmed, Kabirun; Gogoi, Sandhya Rani; Puranik, Vedavati G.; Islam, Nashreen S.","Vanadium-based polyoxometalate complex as a new and efficient catalyst for phenol hydroxylation under mild conditions","New Journal of Chemistry","2018","42","7","5142","","10.1039/C7NJ04433J","","","0.71073","MoKα","","0.1245","0.0437","","","0.0678","0.0745","","","","","","0.973","","","","has coordinates","230424","2020-10-21","18:00:00",""
"7057014","6.472","0.003","27.71","0.011","8.31","0.003","90","","110.61","0.009","90","","1394.9","1","115","1","115","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 N2 O7 U -","- C10 H18 N2 O7 U -","- C40 H72 N8 O28 U4 -","4","1","","Sornosa-Ten, Alejandra; Jewula, Pawel; Fodor, Tamas; Brandès, Stéphane; Sladkov, Vladimir; Rousselin, Yoann; Stern, Christine; Chambron, Jean-Claude; Meyer, Michel","Effects of preorganization in the chelation of UO22+by hydroxamate ligands: cyclic PIPO−vs.linear NMA−","New Journal of Chemistry","2018","42","10","7765","","10.1039/C8NJ00166A","","x-ray","0.71073","MoKα","","0.0284","0.0273","","","0.0595","0.06","","","","","","1.309","","","","has coordinates","230190","2020-10-21","18:00:00",""
"7057015","7.5931","0.0019","9.5094","0.0019","13.177","0.003","103.046","0.008","106.647","0.009","94.822","0.008","876.7","0.4","200","","200","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H40 Br2 Cu N12 O10 -","- C24 H36 Br2 Cu N12 O10 -","- C24 H36 Br2 Cu N12 O10 -","1","0.5","","Berezin, A. S.; Ivanova, A. D.; Komarov, V. Yu.; Nadolinny, V. A.; Lavrenova, L. G.","Influence of water on the structure and magnetic properties of a copper bromide coordination compound with 3-amino-4-ethoxycarbonylpyrazole","New Journal of Chemistry","2018","42","7","4902","","10.1039/C8NJ00017D","","","0.71073","MoKα","","0.102","0.048","","","0.0751","0.0885","","","","","","0.974","","","","has coordinates","230422","2020-10-21","18:00:00",""
"7057016","11.262","0.003","7.5904","0.0017","21.555","0.004","90","","94.803","0.007","90","","1836.1","0.7","150","","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H40 Br2 Cu N12 O10 -","- C24 H40 Br2 Cu N12 O10 -","- C48 H80 Br4 Cu2 N24 O20 -","2","0.5","","Berezin, A. S.; Ivanova, A. D.; Komarov, V. Yu.; Nadolinny, V. A.; Lavrenova, L. G.","Influence of water on the structure and magnetic properties of a copper bromide coordination compound with 3-amino-4-ethoxycarbonylpyrazole","New Journal of Chemistry","2018","42","7","4902","","10.1039/C8NJ00017D","","","0.71073","MoKα","","0.0317","0.0248","","","0.0575","0.0602","","","","","","1.037","","","","has coordinates","230422","2020-10-21","18:00:00",""
"7057017","30.7828","0.0017","5.6317","0.0003","20.8991","0.0012","90","","100.075","0.002","90","","3567.2","0.3","150","","150","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C24 H38 Br2 Cu N12 O9 -","- C24 H36 Br2 Cu N12 O9 -","- C96 H144 Br8 Cu4 N48 O36 -","4","1","","Berezin, A. S.; Ivanova, A. D.; Komarov, V. Yu.; Nadolinny, V. A.; Lavrenova, L. G.","Influence of water on the structure and magnetic properties of a copper bromide coordination compound with 3-amino-4-ethoxycarbonylpyrazole","New Journal of Chemistry","2018","42","7","4902","","10.1039/C8NJ00017D","","","0.71073","MoKα","","0.0497","0.0331","","","0.0754","0.0816","","","","","","1.028","","","","has coordinates","230422","2020-10-21","18:00:00",""
"7057018","9.173","0.002","14.015","0.004","15.954","0.005","90","","106.572","0.008","90","","1965.8","0.9","223.15","","223.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 N8 O16 Tb2 -","- C36 H30 N8 O16 Tb2 -","- C72 H60 N16 O32 Tb4 -","2","0.5","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.0743","0.046","","","0.0957","0.1057","","","","","","1.034","","","","has coordinates","230426","2020-10-21","18:00:00",""
"7057019","9.1835","0.0006","13.8511","0.0009","15.925","0.0012","90","","105.826","0.002","90","","1948.9","0.2","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 Ho2 N8 O16 -","- C36 H30 Ho2 N8 O16 -","- C72 H60 Ho4 N16 O32 -","2","0.5","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.0467","0.0287","","","0.0438","0.0472","","","","","","1.068","","","","has coordinates","230426","2020-10-21","18:00:00",""
"7057020","9.3218","0.0005","13.8104","0.0007","15.8272","0.001","90","","105.427","0.006","90","","1964.1","0.2","298.15","","298.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 Er2 N8 O16 -","- C36 H30 Er2 N8 O16 -","- C72 H60 Er4 N16 O32 -","2","0.5","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.0667","0.036","","","0.0456","0.053","","","","","","0.963","","","","has coordinates","230426","2020-10-21","18:00:00",""
"7057021","16.664","0.004","21.339","0.005","13.994","0.004","90","","111.143","0.007","90","","4641","2","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H32 Eu2 N8 O17 -","- C36 H32 Eu2 N8 O17 -","- C144 H128 Eu8 N32 O68 -","4","1","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.1102","0.0595","","","0.1192","0.1303","","","","","","1.017","","","","has coordinates,has disorder","230426","2020-10-21","18:00:00",""
"7057022","13.3254","0.0008","13.4632","0.0008","14.0695","0.0012","63.357","0.002","84.227","0.003","80.344","0.002","2223.2","0.3","305","2","304.79","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H38 N8 O18 Pr2 -","- C38 H38 N8 O18 Pr2 -","- C76 H76 N16 O36 Pr4 -","2","1","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.0617","0.0281","","","0.0504","0.0659","","","","","","1.14","","","","has coordinates","230426","2020-10-21","18:00:00",""
"7057023","10.919","0.002","17.787","0.004","23.397","0.005","90","","102.12","0.03","90","","4442.8","1.7","223.15","","223.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 N10 Nd2 O16 -","- C40 H36 N10 Nd2 O16 -","- C160 H144 N40 Nd8 O64 -","4","1","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.0478","0.0405","","","0.1102","0.1283","","","","","","1.195","","","","has coordinates","230426","2020-10-21","18:00:00",""
"7057024","10.896","0.002","17.785","0.004","23.351","0.005","90","","102","0.03","90","","4426.2","1.7","223.15","","223.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 N10 O16 Sm2 -","- C40 H36 N10 O16 Sm2 -","- C160 H144 N40 O64 Sm8 -","4","1","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.0488","0.041","","","0.1044","0.1181","","","","","","1.174","","","","has coordinates","230426","2020-10-21","18:00:00",""
"7057025","9.1598","0.0006","13.9123","0.0008","15.9391","0.001","90","","106.185","0.002","90","","1950.7","0.2","296.15","","296.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C36 H30 Dy2 N8 O16 -","- C36 H30 Dy2 N8 O16 -","- C72 H60 Dy4 N16 O32 -","2","0.5","","Pan, Yangdan; Zhang, Haifeng; Qin, Yaru; Ge, Yu; Cui, Yanfeng; Li, Yahong; Liu, Wei; Dong, Yaping","Eight homodinuclear lanthanide complexes prepared from a quinoline based ligand: structural diversity and single-molecule magnetism behaviour","New Journal of Chemistry","2018","42","7","5153","","10.1039/C7NJ04622G","","","0.71073","MoKα","","0.0289","0.0207","","","0.0387","0.0405","","","","","","1.093","","","","has coordinates","230426","2020-10-21","18:00:00",""
"7057026","11.373","0.002","19.388","0.004","13.059","0.003","90","","95.49","0.03","90","","2866.3","1","113","2","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H24 Br2 F24 N4 O10 Pr2 -","- C52 H24 Br2 F24 N4 O10 Pr2 -","- C104 H48 Br4 F48 N8 O20 Pr4 -","2","0.5","","Chu, Xiao-Ya; Zhang, Hong-Xia; Chang, Yi-Xin; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling","A series of Ln2 complexes based on an 8-hydroxyquinoline derivative: slow magnetization relaxation and photo-luminescence properties","New Journal of Chemistry","2018","42","8","5688","","10.1039/C7NJ04942K","","","0.71073","MoKα","","0.035","0.0316","","","0.0926","0.0951","","","","","","1.078","","","","has coordinates,has disorder","230242","2020-10-21","18:00:00",""
"7057027","11.44","0.002","19.297","0.004","13.025","0.003","90","","95.46","0.03","90","","2862.3","1","113","2","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H24 Br2 Er2 F24 N4 O10 -","- C52 H24 Br2 Er2 F24 N4 O10 -","- C104 H48 Br4 Er4 F48 N8 O20 -","2","0.5","","Chu, Xiao-Ya; Zhang, Hong-Xia; Chang, Yi-Xin; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling","A series of Ln2 complexes based on an 8-hydroxyquinoline derivative: slow magnetization relaxation and photo-luminescence properties","New Journal of Chemistry","2018","42","8","5688","","10.1039/C7NJ04942K","","","0.71073","MoKα","","0.0375","0.0312","","","0.0651","0.068","","","","","","1.122","","","","has coordinates,has disorder","230242","2020-10-21","18:00:00",""
"7057028","11.413","0.002","19.349","0.004","13.064","0.003","90","","95.48","0.03","90","","2871.7","1","113","2","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H24 Br2 Dy2 F24 N4 O10 -","- C52 H24 Br2 Dy2 F24 N4 O10 -","- C104 H48 Br4 Dy4 F48 N8 O20 -","2","0.5","","Chu, Xiao-Ya; Zhang, Hong-Xia; Chang, Yi-Xin; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling","A series of Ln2 complexes based on an 8-hydroxyquinoline derivative: slow magnetization relaxation and photo-luminescence properties","New Journal of Chemistry","2018","42","8","5688","","10.1039/C7NJ04942K","","","0.71073","MoKα","","0.0374","0.0294","","","0.0618","0.0649","","","","","","1.002","","","","has coordinates,has disorder","230242","2020-10-21","18:00:00",""
"7057029","11.399","0.002","19.265","0.004","13.014","0.003","90","","95.37","0.03","90","","2845.4","1","113","2","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H24 Br2 F24 Ho2 N4 O10 -","- C52 H24 Br2 F24 Ho2 N4 O10 -","- C104 H48 Br4 F48 Ho4 N8 O20 -","2","0.5","","Chu, Xiao-Ya; Zhang, Hong-Xia; Chang, Yi-Xin; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling","A series of Ln2 complexes based on an 8-hydroxyquinoline derivative: slow magnetization relaxation and photo-luminescence properties","New Journal of Chemistry","2018","42","8","5688","","10.1039/C7NJ04942K","","","0.71073","MoKα","","0.045","0.0367","","","0.0715","0.0754","","","","","","1.145","","","","has coordinates,has disorder","230242","2020-10-21","18:00:00",""
"7057030","11.394","0.002","19.462","0.004","13.087","0.003","90","","95.52","0.03","90","","2888.6","1","113","2","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H24 Br2 F24 Gd2 N4 O10 -","- C52 H24 Br2 F24 Gd2 N4 O10 -","- C104 H48 Br4 F48 Gd4 N8 O20 -","2","0.5","","Chu, Xiao-Ya; Zhang, Hong-Xia; Chang, Yi-Xin; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling","A series of Ln2 complexes based on an 8-hydroxyquinoline derivative: slow magnetization relaxation and photo-luminescence properties","New Journal of Chemistry","2018","42","8","5688","","10.1039/C7NJ04942K","","","0.71073","MoKα","","0.0403","0.0332","","","0.0681","0.0714","","","","","","1.098","","","","has coordinates,has disorder","230242","2020-10-21","18:00:00",""
"7057031","11.402","0.002","19.406","0.004","13.059","0.003","90","","95.57","0.03","90","","2875.9","1","113","2","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H24 Br2 F24 N4 O10 Tb2 -","- C52 H24 Br2 F24 N4 O10 Tb2 -","- C104 H48 Br4 F48 N8 O20 Tb4 -","2","0.5","","Chu, Xiao-Ya; Zhang, Hong-Xia; Chang, Yi-Xin; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling","A series of Ln2 complexes based on an 8-hydroxyquinoline derivative: slow magnetization relaxation and photo-luminescence properties","New Journal of Chemistry","2018","42","8","5688","","10.1039/C7NJ04942K","","","0.71073","MoKα","","0.0485","0.0339","","","0.0646","0.0693","","","","","","0.95","","","","has coordinates,has disorder","230242","2020-10-21","18:00:00",""
"7057032","11.455","0.002","19.207","0.004","13.008","0.003","90","","95.35","0.03","90","","2849.5","1","113","2","113.15","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H24 Br2 F24 Lu2 N4 O10 -","- C52 H24 Br2 F24 Lu2 N4 O10 -","- C104 H48 Br4 F48 Lu4 N8 O20 -","2","0.5","","Chu, Xiao-Ya; Zhang, Hong-Xia; Chang, Yi-Xin; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling","A series of Ln2 complexes based on an 8-hydroxyquinoline derivative: slow magnetization relaxation and photo-luminescence properties","New Journal of Chemistry","2018","42","8","5688","","10.1039/C7NJ04942K","","","0.71073","MoKα","","0.0335","0.0287","","","0.0626","0.0648","","","","","","1.111","","","","has coordinates,has disorder","230242","2020-10-21","18:00:00",""
"7057033","8.0077","0.0003","18.8247","0.0006","20.1978","0.0007","90","","90","","90","","3044.67","0.18","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","usnic acid","usnic acid","","- C18 H16 O7 -","- C18 H16 O7 -","- C144 H128 O56 -","8","2","","Lage, Tiago C. A.; Maciel, Thamilla Maria S.; Mota, Yane C. C.; Sisto, Francesca; Sabino, José R.; Santos, Josué C. C.; Figueiredo, Isis M.; Masia, Carla; de Fátima, Ângelo; Fernandes, Sergio A.; Modolo, Luzia V.","In vitro inhibition of Helicobacter pylori and interaction studies of lichen natural products with jack bean urease","New Journal of Chemistry","2018","42","7","5356","","10.1039/C8NJ00072G","","","1.54178","CuKα","","0.0233","0.0231","","","0.0628","0.063","","","","","","1.044","","","","has coordinates","230428","2020-10-21","18:00:00",""
"7057034","27.5445","0.0019","14.3006","0.001","27.9545","0.0019","90","","110.075","0.001","90","","10342.4","1.2","296","2","296.15","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C22 H23.5 As Cl2 Cu5 N11 O31.75 W9 -","- C22 H23.5 As Cl2 Cu5 N11 O31.75 W9 -","- C176 H188 As8 Cl16 Cu40 N88 O254 W72 -","8","1","","Cong, Bo-Wen; Su, Zhan-Hua; Zhao, Zhi-Feng; Zhao, Wen-Qi; Ma, Xiu-Juan; Xu, Qiu; Du, Li-Juan","A new 3D POMOF with two channels consisting of Wells‒Dawson arsenotungstate and {Cl4Cu10(pz)11} complexes: synthesis, crystal structure, and properties","New Journal of Chemistry","2018","42","6","4596","","10.1039/C7NJ04854H","","","0.71073","MoKα","","0.0566","0.0429","","","0.1158","0.1232","","","","","","1.034","","","","has coordinates","230311","2020-10-21","18:00:00",""
"7057035","14.325","0.006","14.325","0.006","14.325","0.006","90","","90","","90","","2940","2","296","2","296","2","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","","","- C24 H32 O20 Zn4 -","- C24 H31.9998 O20 Zn4 -","- C48 H63.9996 O40 Zn8 -","2","0.166667","","Ma, Yujie; Xu, Guanhong; Wei, Fangdi; Cen, Yao; Song, Yueyue; Shi, Menglan; Xu, Xiaoman; Sohail, Muhammad; Hu, Qin","Fluorescent zinc(ii)-based metal‒organic frameworks for nitroaromatics sensing","New Journal of Chemistry","2018","42","7","5162","","10.1039/C7NJ04966H","","","0.71073","MoKα","","0.0886","0.0714","","","0.2022","0.2235","","","","","","1.057","","","","has coordinates","230429","2020-10-21","18:00:00",""
"7057036","7.6203","0.0009","10.1947","0.0013","11.2268","0.0011","79.856","0.004","77.927","0.004","83.881","0.004","837.34","0.17","100","","100","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H17 Br2 Cu2.5 N2 S2 -","- C10 H17 Br2 Cu2.5 N2 S2 -","- C20 H34 Br4 Cu5 N4 S4 -","2","1","","Himoto, K.; Suzuki, S.; Okubo, T.; Maekawa, M.; Kuroda-Sowa, T.","A new semiconducting 1D Cu(i)‒Cu(ii) mixed-valence coordination polymer with Cu(ii) dimethylpiperidine‒dithiocarbamate and a tetranuclear Cu(i)‒Br cluster unit","New Journal of Chemistry","2018","42","6","3995","","10.1039/C7NJ04763K","","","0.71075","MoKα","","0.0225","0.0191","","","0.0448","0.0454","","","","","","0.96","","","","has coordinates","230312","2020-10-21","18:00:00",""
"7057037","10.3728","0.0007","13.0176","0.0009","14.4077","0.0009","104.596","0.003","96.894","0.002","104.555","0.003","1787","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H36 Br8 K N3 O6 S -","- C21 H36 Br8 K N3 O6 S -","- C42 H72 Br16 K2 N6 O12 S2 -","2","1","","Grounds, Olivia; Zeller, Matthias; Rosokha, Sergiy V.","Structural preferences in strong anion‒π and halogen-bonded complexes: π- and σ-holes vs. frontier orbitals interaction","New Journal of Chemistry","2018","42","13","10572","","10.1039/C7NJ04843B","","","0.71073","MoKα","","0.0724","0.0381","","","0.08","0.0898","","","","","","1.026","","","","has coordinates","230373","2020-10-21","18:00:00",""
"7057038","12.4744","0.0003","12.4744","0.0003","45.03","0.0012","90","","90","","120","","6068.4","0.3","150","2","150","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C62.78 H77.55 Br2 Cl5.56 K2 N22 O12 -","- C62.7798 H77.5476 Br2 Cl5.5596 K2 N22 O12 -","- C188.339 H232.643 Br6 Cl16.6788 K6 N66 O36 -","3","0.166667","","Grounds, Olivia; Zeller, Matthias; Rosokha, Sergiy V.","Structural preferences in strong anion‒π and halogen-bonded complexes: π- and σ-holes vs. frontier orbitals interaction","New Journal of Chemistry","2018","42","13","10572","","10.1039/C7NJ04843B","","","1.54178","CuKα","","0.0307","0.0299","","","0.0817","0.0823","","","","","","1.097","","","","has coordinates,has disorder","230373","2020-10-21","18:00:00",""
"7057039","9.1839","0.0005","15.2227","0.0008","14.7732","0.0008","90","","93.029","0.002","90","","2062.46","0.19","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H28 Br3 F N2 S -","- C14 H28 Br3 F N2 S -","- C56 H112 Br12 F4 N8 S4 -","4","1","","Grounds, Olivia; Zeller, Matthias; Rosokha, Sergiy V.","Structural preferences in strong anion‒π and halogen-bonded complexes: π- and σ-holes vs. frontier orbitals interaction","New Journal of Chemistry","2018","42","13","10572","","10.1039/C7NJ04843B","","","0.71073","MoKα","","0.0585","0.0317","","","0.0708","0.0794","","","","","","1.063","","","","has coordinates","230373","2020-10-21","18:00:00",""
"7057040","12.4751","0.0005","12.4751","0.0005","15.0171","0.0006","90","","90","","120","","2023.97","0.14","150","2","150","2","","","","","","","","6","P -3","-P 3","147","","","","- C64 H80 I2 K2 N24 O13 -","- C62.6664 H79.9998 I2 K2 N23.9998 O13.0002 -","- C62.6664 H79.9998 I2 K2 N23.9998 O13.0002 -","1","0.166667","","Grounds, Olivia; Zeller, Matthias; Rosokha, Sergiy V.","Structural preferences in strong anion‒π and halogen-bonded complexes: π- and σ-holes vs. frontier orbitals interaction","New Journal of Chemistry","2018","42","13","10572","","10.1039/C7NJ04843B","","","0.71073","MoKα","","0.0462","0.0301","","","0.0603","0.0652","","","","","","1.027","","","","has coordinates,has disorder","230373","2020-10-21","18:00:00",""
"7057041","12.497","0.0008","12.497","0.0008","40.188","0.003","90","","90","","120","","5435.5","0.6","150","2","150","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C61 H74 Cl4 K2 N22 O12 -","- C61.0002 H74.0004 Cl4.0004 K2 N22 O12 -","- C183.001 H222.001 Cl12.0012 K6 N66 O36 -","3","0.166667","","Grounds, Olivia; Zeller, Matthias; Rosokha, Sergiy V.","Structural preferences in strong anion‒π and halogen-bonded complexes: π- and σ-holes vs. frontier orbitals interaction","New Journal of Chemistry","2018","42","13","10572","","10.1039/C7NJ04843B","","","0.71073","MoKα","","0.0603","0.0419","","","0.0995","0.1084","","","","","","1.036","","","","has coordinates,has disorder","230373","2020-10-21","18:00:00",""
"7057042","13.1749","0.0006","13.1749","0.0006","15.0846","0.0009","90","","90","","90","","2618.4","0.2","150","2","150","2","","","","","","","","4","I -4","I -4","82","","","","- C45 H30 Cl3 N25 -","- C45 H30 Cl3 N25 -","- C90 H60 Cl6 N50 -","2","0.25","","Grounds, Olivia; Zeller, Matthias; Rosokha, Sergiy V.","Structural preferences in strong anion‒π and halogen-bonded complexes: π- and σ-holes vs. frontier orbitals interaction","New Journal of Chemistry","2018","42","13","10572","","10.1039/C7NJ04843B","","","0.71073","MoKα","","0.0549","0.0385","","","0.0918","0.1006","","","","","","1.013","","","","has coordinates,has disorder","230373","2020-10-21","18:00:00",""
"7057043","13.3307","0.0006","13.3307","0.0006","15.2977","0.0008","90","","90","","90","","2718.5","0.2","150","2","150","2","","","","","","","","4","I -4","I -4","82","","","","- C48 H36 Br N25 -","- C48 H36 Br N25 -","- C96 H72 Br2 N50 -","2","0.25","","Grounds, Olivia; Zeller, Matthias; Rosokha, Sergiy V.","Structural preferences in strong anion‒π and halogen-bonded complexes: π- and σ-holes vs. frontier orbitals interaction","New Journal of Chemistry","2018","42","13","10572","","10.1039/C7NJ04843B","","","0.71073","MoKα","","0.0604","0.0331","","","0.0538","0.0587","","","","","","0.93","","","","has coordinates,has disorder","230373","2020-10-21","18:00:00",""
"7057044","7.3558","0.0005","9.8281","0.0007","13.8221","0.0012","72.201","0.005","78.852","0.006","74.947","0.005","911.69","0.12","93","2","93","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H20 B10 -","- C16 H20 B10 -","- C32 H40 B20 -","2","1","","Nishino, Kenta; Uemura, Kyoya; Tanaka, Kazuo; Chujo, Yoshiki","Dual emission via remote control of molecular rotation of o-carborane in the excited state by the distant substituents in tolane-modified dyads","New Journal of Chemistry","2018","42","6","4210","","10.1039/C7NJ04283C","","","0.71075","MoKα","","0.0813","0.0674","","","0.1945","0.2427","","","","","","1.221","","","","has coordinates","230314","2020-10-21","18:00:00",""
"7057045","7.0713","0.0012","10.2615","0.0016","14.668","0.003","109.044","0.008","93.259","0.007","104.545","0.007","962.6","0.3","103","2","103","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H22 B10 O -","- C17 H22 B10 O -","- C34 H44 B20 O2 -","2","1","","Nishino, Kenta; Uemura, Kyoya; Tanaka, Kazuo; Chujo, Yoshiki","Dual emission via remote control of molecular rotation of o-carborane in the excited state by the distant substituents in tolane-modified dyads","New Journal of Chemistry","2018","42","6","4210","","10.1039/C7NJ04283C","","","0.71075","MoKα","","0.1923","0.0939","","","0.1952","0.2415","","","","","","1.027","","","","has coordinates","230314","2020-10-21","18:00:00",""
"7057046","8.6883","0.001","11.8246","0.0016","15.412","0.003","90","","90","","90","","1583.4","0.4","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C9 H8 N2 O -","- C9 H8 N2 O -","- C72 H64 N16 O8 -","8","2","","Tarai, Arup; Baruah, Jubaraj B.","Different self-assemblies and absorption‒emission properties of the picrate salts of aromatic amine or heterocycle linked oximes","New Journal of Chemistry","2018","42","6","4757","","10.1039/C7NJ04349J","","","0.71073","MoKα","","0.0455","0.036","","","0.0845","0.0899","","","","","","1.057","","","","has coordinates","230319","2020-10-21","18:00:00",""
"7057047","6.7711","0.0006","8.4733","0.0011","15.8026","0.0017","78.747","0.01","87.742","0.008","75.439","0.01","860.62","0.17","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H11 N5 O9 -","- C15 H11 N5 O9 -","- C30 H22 N10 O18 -","2","1","","Tarai, Arup; Baruah, Jubaraj B.","Different self-assemblies and absorption‒emission properties of the picrate salts of aromatic amine or heterocycle linked oximes","New Journal of Chemistry","2018","42","6","4757","","10.1039/C7NJ04349J","","","0.71073","MoKα","","0.1153","0.0778","","","0.1504","0.1744","","","","","","1.04","","","","has coordinates","230319","2020-10-21","18:00:00",""
"7057048","3.8305","0.0004","13.112","0.002","14.5122","0.0018","80.38","0.012","82.576","0.01","86.434","0.012","711.99","0.16","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H9 N5 O8 -","- C12 H9 N5 O8 -","- C24 H18 N10 O16 -","2","1","","Tarai, Arup; Baruah, Jubaraj B.","Different self-assemblies and absorption‒emission properties of the picrate salts of aromatic amine or heterocycle linked oximes","New Journal of Chemistry","2018","42","6","4757","","10.1039/C7NJ04349J","","","0.71073","MoKα","","0.1148","0.0882","","","0.154","0.1678","","","","","","1.066","","","","has coordinates","230319","2020-10-21","18:00:00",""
"7057049","17.0234","0.0015","4.9886","0.0005","22.731","0.002","90","","109.651","0.005","90","","1818","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H13 N5 O9 -","- C16 H13 N5 O9 -","- C64 H52 N20 O36 -","4","1","","Tarai, Arup; Baruah, Jubaraj B.","Different self-assemblies and absorption‒emission properties of the picrate salts of aromatic amine or heterocycle linked oximes","New Journal of Chemistry","2018","42","6","4757","","10.1039/C7NJ04349J","","","0.71073","MoKα","","0.1107","0.0534","","","0.1259","0.1572","","","","","","1.006","","","","has coordinates","230319","2020-10-21","18:00:00",""
"7057050","7.2191","0.0007","10.8361","0.0008","11.388","0.0009","96.925","0.005","100.591","0.005","94.292","0.005","864.98","0.13","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H15 N5 O8 -","- C15 H15 N5 O8 -","- C30 H30 N10 O16 -","2","1","","Tarai, Arup; Baruah, Jubaraj B.","Different self-assemblies and absorption‒emission properties of the picrate salts of aromatic amine or heterocycle linked oximes","New Journal of Chemistry","2018","42","6","4757","","10.1039/C7NJ04349J","","","0.71073","MoKα","","0.056","0.0452","","","0.1094","0.1165","","","","","","1.031","","","","has coordinates","230319","2020-10-21","18:00:00",""
"7057051","16.4079","0.0003","7.1838","0.0001","14.0179","0.0003","90","","111.458","0.002","90","","1537.78","0.05","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N6 O7 Pb -","- C12 H10 N6 O7 Pb -","- C48 H40 N24 O28 Pb4 -","4","1","","Mahmoudi, Ghodrat; Zangrando, Ennio; Mitoraj, Mariusz P.; Gurbanov, Atash V.; Zubkov, Fedor I.; Moosavifar, Maryam; Konyaeva, Irina A.; Kirillov, Alexander M.; Safin, Damir A.","Extended lead(ii) architectures engineered via tetrel bonding interactions","New Journal of Chemistry","2018","42","7","4959","","10.1039/C8NJ00525G","","","0.71073","MoKα","","0.0234","0.0182","","","0.0402","0.0407","","","","","","0.959","","","","has coordinates","230416","2020-10-21","18:00:00",""
"7057052","7.2696","0.0006","9.6656","0.0009","10.0853","0.0009","93.216","0.001","100.911","0.001","105.07","0.001","667.75","0.1","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H12 N4 O2 Pb -","- C13 H12 N4 O2 Pb -","- C26 H24 N8 O4 Pb2 -","2","1","","Mahmoudi, Ghodrat; Zangrando, Ennio; Mitoraj, Mariusz P.; Gurbanov, Atash V.; Zubkov, Fedor I.; Moosavifar, Maryam; Konyaeva, Irina A.; Kirillov, Alexander M.; Safin, Damir A.","Extended lead(ii) architectures engineered via tetrel bonding interactions","New Journal of Chemistry","2018","42","7","4959","","10.1039/C8NJ00525G","","","0.71073","MoKα","","0.0364","0.034","","","0.0893","0.0912","","","","","","1.036","","","","has coordinates","230416","2020-10-21","18:00:00",""
"7057053","10.281","0.005","17.05","0.008","15.015","0.007","90","","106.77","0.03","90","","2520","2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H24 N6 O7 Pb2 -","- C21 H24 N6 O7 Pb2 -","- C84 H96 N24 O28 Pb8 -","4","1","","Mahmoudi, Ghodrat; Zangrando, Ennio; Mitoraj, Mariusz P.; Gurbanov, Atash V.; Zubkov, Fedor I.; Moosavifar, Maryam; Konyaeva, Irina A.; Kirillov, Alexander M.; Safin, Damir A.","Extended lead(ii) architectures engineered via tetrel bonding interactions","New Journal of Chemistry","2018","42","7","4959","","10.1039/C8NJ00525G","","","0.71073","MoKα","","0.0403","0.0267","","","0.0625","0.0684","","","","","","1.055","","","","has coordinates","230416","2020-10-21","18:00:00",""
"7057054","25.62","0.003","8.762","0.002","11.862","0.004","90","","111.828","0.017","90","","2471.9","1.1","294","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H16 N10 O13 Pb2 -","- C15 H16 N10 O13 Pb2 -","- C60 H64 N40 O52 Pb8 -","4","0.5","","Mahmoudi, Ghodrat; Zangrando, Ennio; Mitoraj, Mariusz P.; Gurbanov, Atash V.; Zubkov, Fedor I.; Moosavifar, Maryam; Konyaeva, Irina A.; Kirillov, Alexander M.; Safin, Damir A.","Extended lead(ii) architectures engineered via tetrel bonding interactions","New Journal of Chemistry","2018","42","7","4959","","10.1039/C8NJ00525G","","","0.71073","MoKα","","0.0713","0.0547","","","0.135","0.1451","","","","","","1.062","","","","has coordinates","230416","2020-10-21","18:00:00",""
"7057055","10.8222","0.001","13.3189","0.0012","16.9614","0.0016","90","","97.867","0.002","90","","2421.8","0.4","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 Cl F6 N5 P Pd -","- C19 H19 Cl F6 N5 P Pd -","- C76 H76 Cl4 F24 N20 P4 Pd4 -","4","1","","Chen, Chao; Zheng, Qing; Ni, Shengliang; Wang, Hangxiang","Facile one-pot nanocatalysts encapsulation of palladium‒NHC complexes for aqueous Suzuki‒Miyaura couplings","New Journal of Chemistry","2018","42","6","4624","","10.1039/C7NJ04836J","","","0.71073","MoKα","","0.0613","0.0454","","","0.1251","0.1386","","","","","","1.084","","","","has coordinates","230313","2020-10-21","18:00:00",""
"7057056","9.5629","0.0005","26.8142","0.0009","10.2793","0.0004","90","","116.742","0.006","90","","2353.9","0.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H18 Cl F6 N4 P Pd -","- C21 H18 Cl F6 N4 P Pd -","- C84 H72 Cl4 F24 N16 P4 Pd4 -","4","1","","Chen, Chao; Zheng, Qing; Ni, Shengliang; Wang, Hangxiang","Facile one-pot nanocatalysts encapsulation of palladium‒NHC complexes for aqueous Suzuki‒Miyaura couplings","New Journal of Chemistry","2018","42","6","4624","","10.1039/C7NJ04836J","","","0.71073","MoKα","","0.0533","0.0435","","","0.1034","0.1105","","","","","","1.045","","","","has coordinates","230313","2020-10-21","18:00:00",""
"7057057","8.2397","0.0011","13.5183","0.0013","21.343","0.002","90","","100.006","0.002","90","","2341.2","0.4","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 Cl F6 N5 P Pd -","- C18 H19 Cl F6 N5 P Pd -","- C72 H76 Cl4 F24 N20 P4 Pd4 -","4","1","","Chen, Chao; Zheng, Qing; Ni, Shengliang; Wang, Hangxiang","Facile one-pot nanocatalysts encapsulation of palladium‒NHC complexes for aqueous Suzuki‒Miyaura couplings","New Journal of Chemistry","2018","42","6","4624","","10.1039/C7NJ04836J","","","0.71073","MoKα","","0.0755","0.0445","","","0.0981","0.1147","","","","","","1.057","","","","has coordinates,has disorder","230313","2020-10-21","18:00:00",""
"7057058","12.6526","0.0007","14.8338","0.0008","13.9646","0.0008","90","","104.762","0.006","90","","2534.5","0.3","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H27 N3 Ni O6 Pb S -","- C24 H27 N3 Ni O6 Pb S -","- C96 H108 N12 Ni4 O24 Pb4 S4 -","4","1","","Roy, Sourav; Drew, Michael G. B.; Bauzá, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik","Non-covalent tetrel bonding interactions in hemidirectional lead(ii) complexes with nickel(ii)-salen type metalloligands","New Journal of Chemistry","2018","42","8","6062","","10.1039/C7NJ05148D","","","0.71073","MoKα","","0.0859","0.0648","","","0.1379","0.1494","","","","","","1.032","","","","has coordinates","230239","2020-10-21","18:00:00",""
"7057059","10.5264","0.0006","11.3184","0.0006","12.5352","0.0008","86.021","0.005","71.617","0.005","85.853","0.004","1411.83","0.15","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H31 N3 Ni O8 Pb S2 -","- C24 H31 N3 Ni O8 Pb S2 -","- C48 H62 N6 Ni2 O16 Pb2 S4 -","2","1","","Roy, Sourav; Drew, Michael G. B.; Bauzá, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik","Non-covalent tetrel bonding interactions in hemidirectional lead(ii) complexes with nickel(ii)-salen type metalloligands","New Journal of Chemistry","2018","42","8","6062","","10.1039/C7NJ05148D","","","0.71073","MoKα","","0.052","0.0452","","","0.0948","0.0986","","","","","","1.051","","","","has coordinates","230239","2020-10-21","18:00:00",""
"7057060","9.8038","0.0008","11.9201","0.0011","12.8868","0.0008","95.767","0.006","104.841","0.006","111.721","0.008","1320","0.2","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C24 H30 Cl N3 Ni O5 Pb S -","- C24 H30 Cl N3 Ni O5 Pb S -","- C48 H60 Cl2 N6 Ni2 O10 Pb2 S2 -","2","1","","Roy, Sourav; Drew, Michael G. B.; Bauzá, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik","Non-covalent tetrel bonding interactions in hemidirectional lead(ii) complexes with nickel(ii)-salen type metalloligands","New Journal of Chemistry","2018","42","8","6062","","10.1039/C7NJ05148D","","","0.71073","MoKα","","0.0893","0.0761","","","0.2061","0.2275","","","","","","0.921","","","","has coordinates","230239","2020-10-21","18:00:00",""
"7057061","14.76","0.003","12.3947","0.0015","14.3","0.003","90","","110.72","0.02","90","","2446.9","0.8","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C21 H28 Cl2 N2 Ni O6 Pb -","- C21 H28 Cl2 N2 Ni O6 Pb -","- C84 H112 Cl8 N8 Ni4 O24 Pb4 -","4","0.5","","Roy, Sourav; Drew, Michael G. B.; Bauzá, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik","Non-covalent tetrel bonding interactions in hemidirectional lead(ii) complexes with nickel(ii)-salen type metalloligands","New Journal of Chemistry","2018","42","8","6062","","10.1039/C7NJ05148D","","","0.71073","MoKα","","0.1076","0.0758","","","0.157","0.1766","","","","","","1.061","","","","has coordinates,has disorder","230239","2020-10-21","18:00:00",""
"7057062","14.752","0.0005","8.8836","0.0004","16.476","0.0005","90","","90","","90","","2159.19","0.14","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C16 H18 Li2 Mg N6 O10 -","- C16 H18 Li2 Mg N6 O10 -","- C64 H72 Li8 Mg4 N24 O40 -","4","0.5","","Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying","Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions","New Journal of Chemistry","2018","42","7","5096","","10.1039/C7NJ04823H","","","0.71073","MoKα","","0.0568","0.0399","","","0.0914","0.1007","","","","","","1.008","","","","has coordinates","230418","2020-10-21","18:00:00",""
"7057063","14.7495","0.0019","8.881","0.001","16.4433","0.0017","90","","90","","90","","2153.9","0.4","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C8 H9 Co0.14 Li Mg0.36 N3 O5 -","- C8 H9 Co0.1425 Li Mg0.3575 N3 O5 -","- C64 H72 Co1.14 Li8 Mg2.86 N24 O40 -","8","1","","Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying","Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions","New Journal of Chemistry","2018","42","7","5096","","10.1039/C7NJ04823H","","","0.71073","MoKα","","0.1008","0.0555","","","0.1153","0.1386","","","","","","1.01","","","","has coordinates","230418","2020-10-21","18:00:00",""
"7057064","14.7194","0.0007","8.8624","0.0004","16.4634","0.0008","90","","90","","90","","2147.64","0.18","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C8 H9 Co0.29 Li Mg0.21 N3 O5 -","- C8 H9 Co0.2875 Li Mg0.2125 N3 O5 -","- C64 H72 Co2.3 Li8 Mg1.7 N24 O40 -","8","1","","Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying","Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions","New Journal of Chemistry","2018","42","7","5096","","10.1039/C7NJ04823H","","","0.71073","MoKα","","0.0899","0.0472","","","0.0782","0.0926","","","","","","1.009","","","","has coordinates","230418","2020-10-21","18:00:00",""
"7057065","14.7458","0.0004","8.8756","0.0003","16.4841","0.0006","90","","90","","90","","2157.4","0.12","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C16 H18 Co Li2 N6 O10 -","- C16 H18 Co Li2 N6 O10 -","- C64 H72 Co4 Li8 N24 O40 -","4","0.5","","Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying","Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions","New Journal of Chemistry","2018","42","7","5096","","10.1039/C7NJ04823H","","","0.71073","MoKα","","0.0435","0.0321","","","0.0808","0.0893","","","","","","1.007","","","","has coordinates","230418","2020-10-21","18:00:00",""
"7057066","24.386","0.003","24.386","0.003","24.386","0.003","44.76","0.02","44.76","0.02","44.76","0.02","6541","3","293","2","293","2","","","","","","","","6","R -3 c :R","-P 3* 2n","167","","","","- C61 H70 Ag3 Cl3 N14 O13 -","- C61.02 H66 Ag3 Cl3 N14 O13 -","- C244.08 H264 Ag12 Cl12 N56 O52 -","4","0.333333","","Nechipadappu, Sunil Kumar; Ramachandran, Jeeshma; Shivalingegowda, Naveen; Lokanath, Neratur Krishnappagowda; Trivedi, Darshak R.","Synthesis of cocrystals/salts of flucytosine: Structure and stability","New Journal of Chemistry","2018","42","7","5433","","10.1039/C7NJ04400C","","","0.71073","MoKα","","0.1002","0.0773","","0.2383","0.2122","","","","1.207","1.218","1.218","","","","","has coordinates,has disorder","230417","2020-10-21","18:00:00",""
"7057067","9.1192","0.0005","10.0601","0.0005","10.0983","0.0005","105.212","0.002","112.72","0.002","95.794","0.002","803.01","0.07","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","Flucytosine/2,3-dihydroxybenzoic acid","","- C15 H14 F2 N6 O6 -","- C15 H14 F2 N6 O6 -","- C30 H28 F4 N12 O12 -","2","1","","Nechipadappu, Sunil Kumar; Ramachandran, Jeeshma; Shivalingegowda, Naveen; Lokanath, Neratur Krishnappagowda; Trivedi, Darshak R.","Synthesis of cocrystals/salts of flucytosine: Structure and stability","New Journal of Chemistry","2018","42","7","5433","","10.1039/C7NJ04400C","","","1.54178","CuKα","","0.0692","0.0652","","","0.1901","0.201","","","","","","1.013","","","","has coordinates","230417","2020-10-21","18:00:00",""
"7057068","10.8713","0.0013","8.4914","0.001","14.4885","0.0018","90","","107.613","0.003","90","","1274.8","0.3","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","flucytosine/2,6-digydroxybenzoic acid","","- C11 H12 F N3 O6 -","- C11 H12 F N3 O6 -","- C44 H48 F4 N12 O24 -","4","1","","Nechipadappu, Sunil Kumar; Ramachandran, Jeeshma; Shivalingegowda, Naveen; Lokanath, Neratur Krishnappagowda; Trivedi, Darshak R.","Synthesis of cocrystals/salts of flucytosine: Structure and stability","New Journal of Chemistry","2018","42","7","5433","","10.1039/C7NJ04400C","","","1.54178","CuKα","","0.0592","0.0563","","","0.1707","0.1775","","","","","","1.281","","","","has coordinates","230417","2020-10-21","18:00:00",""
"7057069","5.283","0.002","17.757","0.007","12.125","0.005","90","","95.183","0.012","90","","1132.8","0.8","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Flucytosine/Gallic acid","","- C11 H10 F N3 O6 -","- C11 H10 F N3 O6 -","- C44 H40 F4 N12 O24 -","4","1","","Nechipadappu, Sunil Kumar; Ramachandran, Jeeshma; Shivalingegowda, Naveen; Lokanath, Neratur Krishnappagowda; Trivedi, Darshak R.","Synthesis of cocrystals/salts of flucytosine: Structure and stability","New Journal of Chemistry","2018","42","7","5433","","10.1039/C7NJ04400C","","","1.54178","CuKα","","0.0943","0.0564","","","0.1566","0.162","","","","","","1.181","","","","has coordinates","230417","2020-10-21","18:00:00",""
"7057070","7.298","0.003","13.507","0.004","15.536","0.005","109.39","0.008","92.328","0.007","103.472","0.007","1393.2","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Flucytosine/3,5-dihydroxybenzoic acid","","- C22 H20 F2 N6 O15 -","- C22 H20 F2 N6 O15 -","- C44 H40 F4 N12 O30 -","2","1","","Nechipadappu, Sunil Kumar; Ramachandran, Jeeshma; Shivalingegowda, Naveen; Lokanath, Neratur Krishnappagowda; Trivedi, Darshak R.","Synthesis of cocrystals/salts of flucytosine: Structure and stability","New Journal of Chemistry","2018","42","7","5433","","10.1039/C7NJ04400C","","","0.71073","MoKα","","0.1072","0.0919","","","0.3289","0.3544","","","","","","0.943","","","","has coordinates","230417","2020-10-21","18:00:00",""
"7057071","12.521","0.003","9.249","0.002","18.569","0.004","90","","90","","90","","2150.4","0.8","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C16 H28 Br Co N2 O3 P2 -","- C16 H28 Br Co N2 O3 P2 -","- C64 H112 Br4 Co4 N8 O12 P8 -","4","1","","Cruz, Tiago F. C.; Machado, Pedro M. M.; Gomes, Clara S. B.; Ascenso, José R.; Lemos, M. Amélia N. D. A.; Bordado, João C.; Gomes, Pedro T.","Bis(formylpyrrolyl) cobalt complexes as mediators in the reversible-deactivation radical polymerization of styrene and methyl methacrylate","New Journal of Chemistry","2018","42","8","5900","","10.1039/C8NJ00350E","","x-ray","0.71073","MoKα","","0.0645","0.0382","","","0.0584","0.0625","","","","","","1.013","","","","has coordinates","230245","2020-10-21","18:00:00",""
"7057072","11.2435","0.0005","11.6245","0.0005","16.9612","0.0008","92.816","0.002","90.895","0.001","112.274","0.002","2047.53","0.16","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C41 H48 B Cl2 Co N2 O2 P2 -","- C41 H48 B Cl2 Co N2 O2 P2 -","- C82 H96 B2 Cl4 Co2 N4 O4 P4 -","2","1","","Cruz, Tiago F. C.; Machado, Pedro M. M.; Gomes, Clara S. B.; Ascenso, José R.; Lemos, M. Amélia N. D. A.; Bordado, João C.; Gomes, Pedro T.","Bis(formylpyrrolyl) cobalt complexes as mediators in the reversible-deactivation radical polymerization of styrene and methyl methacrylate","New Journal of Chemistry","2018","42","8","5900","","10.1039/C8NJ00350E","","x-ray","0.71073","MoKα","","0.1005","0.0624","","","0.1403","0.1572","","","","","","0.954","","","","has coordinates","230245","2020-10-21","18:00:00",""
"7057073","20.429","0.008","12.23","0.005","10.184","0.004","90","","117.496","0.012","90","","2257","1.6","150","2","150","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C16 H26 B Co F4 N2 O2 P2 -","- C16 H26 B Co F4 N2 O2 P2 -","- C64 H104 B4 Co4 F16 N8 O8 P8 -","4","0.5","","Cruz, Tiago F. C.; Machado, Pedro M. M.; Gomes, Clara S. B.; Ascenso, José R.; Lemos, M. Amélia N. D. A.; Bordado, João C.; Gomes, Pedro T.","Bis(formylpyrrolyl) cobalt complexes as mediators in the reversible-deactivation radical polymerization of styrene and methyl methacrylate","New Journal of Chemistry","2018","42","8","5900","","10.1039/C8NJ00350E","","x-ray","0.71073","MoKα","","0.0603","0.0543","","","0.1537","0.1617","","","","","","1.117","","","","has coordinates","230245","2020-10-21","18:00:00",""
"7057074","10.3943","0.0005","19.4103","0.0009","12.1847","0.0006","90","","95.169","0.004","90","","2448.3","0.2","100","0.1","100","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C34 H32 O -","- C34 H32 O -","- C136 H128 O4 -","4","1","","Górski, Krzysztof; Mech-Piskorz, Justyna; Noworyta, Krzysztof; Leśniewska, Barbara; Pietraszkiewicz, Marek","Efficient synthesis of 5-oxatruxene and the unusual influence of oxygen heteroatom on its physico-chemical properties","New Journal of Chemistry","2018","42","8","5844","","10.1039/C7NJ04729K","","","1.54184","CuKα","","0.0361","0.0351","","","0.0884","0.0892","","","","","","1.007","","","","has coordinates","230249","2020-10-21","18:00:00",""
"7057075","14.1319","0.0004","12.1283","0.0004","52.278","0.003","90","","90","","90","","8960.2","0.6","100","0.2","100","0.2","","","","","","","","2","P n a 21","P 2c -2n","33","","","","- C39 H42 -","- C39 H42 -","- C468 H504 -","12","3","","Górski, Krzysztof; Mech-Piskorz, Justyna; Noworyta, Krzysztof; Leśniewska, Barbara; Pietraszkiewicz, Marek","Efficient synthesis of 5-oxatruxene and the unusual influence of oxygen heteroatom on its physico-chemical properties","New Journal of Chemistry","2018","42","8","5844","","10.1039/C7NJ04729K","","","1.54184","CuKα","","0.0717","0.0622","","","0.1737","0.1848","","","","","","1.012","","","","has coordinates,has disorder","230249","2020-10-21","18:00:00",""
"7057076","19.6187","0.0009","12.5476","0.0006","25.9749","0.0012","90","","93.411","0.002","90","","6382.9","0.5","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C63 H56 Cl8 N8 P2 Rh2 -","- C63 H56 Cl8 N8 P2 Rh2 -","- C252 H224 Cl32 N32 P8 Rh8 -","4","1","","Roy, Sima; Pramanik, Shuvam; Ghorui, Tapas; Dinda, Soumitra; Patra, Sarat Chandra; Pramanik, Kausikisankar","Redox-active diaminoazobenzene complexes of rhodium(iii): synthesis, structure and spectroscopic characterization","New Journal of Chemistry","2018","42","7","5548","","10.1039/C7NJ04790H","","","0.71073","MoKα","","0.0857","0.0565","","","0.1521","0.1749","","","","","","1.077","","","","has coordinates","230425","2020-10-21","18:00:00",""
"7057077","10.8829","0.0009","12.4756","0.001","14.0207","0.0012","70.126","0.005","89.504","0.005","78.191","0.005","1748.5","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H30 Cl6 N4 P Rh -","- C32 H30 Cl6 N4 P Rh -","- C64 H60 Cl12 N8 P2 Rh2 -","2","1","","Roy, Sima; Pramanik, Shuvam; Ghorui, Tapas; Dinda, Soumitra; Patra, Sarat Chandra; Pramanik, Kausikisankar","Redox-active diaminoazobenzene complexes of rhodium(iii): synthesis, structure and spectroscopic characterization","New Journal of Chemistry","2018","42","7","5548","","10.1039/C7NJ04790H","","","0.71073","MoKα","","0.0819","0.048","","","0.1221","0.1376","","","","","","1.016","","","","has coordinates","230425","2020-10-21","18:00:00",""
"7057078","11.1039","0.0003","11.3734","0.0003","12.972","0.0004","67.466","0.002","72.869","0.002","84.364","0.002","1445.82","0.08","90","0.5","90","0.5","","","","","","","","6","P -1","-P 1","2","","","","- C33 H36 B F2 N5 O -","- C33 H36 B F2 N5 O -","- C66 H72 B2 F4 N10 O2 -","2","1","","Nguyen, Alex L.; Griffin, Kaitlin E.; Zhou, Zehua; Fronczek, Frank R.; Smith, Kevin M.; Vicente, M. Graça H.","Syntheses of 1,2,3-triazole-BODIPYs bearing up to three carbohydrate units","New Journal of Chemistry","2018","42","10","8241","","10.1039/C8NJ00041G","","","0.71073","MoKα","","0.0966","0.0525","","","0.1125","0.129","","","","","","1.007","","","","has coordinates","230186","2020-10-21","18:00:00",""
"7057079","13.3965","0.0015","9.2534","0.001","17.1816","0.0019","90","","104.822","0.008","90","","2059","0.4","90","0.5","90","0.5","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C40 H48 B F2 N5 O10 -","- C40 H48 B F2 N5 O10 -","- C80 H96 B2 F4 N10 O20 -","2","1","","Nguyen, Alex L.; Griffin, Kaitlin E.; Zhou, Zehua; Fronczek, Frank R.; Smith, Kevin M.; Vicente, M. Graça H.","Syntheses of 1,2,3-triazole-BODIPYs bearing up to three carbohydrate units","New Journal of Chemistry","2018","42","10","8241","","10.1039/C8NJ00041G","","","1.54184","CuKα","","0.1409","0.0623","","","0.1054","0.1307","","","","","","0.959","","","","has coordinates","230186","2020-10-21","18:00:00",""
"7057080","7.695","0.003","7.92","0.003","10.362","0.003","96.36","0.03","99.93","0.03","91.11","0.03","617.7","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 N2 O8 P2 -","- C8 H16 N2 O8 P2 -","- C16 H32 N4 O16 P4 -","2","1","","Rojek, Tomasz; Goldeman, Waldemar; Ślepokura, Katarzyna; Duczmal, Marek; Wojciechowska, Agnieszka; Matczak-Jon, Ewa","1D Co(ii) coordination polymers based on cyclobutyl- and cyclopentyl-substituted zoledronate analogues: synthesis, structural comparison, thermal stability and magnetic properties","New Journal of Chemistry","2018","42","10","7830","","10.1039/C8NJ00118A","","","0.71073","MoKα","","0.0435","0.0404","","","0.1186","0.1209","","","","","","1.081","","","","has coordinates","230184","2020-10-21","18:00:00",""
"7057081","10.288","0.003","9.956","0.003","10.17","0.003","80.59","0.03","72.36","0.03","61.94","0.03","875.7","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H46 Co3 N4 O26 P4 -","- C16 H46 Co3 N4 O26 P4 -","- C16 H46 Co3 N4 O26 P4 -","1","0.5","","Rojek, Tomasz; Goldeman, Waldemar; Ślepokura, Katarzyna; Duczmal, Marek; Wojciechowska, Agnieszka; Matczak-Jon, Ewa","1D Co(ii) coordination polymers based on cyclobutyl- and cyclopentyl-substituted zoledronate analogues: synthesis, structural comparison, thermal stability and magnetic properties","New Journal of Chemistry","2018","42","10","7830","","10.1039/C8NJ00118A","","","0.71073","MoKα","","0.0586","0.0489","","","0.1319","0.1367","","","","","","1.001","","","","has coordinates,has disorder","230184","2020-10-21","18:00:00",""
"7057082","7.9658","0.0017","9.4269","0.0019","9.9867","0.0019","92.69","0.05","95.66","0.05","101.35","0.05","730","0.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H38 Co3 N4 O20 P4 -","- C18 H38 Co3 N4 O20 P4 -","- C18 H38 Co3 N4 O20 P4 -","1","0.5","","Rojek, Tomasz; Goldeman, Waldemar; Ślepokura, Katarzyna; Duczmal, Marek; Wojciechowska, Agnieszka; Matczak-Jon, Ewa","1D Co(ii) coordination polymers based on cyclobutyl- and cyclopentyl-substituted zoledronate analogues: synthesis, structural comparison, thermal stability and magnetic properties","New Journal of Chemistry","2018","42","10","7830","","10.1039/C8NJ00118A","","","0.71073","MoKα","","0.0533","0.0381","","","0.0842","0.0903","","","","","","1.037","","","","has coordinates","230184","2020-10-21","18:00:00",""
"7057083","6.895","0.002","16.818","0.006","14.457","0.006","90","","91.27","0.03","90","","1676","1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H24 N2 O11 P2 -","- C9 H24 N2 O11 P2 -","- C36 H96 N8 O44 P8 -","4","1","","Rojek, Tomasz; Goldeman, Waldemar; Ślepokura, Katarzyna; Duczmal, Marek; Wojciechowska, Agnieszka; Matczak-Jon, Ewa","1D Co(ii) coordination polymers based on cyclobutyl- and cyclopentyl-substituted zoledronate analogues: synthesis, structural comparison, thermal stability and magnetic properties","New Journal of Chemistry","2018","42","10","7830","","10.1039/C8NJ00118A","","","1.5418","CuKα","","0.0653","0.0605","","","0.1628","0.1678","","","","","","1.052","","","","has coordinates","230184","2020-10-21","18:00:00",""
"7057084","10.9482","0.0007","11.7177","0.0007","11.9192","0.0007","90","","97.126","0.002","90","","1517.28","0.16","296","2","296","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C14 H25 Ag4 Cd2 N10 O7 -","- C14 H25 Ag4 Cd2 N10 O7 -","- C28 H50 Ag8 Cd4 N20 O14 -","2","0.5","","Karadağ, Ahmet; Korkmaz, Nesrin; Aydın, Ali; Tekin, Şaban; Yanar, Yusuf; Yerli, Yusuf; Korkmaz, Şengül Aslan","In vitro biological properties and predicted DNA‒BSA interaction of three new dicyanidoargentate(i)-based complexes: synthesis and characterization","New Journal of Chemistry","2018","42","6","4679","","10.1039/C7NJ04796G","","","0.71073","MoKα","","0.0452","0.0445","","","0.136","0.1364","","","","","","1.069","","","","has coordinates","230310","2020-10-21","18:00:00",""
"7057085","15.8751","0.0006","15.8751","0.0006","31.9698","0.0014","90","","90","","120","","6977.6","0.5","130","2","130","2","","","","","","","","7","R 3 :H","R 3","146","","","","- C36 H84 Co2 N12 O52 P W12 -","- C36 H84 Co2 N12 O52 P W12 -","- C108 H252 Co6 N36 O156 P3 W36 -","3","0.333333","","Shmakova, Alexandra A.; Akhmetova, Maria M.; Volchek, Victoria V.; Romanova, Tamara E.; Korolkov, Ilya; Sheven, Dmitri G.; Adonin, Sergey A.; Abramov, Pavel A.; Sokolov, Maxim N.","A HPLC-ICP-AES technique for the screening of [XW11NbO40]n− aqueous solutions","New Journal of Chemistry","2018","42","10","7940","","10.1039/C7NJ04702A","","x-ray","0.71073","MoKα","","0.0555","0.0502","","","0.1196","0.1247","","","","","","1.015","","","","has coordinates,has disorder","230187","2020-10-21","18:00:00",""
"7057086","12.6148","0.0008","14.6506","0.0007","19.8436","0.0012","90","","105.19","0.006","90","","3539.3","0.4","130","2","130","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H33 N11 Ni2 O41 P W12 -","- C27 H33 N11 Ni2 O41 P W12 -","- C54 H66 N22 Ni4 O82 P2 W24 -","2","0.5","","Shmakova, Alexandra A.; Akhmetova, Maria M.; Volchek, Victoria V.; Romanova, Tamara E.; Korolkov, Ilya; Sheven, Dmitri G.; Adonin, Sergey A.; Abramov, Pavel A.; Sokolov, Maxim N.","A HPLC-ICP-AES technique for the screening of [XW11NbO40]n− aqueous solutions","New Journal of Chemistry","2018","42","10","7940","","10.1039/C7NJ04702A","","x-ray","0.71073","MoKα","","0.1289","0.0735","","","0.1623","0.1819","","","","","","1.062","","","","has coordinates,has disorder","230187","2020-10-21","18:00:00",""
"7057087","19.0694","0.0006","19.0694","0.0006","17.1332","0.0006","90","","90","","120","","5395.6","0.3","293","2","293","2","","","","","","","","5","P -3","-P 3","147","","","","- C32 H50 Mo N2 O4 -","- C32 H50 Mo N2 O4 -","- C192 H300 Mo6 N12 O24 -","6","1","","Maurya, Mannar R.; Mengesha, Bekele; Uprety, Bhawna; Jangra, Nancy; Tomar, Reshu; Avecilla, Fernando","Oxygen atom transfer between DMSO and benzoin catalyzed by cis-dioxidomolybdenum(vi) complexes of tetradentate Mannich bases","New Journal of Chemistry","2018","42","8","6225","","10.1039/C7NJ03551A","","","0.71073","MoKα","","0.0891","0.0521","","","0.1537","0.1827","","","","","","1.031","","","","has coordinates,has disorder","288501","2023-12-22","13:20:51",""
"7057088","15.164","0.002","12.8563","0.0018","10.6927","0.0014","90","","90.963","0.007","90","","2084.3","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 Mo N2 O4 -","- C24 H22 Mo N2 O4 -","- C96 H88 Mo4 N8 O16 -","4","1","","Maurya, Mannar R.; Mengesha, Bekele; Uprety, Bhawna; Jangra, Nancy; Tomar, Reshu; Avecilla, Fernando","Oxygen atom transfer between DMSO and benzoin catalyzed by cis-dioxidomolybdenum(vi) complexes of tetradentate Mannich bases","New Journal of Chemistry","2018","42","8","6225","","10.1039/C7NJ03551A","","","0.71073","MoKα","","0.0615","0.0352","","","0.0926","0.1228","","","","","","1.093","","","","has coordinates","288501","2023-12-22","13:20:51",""
"7057089","12.1153","0.0011","10.9427","0.001","15.716","0.0014","90","","112.296","0.004","90","","1927.8","0.3","99","2","99","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Mo N2 O4 -","- C20 H26 Mo N2 O4 -","- C80 H104 Mo4 N8 O16 -","4","1","","Maurya, Mannar R.; Mengesha, Bekele; Uprety, Bhawna; Jangra, Nancy; Tomar, Reshu; Avecilla, Fernando","Oxygen atom transfer between DMSO and benzoin catalyzed by cis-dioxidomolybdenum(vi) complexes of tetradentate Mannich bases","New Journal of Chemistry","2018","42","8","6225","","10.1039/C7NJ03551A","","","0.71073","MoKα","","0.0209","0.0196","","","0.0517","0.0524","","","","","","1.077","","","","has coordinates","288501","2023-12-22","13:20:51",""
"7057090","12.9405","0.0004","14.038","0.0004","28.3268","0.001","90","","90","","90","","5145.8","0.3","293","2","293","2","","","","","","","","5","P c a b","-P 2bc 2ac","61","","","","- C26 H38 Mo N2 O4 -","- C26 H38 Mo N2 O4 -","- C208 H304 Mo8 N16 O32 -","8","1","","Maurya, Mannar R.; Mengesha, Bekele; Uprety, Bhawna; Jangra, Nancy; Tomar, Reshu; Avecilla, Fernando","Oxygen atom transfer between DMSO and benzoin catalyzed by cis-dioxidomolybdenum(vi) complexes of tetradentate Mannich bases","New Journal of Chemistry","2018","42","8","6225","","10.1039/C7NJ03551A","","","0.71073","MoKα","","0.0807","0.0367","","","0.0854","0.1059","","","","","","0.937","","","","has coordinates","288501","2023-12-22","13:20:51",""
"7057091","13.3765","0.0011","15.2044","0.0012","19.531","0.0016","90","","90","","90","","3972.2","0.6","100","2","100","2","","","","","","","","7","P n 21 a","P -2ac -2n","33","","","","- C36 H37 Cl2 Mo N6 P S4 -","- C36 H37 Cl2 Mo N6 P S4 -","- C144 H148 Cl8 Mo4 N24 P4 S16 -","4","1","","Bose, Moumita; Moula, Golam; Begum, Ameerunisha; Sarkar, Sabyasachi","Synthesis and characterization of cyano and isocyano complexes of bis(dithiolato) molybdenum using Me3SiCN: a route to a cyanide-bridged multimer to a monomer","New Journal of Chemistry","2018","42","7","5580","","10.1039/C8NJ00246K","","","0.71073","MoKα","","0.0693","0.0628","","","0.1689","0.1761","","","","","","1.104","","","","has coordinates","230427","2020-10-21","18:00:00",""
"7057092","20.059","0.005","9.487","0.005","15.979","0.005","90","0.005","120.919","0.005","90","0.005","2608.7","1.7","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H18 Mo N6 S4 Si2 -","- C16 H18 Mo N6 S4 Si2 -","- C64 H72 Mo4 N24 S16 Si8 -","4","0.5","","Bose, Moumita; Moula, Golam; Begum, Ameerunisha; Sarkar, Sabyasachi","Synthesis and characterization of cyano and isocyano complexes of bis(dithiolato) molybdenum using Me3SiCN: a route to a cyanide-bridged multimer to a monomer","New Journal of Chemistry","2018","42","7","5580","","10.1039/C8NJ00246K","","","0.71069","MoKα","","0.087","0.06","","","0.16","0.2479","","","","","","1.498","","","","has coordinates","230427","2020-10-21","18:00:00",""
"7057093","21.026","0.005","19.802","0.005","20.241","0.005","90","0.005","118.266","0.005","90","0.005","7423","3","100","2","100","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C69 H60 Cl4 Mo2 N10 O P2 S8 -","- C69 H60 Cl4 Mo2 N10 O P2 S8 -","- C276 H240 Cl16 Mo8 N40 O4 P8 S32 -","4","1","","Bose, Moumita; Moula, Golam; Begum, Ameerunisha; Sarkar, Sabyasachi","Synthesis and characterization of cyano and isocyano complexes of bis(dithiolato) molybdenum using Me3SiCN: a route to a cyanide-bridged multimer to a monomer","New Journal of Chemistry","2018","42","7","5580","","10.1039/C8NJ00246K","","","0.71069","MoKα","","0.1247","0.0686","","","0.1684","0.2395","","","","","","1.005","","","","has coordinates","230427","2020-10-21","18:00:00",""
"7057094","11.835","0.003","6.6734","0.0011","12.462","0.002","90","","90","","90","","984.2","0.3","100","2","100","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C8 H8 I N3 -","- C8 H8 I N3 -","- C32 H32 I4 N12 -","4","0.5","","Szell, Patrick M. J.; Siiskonen, Antti; Catalano, Luca; Cavallo, Gabriella; Terraneo, Giancarlo; Priimagi, Arri; Bryce, David L.; Metrangolo, Pierangelo","Halogen-bond driven self-assembly of triangular macrocycles","New Journal of Chemistry","2018","42","13","10467","","10.1039/C8NJ00759D","","","0.71073","MoKα","","0.0212","0.0197","","","0.048","0.0497","","","","","","1.128","","","","has coordinates","230377","2020-10-21","18:00:00",""
"7057095","19.387","0.003","30.384","0.005","8.6076","0.0015","90","","90","","90","","5070.3","1.4","100","2","100","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C11 H15 I N2 -","- C11 H15 I N2 -","- C176 H240 I16 N32 -","16","1","","Szell, Patrick M. J.; Siiskonen, Antti; Catalano, Luca; Cavallo, Gabriella; Terraneo, Giancarlo; Priimagi, Arri; Bryce, David L.; Metrangolo, Pierangelo","Halogen-bond driven self-assembly of triangular macrocycles","New Journal of Chemistry","2018","42","13","10467","","10.1039/C8NJ00759D","","","0.71073","MoKα","","0.0524","0.0371","","","0.0898","0.0995","","","","","","1.111","","","","has coordinates","230377","2020-10-21","18:00:00",""
"7057096","23.295","0.004","13.619","0.002","14.688","0.002","90","","101.934","0.008","90","","4559.1","1.2","103","2","103","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C36 H30 I6 N12 -","- C36 H30 I6 N12 -","- C144 H120 I24 N48 -","4","1","","Szell, Patrick M. J.; Siiskonen, Antti; Catalano, Luca; Cavallo, Gabriella; Terraneo, Giancarlo; Priimagi, Arri; Bryce, David L.; Metrangolo, Pierangelo","Halogen-bond driven self-assembly of triangular macrocycles","New Journal of Chemistry","2018","42","13","10467","","10.1039/C8NJ00759D","","","0.71073","MoKα","","0.0784","0.0418","","","0.0634","0.0713","","","","","","1.04","","","","has coordinates","230377","2020-10-21","18:00:00",""
"7057097","11.0353","0.0007","14.276","0.0009","14.2688","0.0009","90","","90","","90","","2247.9","0.2","200","2","200","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2-iodoethynylpyridine","","- C21 H12 I3 N3 -","- C21 H12 I3 N3 -","- C84 H48 I12 N12 -","4","0.5","","Szell, Patrick M. J.; Siiskonen, Antti; Catalano, Luca; Cavallo, Gabriella; Terraneo, Giancarlo; Priimagi, Arri; Bryce, David L.; Metrangolo, Pierangelo","Halogen-bond driven self-assembly of triangular macrocycles","New Journal of Chemistry","2018","42","13","10467","","10.1039/C8NJ00759D","","","0.71073","MoKα","","0.1234","0.1183","","","0.2951","0.297","","","","","","1.094","","","","has coordinates,has disorder","230377","2020-10-21","18:00:00",""
"7057098","13.733","0.003","17.259","0.004","16.297","0.003","90","","102.51","0.03","90","","3771","1.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H112 N4 O25 V6 -","- C64 H112 N4 O25 V6 -","- C128 H224 N8 O50 V12 -","2","0.5","","Huang, Bo; Wang, Nan; Yang, Kang; Ke, Degang; Fang, Yajun; Hu, Xunliang; Wu, Baolin; Xiao, Zicheng; Wu, Pingfan; Wei, Yongge","Stepwise syntheses and supramolecular assemblies of a series of polyoxovanadate hybrids with various architectures","New Journal of Chemistry","2018","42","8","5853","","10.1039/C7NJ04727D","","","0.71073","MoKα","","0.1439","0.061","","","0.1507","0.1939","","","","","","0.984","","","","has coordinates","230236","2020-10-21","18:00:00",""
"7057099","12.0059","0.0008","13.8979","0.0012","14.0548","0.0007","66.339","0.006","78.031","0.005","67.63","0.007","1982.2","0.3","107.2","","107.2","","","","","","","","","5","P -1","-P 1","2","","","","- C70 H108 N4 O25 V6 -","- C70 H108 N4 O25 V6 -","- C70 H108 N4 O25 V6 -","1","0.5","","Huang, Bo; Wang, Nan; Yang, Kang; Ke, Degang; Fang, Yajun; Hu, Xunliang; Wu, Baolin; Xiao, Zicheng; Wu, Pingfan; Wei, Yongge","Stepwise syntheses and supramolecular assemblies of a series of polyoxovanadate hybrids with various architectures","New Journal of Chemistry","2018","42","8","5853","","10.1039/C7NJ04727D","","","0.7107","MoKα","","0.0769","0.0673","","","0.1571","0.1614","","","","","","1.175","","","","has coordinates,has disorder","230236","2020-10-21","18:00:00",""
"7057100","11.187","0.002","13.547","0.003","14.326","0.003","107.72","0.03","94.21","0.03","104.66","0.03","1973.9","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C66 H116 N4 O25 V6 -","- C66 H116 N4 O25 V6 -","- C66 H116 N4 O25 V6 -","1","0.5","","Huang, Bo; Wang, Nan; Yang, Kang; Ke, Degang; Fang, Yajun; Hu, Xunliang; Wu, Baolin; Xiao, Zicheng; Wu, Pingfan; Wei, Yongge","Stepwise syntheses and supramolecular assemblies of a series of polyoxovanadate hybrids with various architectures","New Journal of Chemistry","2018","42","8","5853","","10.1039/C7NJ04727D","","","0.71073","MoKα","","0.122","0.0772","","","0.2246","0.2798","","","","","","1.031","","","","has coordinates,has disorder","230236","2020-10-21","18:00:00",""
"7057101","13.5838","0.0019","17.309","0.002","16.326","0.002","90","","101.95","0.002","90","","3755.4","0.8","273","2","273.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C64 H108 N4 O25 V6 -","- C64 H108 N4 O25 V6 -","- C128 H216 N8 O50 V12 -","2","0.5","","Huang, Bo; Wang, Nan; Yang, Kang; Ke, Degang; Fang, Yajun; Hu, Xunliang; Wu, Baolin; Xiao, Zicheng; Wu, Pingfan; Wei, Yongge","Stepwise syntheses and supramolecular assemblies of a series of polyoxovanadate hybrids with various architectures","New Journal of Chemistry","2018","42","8","5853","","10.1039/C7NJ04727D","","","0.71073","MoKα","","0.1495","0.065","","","0.1617","0.2132","","","","","","1.017","","","","has coordinates","230236","2020-10-21","18:00:00",""
"7057102","13.677","0.0004","25.6111","0.0009","26.6282","0.0009","90","","93.512","0.002","90","","9309.9","0.5","90","0.5","90","0.5","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H33 Cu N4 O2 -","- C46 H33 Cu N4 O2 -","- C368 H264 Cu8 N32 O16 -","8","2","","Savoldelli, A.; Nardis, S.; Genovese, D.; Prodi, L.; Fronczek, F. R.; Smith, K. M.; Paolesse, R.","Moving corrole towards a red-record: synthesis of β-acrolein Ga and Cu corroles using the Vilsmeier reaction","New Journal of Chemistry","2018","42","10","8200","","10.1039/C7NJ04705C","","","1.54184","CuKα","","0.1042","0.071","","","0.1903","0.2179","","","","","","1.058","","","","has coordinates","230202","2020-10-21","18:00:00",""
"7057103","36.7663","0.0009","17.2278","0.0004","14.6878","0.0003","90","","101.431","0.001","90","","9118.7","0.4","90","0.5","90","0.5","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52.7 H46.4 Cl1.4 Ga N4 O5 -","- C52 H45 Ga N4 O5 -","- C416 H360 Ga8 N32 O40 -","8","1","","Savoldelli, A.; Nardis, S.; Genovese, D.; Prodi, L.; Fronczek, F. R.; Smith, K. M.; Paolesse, R.","Moving corrole towards a red-record: synthesis of β-acrolein Ga and Cu corroles using the Vilsmeier reaction","New Journal of Chemistry","2018","42","10","8200","","10.1039/C7NJ04705C","","","0.71073","MoKα","","0.1004","0.0501","","","0.1043","0.1184","","","","","","1.034","","","","has coordinates,has disorder","230202","2020-10-21","18:00:00",""
"7057104","5.963","0.0002","23.1856","0.0008","10.0548","0.0004","90","","93.046","0.002","90","","1388.17","0.09","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H9 N3 Se3 -","- C12 H9 N3 Se3 -","- C48 H36 N12 Se12 -","4","1","","Jeannin, Olivier; Huynh, Huu-Tri; Riel, Asia Marie S.; Fourmigué, Marc","Chalcogen bonding interactions in organic selenocyanates: from cooperativity to chelation","New Journal of Chemistry","2018","42","13","10502","","10.1039/C8NJ00554K","","x-ray","0.71073","MoKα","","0.0807","0.0513","","","0.0979","0.1066","","","","","","1.097","","","","has coordinates","230369","2020-10-21","18:00:00",""
"7057105","5.4173","0.0012","13.172","0.003","11.795","0.002","90","","97.451","0.014","90","","834.5","0.3","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 N4 Se4 -","- C14 H10 N4 Se4 -","- C28 H20 N8 Se8 -","2","0.5","","Jeannin, Olivier; Huynh, Huu-Tri; Riel, Asia Marie S.; Fourmigué, Marc","Chalcogen bonding interactions in organic selenocyanates: from cooperativity to chelation","New Journal of Chemistry","2018","42","13","10502","","10.1039/C8NJ00554K","","x-ray","0.71073","MoKα","","0.0826","0.0439","","","0.101","0.1185","","","","","","0.914","","","","has coordinates","230369","2020-10-21","18:00:00",""
"7057106","18.8209","0.0009","10.1135","0.0005","17.9834","0.0007","90","","99.039","0.002","90","","3380.5","0.3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H15 N3 Se3 -","- C15 H15 N3 Se3 -","- C120 H120 N24 Se24 -","8","1","","Jeannin, Olivier; Huynh, Huu-Tri; Riel, Asia Marie S.; Fourmigué, Marc","Chalcogen bonding interactions in organic selenocyanates: from cooperativity to chelation","New Journal of Chemistry","2018","42","13","10502","","10.1039/C8NJ00554K","","x-ray","0.71073","MoKα","","0.0918","0.0381","","","0.0754","0.0991","","","","","","0.891","","","","has coordinates,has disorder","230369","2020-10-21","18:00:00",""
"7057107","5.9559","0.0005","10.0181","0.0008","17.6631","0.0013","79.153","0.003","82.977","0.003","84.524","0.003","1024.47","0.14","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H22 N4 O Se3 -","- C18 H22 N4 O Se3 -","- C36 H44 N8 O2 Se6 -","2","1","","Jeannin, Olivier; Huynh, Huu-Tri; Riel, Asia Marie S.; Fourmigué, Marc","Chalcogen bonding interactions in organic selenocyanates: from cooperativity to chelation","New Journal of Chemistry","2018","42","13","10502","","10.1039/C8NJ00554K","","x-ray","0.71073","MoKα","","0.0364","0.0316","","","0.0694","0.0706","","","","","","1.198","","","","has coordinates","230369","2020-10-21","18:00:00",""
"7057108","9.224","0.005","9.382","0.005","9.591","0.005","108.086","0.015","116.283","0.014","102.687","0.015","642.3","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H24 N6 O2 Se4 -","- C20 H24 N6 O2 Se4 -","- C20 H24 N6 O2 Se4 -","1","0.5","","Jeannin, Olivier; Huynh, Huu-Tri; Riel, Asia Marie S.; Fourmigué, Marc","Chalcogen bonding interactions in organic selenocyanates: from cooperativity to chelation","New Journal of Chemistry","2018","42","13","10502","","10.1039/C8NJ00554K","","x-ray","0.71073","MoKα","","0.0635","0.04","","","0.0808","0.0905","","","","","","1.118","","","","has coordinates","230369","2020-10-21","18:00:00",""
"7057109","18.5055","0.0017","10.3314","0.0009","23.327","0.002","90","","107.551","0.004","90","","4252.2","0.7","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H23 N3 O2 Se3 -","- C19 H23 N3 O2 Se3 -","- C152 H184 N24 O16 Se24 -","8","1","","Jeannin, Olivier; Huynh, Huu-Tri; Riel, Asia Marie S.; Fourmigué, Marc","Chalcogen bonding interactions in organic selenocyanates: from cooperativity to chelation","New Journal of Chemistry","2018","42","13","10502","","10.1039/C8NJ00554K","","x-ray","0.71073","MoKα","","0.0485","0.0342","","","0.0741","0.0816","","","","","","1.06","","","","has coordinates,has disorder","230369","2020-10-21","18:00:00",""
"7057110","6.5759","0.0004","8.4895","0.0005","8.8346","0.0005","84.185","0.002","78.947","0.003","80.038","0.003","475.57","0.05","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H26 N4 Ni S4 -","- C14 H26 N4 Ni S4 -","- C14 H26 N4 Ni S4 -","1","0.5","","Gervas, Charles; Mlowe, Sixberth; Akerman, Matthew P.; Revaprasadu, Neerish","Phase pure Ni3S2 and NiS from bis(N′-ethyl-N-piperazinylcarbodithioato-S,S′)‒nickel(ii) via solvent thermolysis and aerosol assisted chemical vapour deposition","New Journal of Chemistry","2018","42","8","6203","","10.1039/C8NJ00092A","","","0.71073","MoKα","","0.019","0.0182","","","0.0468","0.0474","","","","","","1.04","","","","has coordinates","230238","2020-10-21","18:00:00",""
"7057111","9.7961","0.001","11.3348","0.0016","15.5663","0.0015","85.817","0.004","84.393","0.004","76.837","0.004","1672.7","0.3","150","2","150","2","","","","","","","","5","P 1","P 1","1","","","","- C33 H34.5 Cl1.5 N7 O6 -","- C33 H34.5 Cl1.5 N7 O6 -","- C66 H69 Cl3 N14 O12 -","2","2","","Zhang, Zongyao; Xu, Lijin; Cao, Rui","Structures and single crystal to single crystal transformations of cadmium frameworks using a flexible tripodal ligand","New Journal of Chemistry","2018","42","7","5593","","10.1039/C7NJ05125E","","","0.71073","MoKα","","0.0788","0.0566","","","0.1134","0.127","","","","","","1.078","","","","has coordinates,has disorder","230423","2020-10-21","18:00:00",""
"7057112","12.1835","0.0013","12.1835","0.0013","38.086","0.005","90","","90","","120","","4896","1","150","2","150","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C66 H66 Cd Cl2 N14 O8 -","- C66 H66 Cd Cl2 N14 O8 -","- C198 H198 Cd3 Cl6 N42 O24 -","3","0.166667","","Zhang, Zongyao; Xu, Lijin; Cao, Rui","Structures and single crystal to single crystal transformations of cadmium frameworks using a flexible tripodal ligand","New Journal of Chemistry","2018","42","7","5593","","10.1039/C7NJ05125E","","","0.71073","MoKα","","0.1003","0.0934","","","0.2668","0.2781","","","","","","1.107","","","","has coordinates","230423","2020-10-21","18:00:00",""
"7057113","13.094","0.003","13.094","0.003","37.435","0.01","90","","90","","120","","5558","2","150","2","150","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C66 H66 Cd Cl2 N14 -","- C66 H66 Cd Cl2 N14 -","- C198 H198 Cd3 Cl6 N42 -","3","0.166667","","Zhang, Zongyao; Xu, Lijin; Cao, Rui","Structures and single crystal to single crystal transformations of cadmium frameworks using a flexible tripodal ligand","New Journal of Chemistry","2018","42","7","5593","","10.1039/C7NJ05125E","","","0.71073","MoKα","","0.0631","0.0506","","","0.1351","0.1418","","","","","","1.054","","","","has coordinates","230423","2020-10-21","18:00:00",""
"7057114","14.01","0.006","23.38","0.009","21.272","0.009","90","","96.13","0.04","90","","6928","5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C66 H66 Cd2 Cl4 N14 -","- C66 H66 Cd2 Cl4 N14 -","- C264 H264 Cd8 Cl16 N56 -","4","1","","Zhang, Zongyao; Xu, Lijin; Cao, Rui","Structures and single crystal to single crystal transformations of cadmium frameworks using a flexible tripodal ligand","New Journal of Chemistry","2018","42","7","5593","","10.1039/C7NJ05125E","","","0.71073","MoKα","","0.2261","0.1173","","","0.3208","0.3844","","","","","","1.012","","","","has coordinates","230423","2020-10-21","18:00:00",""
"7057115","14.18","0.009","15.386","0.008","18.466","0.012","101.133","0.019","92.04","0.03","92.143","0.019","3946","4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H78 Cd2 N14 O8 -","- C74 H78 Cd2 N14 O8 -","- C148 H156 Cd4 N28 O16 -","2","1","","Zhang, Zongyao; Xu, Lijin; Cao, Rui","Structures and single crystal to single crystal transformations of cadmium frameworks using a flexible tripodal ligand","New Journal of Chemistry","2018","42","7","5593","","10.1039/C7NJ05125E","","","0.71073","MoKα","","0.1613","0.0708","","","0.1388","0.1684","","","","","","0.995","","","","has coordinates,has disorder","230423","2020-10-21","18:00:00",""
"7057116","6.0262","0.0012","13.512","0.003","14.157","0.003","90","","102.212","0.002","90","","1126.7","0.4","90","","90","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N2 O2 -","- C14 H12 N2 O2 -","- C56 H48 N8 O8 -","4","1","","Yadav, Neetu; Singh, Ashok Kumar","Dicarbohydrazide based chemosensors for copper and cyanide ions via a displacement approach","New Journal of Chemistry","2018","42","8","6023","","10.1039/C8NJ00230D","","","0.71073","MoKα","","0.0648","0.0409","","","0.088","