# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-26T21:34:26+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'New Journal of Chemistry') AND volume = 23 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
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"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","23","1","17","24","10.1039/a806501b","","","","","","","0.0404","","","0.0977","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","1","17","24","10.1039/a806501b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","1","17","24","10.1039/a806501b","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051385","13.9562","0.0003","15.0799","0.0004","23.1845","0.0002","90","","102.979","0.001","90","","4754.7","0.2","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H26 N12 Si -","- C48 H26 N12 Si -","- C192 H104 N48 Si4 -","4","1","","Stradiotto, Mark; Brook, Michael A.; McGlinchey, Michael J.","The Molecular Dynamics and cycloaddition chemistry of tris(1-indenyl)allylsilane: Generation of the first crystallographically-characterized tris(benzonorbornyl)silane","New Journal of Chemistry","1999","23","3","317","321","10.1039/a806739b","","","","","","","0.0777","","","0.2053","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
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"7051387","16.058","0.002","16.058","0.002","10.286","0.002","90","","90","","120","","2297","0.6","298","2","298","2","","","","","","","","6","P 3","P 3","143","","","","- C21 H38 Cl3.33 Fe0.33 Mg2.33 O8 -","- C21 H38 Cl4.66667 Fe0.666667 Mg2.33333 O8 -","- C63 H114 Cl14 Fe2 Mg7 O24 -","3","1","","","","New Journal of Chemistry","1999","23","2","185","188","10.1039/a807745b","","","","","","","0.0666","","","0.1726","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051388","12.079","0.003","12.15","0.003","17.641","0.004","87.02","0.03","78","0.03","60.87","0.03","2208.4","0.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H62.5 Cl4 Mg2.8 Ni1.2 O12.5 -","- C29 H62.5 Cl4 Mg2.8 Ni1.2 O12.5 -","- C58 H125 Cl8 Mg5.6 Ni2.4 O25 -","2","1","","","","New Journal of Chemistry","1999","23","2","185","188","10.1039/a807745b","","","","","","","0.0416","","","0.1129","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051389","7.053","0.002","13.818","0.005","16.452","0.006","90","","90","","90","","1603.4","0.7","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H24 Cl2 N4 Ti -","- C10 H24 Cl2 N4 Ti -","- C40 H96 Cl8 N16 Ti4 -","4","1","","","","New Journal of Chemistry","1999","23","3","271","273","10.1039/a807985d","","","","","","","0.0455","","","0.0475","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051390","9.871","0.005","16.677","0.011","15.02","0.011","90","","103.51","0.05","90","","2404.1","2.1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H42 Cl2 N4 Ti -","- C19 H42 Cl2 N4 Ti -","- C76 H168 Cl8 N16 Ti4 -","4","1","","","","New Journal of Chemistry","1999","23","3","271","273","10.1039/a807985d","","","","","","","0.0681","","","0.0672","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051391","12.378","0.005","7.934","0.003","6.322","0.003","90","","99.07","0.03","90","","613.04","","220","","220","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 Ag N3 O2 -","- C4 H4 Ag N3 O2 -","- C16 H16 Ag4 N12 O8 -","4","0.5","","","","New Journal of Chemistry","1999","23","1","13","15","10.1039/a808025i","","","","","","","0.0443","","","0.0459","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051392","7.2931","0.0012","6.087","0.002","11.481","0.003","90","","102.871","0.017","90","","496.8","0.2","220","2","220","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","[Ag(4,4'bipy)NO2]","","","- C10 H8 Ag N3 O2 -","- C10 H8 Ag N3 O2 -","- C20 H16 Ag2 N6 O4 -","2","0.5","","","","New Journal of Chemistry","1999","23","1","13","15","10.1039/a808025i","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051393","11.132","0.002","11.12","0.002","20.726","0.005","77.81","0.02","83.31","0.02","89.95","0.014","2490","0.9","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H19 Li N2 O -","- C12 H19 Li N2 O -","- C96 H152 Li8 N16 O8 -","8","4","","","","New Journal of Chemistry","1999","23","1","35","41","10.1039/a808050j","","","","","","","0.0698","","","0.2173","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","1","35","41","10.1039/a808050j","","","","","","","0.0536","","","0.1177","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","1","35","41","10.1039/a808050j","","","","","","","0.0571","","","0.1314","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","2","237","240","10.1039/a808186g","","","","","","","0.0364","","","0.0964","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"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","23","4","345","346","10.1039/a808494g","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","4","407","416","10.1039/a808621d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","4","407","416","10.1039/a808621d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","4","407","416","10.1039/a808621d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","2","199","206","10.1039/a808860h","","","","","","","0.0457","","","0.0993","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","3","303","307","10.1039/a809030k","","","","","","","0.0389","","","0.0901","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051404","8.0893","0.0008","12.7708","0.0014","10.0663","0.0011","90","","105.275","0.002","90","","1003.2","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C H7 N5 O8 P2 Zn2 -","- C H7 N5 O8 P2 Zn2 -","- C4 H28 N20 O32 P8 Zn8 -","4","1","","","","New Journal of Chemistry","1999","23","3","303","307","10.1039/a809030k","","","","","","","0.0422","","","0.0993","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051405","20.032","0.006","21.966","0.006","16.522","0.005","112.11","0.04","113.73","0.04","94.26","0.04","5944","3","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H38 Mn N8 S2 -","- C26 H38 Mn N8 S2 -","- C208 H304 Mn8 N64 S16 -","8","4","","","","New Journal of Chemistry","1999","23","10","1033","1039","10.1039/a809066a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","10","1033","1039","10.1039/a809066a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051407","20.084","0.005","8.384","0.005","18.339","0.005","90","","107.08","0.04","90","","2952","2","210","2","210","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H38 Mn N8 S2 -","- C26 H38 Mn N8 S2 -","- C104 H152 Mn4 N32 S8 -","4","0.5","","","","New Journal of Chemistry","1999","23","10","1033","1039","10.1039/a809066a","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051408","27.842","0.006","27.842","0.006","12.445","0.004","90","","90","","120","","8354.6","3.8","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C31 H26.5 F12 N3.5 P2 -","- C31 H26.5 F12 N3.5 P2 -","- C279 H238.5 F108 N31.5 P18 -","9","0.5","","","","New Journal of Chemistry","1999","23","6","587","602","10.1039/a809433k","","","","","","","0.0754","","","0.2145","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051409","28.925","0.003","13.581","0.0013","24.8718","0.0014","90","","107.096","0.01","90","","9338.8","1.4","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C78 H90 F24 N10 O22 P4 -","- C78 H90 F24 N10 O22 P4 -","- C312 H360 F96 N40 O88 P16 -","4","0.5","","","","New Journal of Chemistry","1999","23","6","587","602","10.1039/a809433k","","","","","","","0.1274","","","0.3379","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051410","15.109","0.002","24.2235","0.0015","12.5179","0.0012","90","","90","","90","","4581.3","0.8","193","2","193","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C40 H32 F24 N4 P4 -","- C40 H32 F24 N4 P4 -","- C160 H128 F96 N16 P16 -","4","1","","","","New Journal of Chemistry","1999","23","6","587","602","10.1039/a809433k","","","","","","","0.073","","","0.1844","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051411","13.799","0.003","14.407","0.004","16.336","0.005","110.09","0.02","90.33","0.02","91.12","0.02","3049.2","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C64 H66 F12 N2 O10 P2 -","- C64 H66 F12 N2 O10 P2 -","- C128 H132 F24 N4 O20 P4 -","2","1","","","","New Journal of Chemistry","1999","23","6","587","602","10.1039/a809433k","","","","","","","0.1141","","","0.2968","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051412","11.222","0.002","11.277","0.003","12.033","0.003","106.2","0.02","99.94","0.02","107.196","0.015","1342","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H60 F12 N4 O10 P2 -","- C48 H60 F12 N4 O10 P2 -","- C48 H60 F12 N4 O10 P2 -","1","0.5","","","","New Journal of Chemistry","1999","23","6","587","602","10.1039/a809433k","","","","","","","0.0681","","","0.1807","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051413","27.283","0.003","27.283","0.004","27.283","0.003","90","0.01","90","0.007","90","0.008","20308.4","4.1","173","2","173","2","","","","","","","","9","P a -3","-P 2ac 2ab 3","205","","","","- C30 H30 B Cu F6 N6 O P S3 -","- C30 H30 B Cu F5.98667 N6 O P S3 -","- C720 H720 B24 Cu24 F143.68 N144 O24 P24 S72 -","24","1","","","","New Journal of Chemistry","1999","23","4","417","424","10.1039/a809777a","","","","","","","0.0601","","","0.1167","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
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"7051415","10.02","0.002","13.254","0.002","15.142","0.003","105.878","0.013","106.3","0.02","92.291","0.014","1841.5","0.6","173","2","173","2","","","","","","","","9","P -1","-P 1","2","","","","- C33 H41 B Cl2 Cu F6 N9 O P -","- C33 H27 B Cl2 Cu F6 N9 O P -","- C66 H54 B2 Cl4 Cu2 F12 N18 O2 P2 -","2","1","","","","New Journal of Chemistry","1999","23","4","417","424","10.1039/a809777a","","","","","","","0.0627","","","0.151","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051416","24.29","0.005","8.169","0.002","15.807","0.003","90","","127.42","0.03","90","","2491","0.9","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C18 H10 B2 Cl6 Fe N6 O6 -","- C18 H10 B2 Cl6 Fe N6 O6 -","- C72 H40 B8 Cl24 Fe4 N24 O24 -","4","0.5","","","","New Journal of Chemistry","1999","23","4","355","358","10.1039/a809881f","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","4","355","358","10.1039/a809881f","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","5","499","507","10.1039/a809942a","","","","","","","0.0578","","","0.1394","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","5","499","507","10.1039/a809942a","","","","","","","0.1063","","","0.2279","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","4","403","406","10.1039/a809943j","","","","","","","0.0236","","","0.0604","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","3","267","269","10.1039/a900125e","","","","","","","0.0465","","","0.0996","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","4","359","364","10.1039/a900344d","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","6","625","628","10.1039/a900562e","","","","","","","0.0784","","","0.1838","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","6","625","628","10.1039/a900562e","","","","","","","0.0671","","","0.1892","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","4","393","396","10.1039/a900679f","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","5","545","548","10.1039/a900890j","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","6","573","575","10.1039/a900947g","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","6","573","575","10.1039/a900947g","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","7","785","790","10.1039/a901893j","","","","","","","0.0942","","","0.2014","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","785","790","10.1039/a901893j","","","","","","","0.0687","","","0.1923","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","743","748","10.1039/a901896d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","5","461","463","10.1039/a901925a","","","","","","","0.0449","","","0.0981","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","5","461","463","10.1039/a901925a","","","","","","","0.1101","","","0.2674","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","6","629","632","10.1039/a902177i","","","","","","","0.0505","","","0.0508","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","683","685","10.1039/a902282a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","683","685","10.1039/a902282a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","691","693","10.1039/a902627d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","691","693","10.1039/a902627d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","777","783","10.1039/a902738f","","","","","","","0.0359","","","0.0824","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","777","783","10.1039/a902738f","","","","","","","0.049","","","0.1157","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","777","783","10.1039/a902738f","","","","","","","0.0413","","","0.1006","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","777","783","10.1039/a902738f","","","","","","","0.0438","","","0.0994","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","891","895","10.1039/a902815c","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","773","776","10.1039/a902907i","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","687","690","10.1039/a903330k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"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","23","10","1041","1044","10.1039/a903589c","","","","","","","0.0502","","","0.1254","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","807","809","10.1039/a903679b","","","","","","","0.0433","","","0.0993","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","807","809","10.1039/a903679b","","","","","","","0.0779","","","0.2038","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","7","675","678","10.1039/a903746b","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","841","844","10.1039/a903793d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","841","844","10.1039/a903793d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"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","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"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","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"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","23","9","929","938","10.1039/a903823j","","","","","","","0.088","","","0.2134","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","9","897","903","10.1039/a904174e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","301851","2025-08-21","20:32:38",""
"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","23","9","911","914","10.1039/a904476k","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","815","817","10.1039/a904579a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","8","815","817","10.1039/a904579a","","","","","","","0.0479","","","0.1165","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","9","915","921","10.1039/a904599f","","","","","","","0.0511","","","0.1031","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"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","23","9","915","921","10.1039/a904599f","","","","","","","0.0357","","","0.101","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","11","1079","1086","10.1039/a904760c","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","11","1079","1086","10.1039/a904760c","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","11","1049","1050","10.1039/a905080i","","","","","","","0.0485","","","0.056","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","10","957","959","10.1039/a905250j","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","11","1097","1103","10.1039/a905284d","","","","","","","0.0347","","","0.0978","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","12","1215","1222","10.1039/a905842g","","","","","","","0.0577","","","0.1572","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","11","1051","1052","10.1039/a905955e","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"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","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1253","1260","10.1039/a906264e","","","","","","","0.06","","","0.213","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","10","961","963","10.1039/a906292k","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1137","1139","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"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","23","12","1137","1139","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"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","23","12","1137","1139","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"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","301851","2025-08-21","20:32:38",""
"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","23","10","1007","1013","10.1039/a906736a","","","","","","","0.0402","","","0.1028","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","12","1223","1230","10.1039/a907124e","","","","","","","0.0413","","","0.1092","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"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","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"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","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"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","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"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","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"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","23","12","1163","1169","10.1039/a907417a","","","","","","","0.057","","","0.0863","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"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","23","12","1163","1169","10.1039/a907417a","","","","","","","0.0353","","","0.0503","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"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","301851","2025-08-21","20:32:47",""