# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-29T07:59:08+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'New J. Chem.') AND volume = 24 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
"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",""
"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",""
"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",""
"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",""
"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",""