# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-02T00:34:56+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 Journal of Chemistry') AND volume = 28 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
"7050118","10.716","0.001","16.811","0.001","13.097","0.001","90","","104.23","0.01","90","","2287","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 N2 O2 S2 -","- C28 H24 N2 O2 S2 -","- C112 H96 N8 O8 S8 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0744","0.0634","","","0.1619","0.1712","","","","","","1.033","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050119","15.279","0.001","12.807","0.001","12.191","0.001","90","","94.51","0.01","90","","2378.1","0.3","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C28 H21 Co N2 O2 S2 -","- C28 H21 Co N2 O2 S2 -","- C112 H84 Co4 N8 O8 S8 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0303","0.0276","","","0.0624","0.0636","","","","","","1.063","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050120","11.383","0.001","11.383","0.001","18.347","0.001","90","","90","","90","","2377.3","0.3","173","2","173","2","","","","","","","","6","P 41","P 4w","76","","","","- C28 H22 N2 O2 S2 Zn -","- C28 H22 N2 O2 S2 Zn -","- C112 H88 N8 O8 S8 Zn4 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0477","0.0375","","","0.0702","0.0737","","","","","","1.022","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050121","11.233","0.001","11.233","0.001","18.428","0.002","90","","90","","90","","2325.3","0.4","150","2","150","2","","","","","","","","6","P 41","P 4w","76","","","","- C28 H22 N2 Ni O2 S2 -","- C28 H22 N2 Ni O2 S2 -","- C112 H88 N8 Ni4 O8 S8 -","4","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.2345","0.194","","","0.4342","0.4559","","","","","","1.112","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050122","10.75","0.001","12.299","0.001","12.656","0.001","84.38","0.01","67.41","0.01","70.99","0.01","1460","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C36.5 H28 N2 Ni O2.5 S2 -","- C36.5 H28 N2 Ni O2.5 S2 -","- C73 H56 N4 Ni2 O5 S4 -","2","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.075","0.0507","","","0.1099","0.1229","","","","","","1.055","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050123","22.994","0.001","7.612","0.001","17.98","0.002","90","","110.55","0.01","90","","2946.8","0.6","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H26 N2 O2 S2 Zn -","- C36 H26 N2 O2 S2 Zn -","- C144 H104 N8 O8 S8 Zn4 -","4","0.5","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71073","MoKα","","0.0529","0.0339","","","0.0664","0.0726","","","","","","1.036","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050124","13.929","0.0003","13.929","0.0003","14.231","0.0005","90","0.001","90","0.001","90","0.002","2761.06","0.13","173","2","173","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C16 H15 Co0.5 N O4 -","- C16 H15 Co0.5 N O4 -","- C128 H120 Co4 N8 O32 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.0787","0.0439","","","0.0924","0.106","","","","","","1.025","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050125","13.925","0.002","13.925","0.002","14.181","0.003","90","","90","","90","","2749.8","0.8","173","2","173","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C16 H15 N Ni0.5 O4 -","- C16 H15 N Ni0.5 O4 -","- C128 H120 N8 Ni4 O32 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.1044","0.0746","","","0.1695","0.1863","","","","","","1.063","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050126","13.925","0.002","13.925","0.002","14.181","0.003","90","","90","","90","","2749.8","0.8","173","2","173","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C15 H15 N O3 Zn0.5 -","- C15 H15 N O3 Zn0.5 -","- C120 H120 N8 O24 Zn4 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.0756","0.0382","","","0.0708","0.0818","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050127","17.254","0.0002","8.395","0.0004","15.994","0.0006","90","0.001","90","0.001","90","0.002","2316.69","0.14","173","2","173","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C14 H12 N O2 -","- C14 H12 N O2 -","- C112 H96 N8 O16 -","8","1","","Gudneppanavar Rajsekhar; Chebrolu P. Rao; Pauli Saarenketo; Kalle Nättinen; Kari Rissanen","Complexation behaviour of hexadentate ligands possessing N2O4 and N2O2S2 cores: differential reactivity towards Co(II), Ni(II) and Zn(II) salts and structures of the products","New J. Chem.","2004","28","1","75","84","10.1039/b305313j","","","0.71069","MoKα","","0.0939","0.066","","","0.1532","0.1711","","","","","","1.054","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050128","18.373","0.008","5.489","0.004","11.369","0.004","90","","124.22","0.03","90","","948.1","0.9","122","2","122","2","","","","","","","","3","C 1 2 1","C 2y","5","Schiff base","N-[(1E)-1H-pyrrol-2-ylmethylene]benzene-1,2-diamine","","- C11 H11 N3 -","- C11 H11 N3 -","- C44 H44 N12 -","4","1","","Munro, Orde Q.; Strydom, Sandra D.; Grimmer, Craig D.","Complementary hydrogen bonding in a new tridentate Schiff base ligand: X-ray, DFT and solution NMR studiesElectronic supplementary information (ESI) available: unit cell packing diagram for 3 (Fig. S1) and 1H NMR spectra of 3 as a function of the concentration of added H2O in CDCl3 solution (Fig. S2). See http://www.rsc.org/suppdata/nj/b3/b305946d/","New Journal of Chemistry","2004","28","1","34","","10.1039/b305946d","","","0.71073","MoKα","","0.0382","0.0361","","","0.1","0.1016","","","","","","1.063","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050129","11.13247","0.00012","20.67256","0.00017","7.44834","0.00005","90","","97.985","0.0006","90","","1697.52","0.03","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C11 H8 O2 -","- C11 H8 O2 -","- C88 H64 O16 -","8","2","","Nowell, Harriott; Paul Attfield, J.","X-Ray and neutron powder diffraction studies of the crystal structure of vitamin K3Electronic supplementary information (ESI) available: X-ray powder diffraction data. See http://www.rsc.org/suppdata/nj/b3/b306072a/","New Journal of Chemistry","2004","28","3","406","","10.1039/b306072a","powder diffraction","x-ray","0.598542","","","","","","","","","0.1076","","2.96","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050130","11.11103","0.00025","20.6416","0.0005","7.43426","0.0001","90","","97.949","0.0009","90","","1688.66","0.06","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C11 H8 O2 -","- C11 H8 O2 -","- C88 H64 O16 -","8","2","","Nowell, Harriott; Paul Attfield, J.","X-Ray and neutron powder diffraction studies of the crystal structure of vitamin K3Electronic supplementary information (ESI) available: X-ray powder diffraction data. See http://www.rsc.org/suppdata/nj/b3/b306072a/","New Journal of Chemistry","2004","28","3","406","","10.1039/b306072a","powder diffraction","","","","","","","","","","","","","2.72","","","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050131","29.5519","0.0012","10.0503","0.0005","19.316","0.0009","90","","112.005","0.004","90","","5319","0.4","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H36 N3 O7 V -","- C26 H36 N3 O7 V -","- C208 H288 N24 O56 V8 -","8","1","","Jozef Tatiersky; Peter Schwendt; Jaromír Marek; Michal Sivák","Racemic vanadium(V) oxo monoperoxo complexes with two achiral bidentate heteroligands. Synthesis, characterization, crystal structure and stereochemistry of K[VO(O2)(ox)(bpy)]·3H2O and Pr4N[VO(O2)(ox)(phen)]","New J. Chem.","2004","28","1","127","133","10.1039/b306090j","","","0.71073","MoKα","","0.0576","0.0417","","","0.0954","0.1021","","","","","","1.004","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050132","9.6777","0.0005","13.8879","0.0006","12.7353","0.0006","90","","97.606","0.005","90","","1696.6","0.14","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 K N2 O10 V -","- C12 H14 K N2 O10 V -","- C48 H56 K4 N8 O40 V4 -","4","1","","Jozef Tatiersky; Peter Schwendt; Jaromír Marek; Michal Sivák","Racemic vanadium(V) oxo monoperoxo complexes with two achiral bidentate heteroligands. Synthesis, characterization, crystal structure and stereochemistry of K[VO(O2)(ox)(bpy)]·3H2O and Pr4N[VO(O2)(ox)(phen)]","New J. Chem.","2004","28","1","127","133","10.1039/b306090j","","","0.71073","MoKα","","0.0301","0.0245","","0.0634","0.0615","","","","1.004","1.038","1.038","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050133","9.755","0.004","8.478","0.003","17.791","0.003","90","","95.72","0.02","90","","1464","0.8","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 Fe2 N4 O4 -","- C32 H30 Fe2 N4 O4 -","- C64 H60 Fe4 N8 O8 -","2","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0601","","","","0.1801","","","","","","1.084","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050134","10.801","0.005","7.696","0.005","17.052","0.004","90","","95.1","0.03","90","","1411.8","1.2","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Fe2 N4 O2 -","- C34 H30 Fe2 N4 O2 -","- C68 H60 Fe4 N8 O4 -","2","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0501","","","","0.1478","","","","","","1.067","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050135","10.766","0.003","7.576","0.003","17.452","0.004","90","","94.59","0.02","90","","1418.9","0.8","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H30 Fe2 N4 O2 -","- C34 H28 Fe2 N4 O2 -","- C68 H56 Fe4 N8 O4 -","2","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0492","","","","0.143","","","","","","1.047","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050136","7.406","0.003","19.131","0.007","20.727","0.003","90","","92.42","0.03","90","","2934.1","1.7","296.2","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H30 Fe2 N4 O4 S -","- C32 H30 Fe2 N4 O4 S -","- C128 H120 Fe8 N16 O16 S4 -","4","1","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0407","","","","0.1287","","","","","","1.03","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050137","9.32","0.004","10.951","0.005","13.149","0.004","90","","99.32","0.03","90","","1324.3","0.9","296.3","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H26 Fe N2 O2 -","- C34 H26 Fe N2 O2 -","- C68 H52 Fe2 N4 O4 -","2","1","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.042","","","","0.137","","","","","","1.053","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050138","11.037","0.002","12.652","0.004","7.518","0.005","104.42","0.03","96.41","0.03","88.21","0.03","1010.4","0.8","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H18 Fe N2 O6 -","- C23 H18 Fe N2 O6 -","- C46 H36 Fe2 N4 O12 -","2","1","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0419","","","","0.1119","","","","","","1.055","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050139","12.474","0.004","13.687","0.003","19.39","0.003","90","","94.1","0.02","90","","3302","1.4","296.2","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H30 Fe2 N4 O8 -","- C38 H30 Fe2 N4 O8 -","- C152 H120 Fe8 N16 O32 -","4","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0521","","","","0.1638","","","","","","1.016","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050140","7.997","0.003","14.278","0.002","17.219","0.002","90","","90","","90","","1966.1","0.8","296.2","","","","","","","","","","","5","P b c m","-P 2c 2b","57","","","","- C20 H22 Fe N2 O5 -","- C20 H17 Fe N2 O5 -","- C80 H68 Fe4 N8 O20 -","4","0.5","","Horikoshi, Ryo; Nambu, Chisato; Mochida, Tomoyuki","Supramolecular assembly of ferrocenes via hydrogen bonds: dimensional variation in ferrocenylpyrimidine complexes with carboxylic acids and aromatic alcohols","New Journal of Chemistry","2004","28","1","26","","10.1039/b306699a","","","0.7107","MoKα","","","0.0565","","","","0.1707","","","","","","1.162","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7050141","9.433","0.001","10.255","0.001","12.18","0.002","81.66","0.01","87.44","0.01","73.95","0.01","1120.3","0.3","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H26 O3 Sn -","- C24 H26 O3 Sn -","- C48 H52 O6 Sn2 -","2","1","","Chisholm, Malcolm H.; Delbridge, Ewan E.; Gallucci, Judith C.","Modeling the catalyst resting state in aryl tin(iv) polymerizations of lactide and estimating the relative rates of transamidation, transesterification and chain transferElectronic supplementary information (ESI) available: kinetic data of reactions C and E in Scheme 2. See http://www.rsc.org/suppdata/nj/b3/b306700a/","New Journal of Chemistry","2004","28","1","145","","10.1039/b306700a","","","0.71073","MoKα","","0.0312","0.024","","0.0554","0.0527","","","","1.081","1.1","1.1","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050142","11.554","0.001","11.075","0.001","19.704","0.002","90","","98.947","0.004","90","","2490.7","0.4","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 N2 O4 Sn -","- C24 H34 N2 O4 Sn -","- C96 H136 N8 O16 Sn4 -","4","1","","Chisholm, Malcolm H.; Delbridge, Ewan E.; Gallucci, Judith C.","Modeling the catalyst resting state in aryl tin(iv) polymerizations of lactide and estimating the relative rates of transamidation, transesterification and chain transferElectronic supplementary information (ESI) available: kinetic data of reactions C and E in Scheme 2. See http://www.rsc.org/suppdata/nj/b3/b306700a/","New Journal of Chemistry","2004","28","1","145","","10.1039/b306700a","","","0.71073","MoKα","","0.0452","0.0349","","0.0979","0.0926","","","","1.036","1.087","1.087","","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050143","11.21","0.002","8.8436","0.0018","25.809","0.005","90","","98.39","0.03","90","","2531.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 Cl2 N4 O9 -","- C16 H38 Cl2 N4 O9 -","- C64 H152 Cl8 N16 O36 -","4","1","","Ali, Mahammad; Ray, Ambarish; Sheldrick, William S.; Mayer-Figge, H.; Gao, Song; Sahmes, Alexander I.","Synthesis, crystal structure, EPR and magnetic properties of a cyano-bridged Cuii?Niii heterobimetallic complex: an unusual structure with long-range ferromagnetic exchange through hydrogen bonding","New Journal of Chemistry","2004","28","3","412","","10.1039/b306866h","","","0.71073","MoKα","","0.1742","0.0737","","","0.14","0.1794","","","","","","1.003","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050144","15.14","0.009","12.002","0.004","14.286","0.005","90","","115.62","0.04","90","","2341","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H36 Cu N8 Ni -","- C20 H36 Cu N8 Ni -","- C80 H144 Cu4 N32 Ni4 -","4","0.5","","Ali, Mahammad; Ray, Ambarish; Sheldrick, William S.; Mayer-Figge, H.; Gao, Song; Sahmes, Alexander I.","Synthesis, crystal structure, EPR and magnetic properties of a cyano-bridged Cuii?Niii heterobimetallic complex: an unusual structure with long-range ferromagnetic exchange through hydrogen bonding","New Journal of Chemistry","2004","28","3","412","","10.1039/b306866h","","","0.71073","MoKα","","0.0906","0.0604","","","0.1568","0.1822","","","","","","1.03","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050145","8.6072","0.0007","11.55","0.002","11.857","0.002","99.737","0.002","92.727","0.002","109.999","0.002","1084.6","0.3","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H9 Cu K N2 O7 -","- C6 H9 Cu K N2 O7 -","- C24 H36 Cu4 K4 N8 O28 -","4","2","","Malek, Kamilla; Vala, Martin; Swiatek-Kozlowska, Jolanta; Proniewicz, Leonard M.","Solid state study of the copper(ii) complex of 2-hydroxyiminopropanoic acidElectronic supplementary information (ESI) available: bond lengths, bond angles and hydrogen bonds for K[CuHL2]�H2O; harmonic frequencies, IR and Raman intensities and potential energy distributions for hpa and K[CuHL2]�H2O. See http://www.rsc.org/suppdata/nj/b3/b307066m/","New Journal of Chemistry","2004","28","4","477","","10.1039/b307066m","","","0.71073","MoKα","","0.0507","0.0333","","","0.0836","0.0893","","","","","","0.977","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050146","15.018","0.0015","5.0236","0.0005","9.9426","0.0006","90","","106.549","0.005","90","","719.04","0.11","240","2","240","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","hexanoic acid","hexanoic acid","","- C6 H12 O2 -","- C6 H12 O2 -","- C24 H48 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.0732","0.0504","","","0.1253","0.1393","","","","","","1.053","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050147","16.0089","0.0015","5.0764","0.0004","10.1589","0.0007","90","","92.864","0.003","90","","824.56","0.12","230","2","230","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","heptanoic acid","heptanoic acid","","- C7 H14 O2 -","- C7 H14 O2 -","- C28 H56 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.101","0.0624","","","0.1569","0.1855","","","","","","1.045","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050148","18.6641","0.0011","4.9756","0.0003","9.5741","0.0005","90","","95.774","0.002","90","","884.59","0.09","170","2","170","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","octanoic acid","octanoic acid","","- C8 H16 O2 -","- C8 H16 O2 -","- C32 H64 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.0853","0.0701","","","0.186","0.1963","","","","","","1.156","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050149","21.113","0.0003","4.9188","0.0006","10.1177","0.0007","90","","93.778","0.007","90","","1048.45","0.15","270","2","270","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","nonanoic acid","nonanoic acid","","- C9 H18 O2 -","- C9 H18 O2 -","- C36 H72 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.1142","0.0719","","","0.1874","0.2205","","","","","","1.095","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050150","22.844","0.0016","4.9612","0.0003","9.3977","0.0006","90","","93.559","0.004","90","","1063.02","0.12","170","2","170","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","decanoic acid","decanoic acid","","- C10 H20 O2 -","- C10 H20 O2 -","- C40 H80 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.1261","0.0925","","","0.2108","0.235","","","","","","1.091","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050151","25.839","0.003","4.9123","0.0004","10.0285","0.0011","90","","99.01","0.003","90","","1257.2","0.2","300","2","300","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","undecanoic acid","undecanoic acid","","- C11 H22 O2 -","- C11 H22 O2 -","- C44 H88 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.1022","0.0714","","","0.183","0.2063","","","","","","1.103","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050152","27.563","0.002","4.9627","0.0003","9.5266","0.0006","90","","98.006","0.002","90","","1290.41","0.15","270","2","270","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","dodecanoic acid","dodecanoic acid","","- C12 H24 O2 -","- C12 H24 O2 -","- C48 H96 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.0881","0.0671","","","0.1621","0.1813","","","","","","1.186","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050153","59.88","0.002","4.9425","0.0002","9.8118","0.0005","90","","93.8","0.002","90","","2897.5","0.2","310","2","310","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","tridecanoic acid","tridecanoic acid","","- C13 H26 O2 -","- C13 H26 O2 -","- C104 H208 O16 -","8","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.0949","0.0597","","","0.1496","0.177","","","","","","1.079","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050154","31.559","0.003","4.9652","0.0005","9.426","0.0011","90","","94.432","0.004","90","","1472.6","0.3","270","2","270","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","tetradecanoic acid","tetradecanoic acid","","- C14 H28 O2 -","- C14 H28 O2 -","- C56 H112 O8 -","4","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.7107","MoKα","","0.0722","0.0564","","","0.142","0.1526","","","","","","1.12","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050155","69.258","0.003","4.9556","0.0002","9.7197","0.0004","90","","98.024","0.002","90","","3303.3","0.2","330","2","330","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","pentadecanoic acid","pentadecanoic acid","","- C15 H30 O2 -","- C15 H30 O2 -","- C120 H240 O16 -","8","1","","Bond, Andrew D.","On the crystal structures and melting point alternation of the n-alkyl carboxylic acidsElectronic supplementary information (ESI) available: crystallographic data for C6?C15 in tabular and .cif format, full details of temperature calibration and density measurement, packing coefficients and lattice binding energies, formal definitions of the orthogonal cells, details of all projections and measurements of all geometric parameters referred to in the text. See http://www.rsc.org/suppdata/nj/b3/b307208h/","New Journal of Chemistry","2004","28","1","104","","10.1039/b307208h","","","0.71073","MoKα","","0.1315","0.0697","","","0.1564","0.1889","","","","","","1.118","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050156","8.949","0.002","9.856","0.002","8.358","0.002","102.12","0.03","110.5","0.03","74.78","0.03","660.6","0.3","291","2","291","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H8 Ag N5 O4 -","- C12 H8 Ag N5 O4 -","- C24 H16 Ag2 N10 O8 -","2","1","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","199","10.1039/b307384j","","","0.71073","MoKα","","0.0529","0.0421","","0.0918","0.0884","","","","1.101","1.122","1.122","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050157","29.829","0.006","13.139","0.003","8.5558","0.0017","90","","105.95","0.03","90","","3224.1","1.3","291","2","291","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H28 Cu2 N4 O11 -","- C22 H22 Cu2 N4 O11 -","- C88 H88 Cu8 N16 O44 -","4","0.5","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.1342","0.0678","","","0.149","0.1692","","","","","","1.021","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050158","7.4061","0.0015","10.725","0.002","26.453","0.005","90","","96.11","0.03","90","","2089.2","0.7","291","2","291","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H22 Co N4 O10 S -","- C14 H19 Co N4 O10 S -","- C56 H76 Co4 N16 O40 S4 -","4","1","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.0885","0.0547","","","0.1232","0.134","","","","","","1.07","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050159","4.1122","0.0008","13.463","0.003","23.674","0.005","90","","91.69","0.03","90","","1310.1","0.5","291","2","291","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Cd I2 N8 O2 -","- C24 H16 Cd I2 N8 O2 -","- C48 H32 Cd2 I4 N16 O4 -","2","0.5","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.0783","0.0644","","0.185","0.1569","","","","1.127","1.138","1.138","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050160","7.9571","0.0016","8.674","0.0017","11.326","0.002","94.31","0.03","110.17","0.03","94.66","0.03","726.9","0.3","291","2","291","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H20 Mn N10 O4 S2 -","- C26 H20 Mn N10 O4 S2 -","- C26 H20 Mn N10 O4 S2 -","1","0.5","","Hou, Hongwei; Xie, Lixia; Li, Gang; Ge, Tiezhu; Fan, Yaoting; Zhu, Yu","Synthesis and crystal structures of a series of complexes based on a rigid angular ligand and the magnetic properties of the Cu(ii) polymer","New Journal of Chemistry","2004","28","2","191","","10.1039/b307384j","","","0.71073","MoKα","","0.069","0.0594","","","0.1722","0.1821","","","","","","1.043","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050163","27.3962","0.0016","27.3962","0.0016","12.6672","0.001","90","","90","","120","","8233.6","0.9","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C28 H58 N8 Ni O4 -","- C28 H58 N8 Ni O4 -","- C252 H522 N72 Ni9 O36 -","9","0.5","","Gülay Gümüş; Vefa Ahsen; Colette Lebrun; Dominique Luneau; Jacques Pécaut","Unprecedented tubular channels assemblies afforded by alkyl-substituted oxamide oxime metal complexes","New J. Chem.","2004","28","2","177","179","10.1039/b307783g","","","0.71073","MoKα","","0.0977","0.0534","","","0.1508","0.1702","","","","","","1.006","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050164","27.8737","0.0019","27.8737","0.0019","12.4102","0.0013","90","","90","","120","","8350.2","1.2","298","2","298","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C28 H58 N8 O4 Pd -","- C28 H58 N8 O4 Pd -","- C252 H522 N72 O36 Pd9 -","9","0.5","","Gülay Gümüş; Vefa Ahsen; Colette Lebrun; Dominique Luneau; Jacques Pécaut","Unprecedented tubular channels assemblies afforded by alkyl-substituted oxamide oxime metal complexes","New J. Chem.","2004","28","2","177","179","10.1039/b307783g","","","0.71073","MoKα","","0.1684","0.046","","","0.1049","0.1504","","","","","","0.651","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050165","13.353","0.0001","17.5779","0.0001","17.4987","0.0002","90","","99.3274","0.0003","90","","4052.95","0.06","173","1","173","1","","","","","","","see text","9","P 1 n 1","P -2yac","7","Dichlorobis(triphenylphosphine oxide)zinc(ii)","","","- C81 H77 F3 N3 O6 P4 Re Ru S -","- C81 H77 F3 N3 O6 P4 Re Ru S -","- C162 H154 F6 N6 O12 P8 Re2 Ru2 S2 -","2","1","","Fritz E. Kühn; Jing-Lin Zuo; Fabrizia Fabrizi de Biani; Ana M. Santos; Yanmei Zhang; Jin Zhao; Angela Sandulache; Eberhardt Herdtweck","4-Ethynylpyridine as bridging moiety in mixed Ru/Re complexes","New J. Chem.","2004","28","1","43","51","10.1039/b307919h","","","0.71073","MoKα","","0.0431","0.0396","","","0.1015","0.104","","","","","","1.031","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050166","15.3648","0.0013","14.4941","0.0014","16.7893","0.0011","90.013","0.006","91.015","0.006","89.99","0.007","3738.4","0.5","293","","293","","","","","","","","?","4","P 1 21/n 1","-P 2yn","14","","","","- C46 H42 N2 O6 -","- C46 H42 N2 O6 -","- C184 H168 N8 O24 -","4","1","","Miroslav Dudič; Pavel Lhoták; Ivan Stibor; Hana Petříčková; Kamil Lang","(Thia)calix[4]arene‒porphyrin conjugates: novel receptors for fullerene complexation with C70 over C60 selectivity","New J. Chem.","2004","28","1","85","90","10.1039/b307988k","","","1.5418","CuKα","","0.2382","0.0953","","0.1347","0.0818","0.0814","","","","","","1.1779","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050167","18.037","0.003","17.973","0.002","19.697","0.002","90.007","0.009","112.25","0.01","90","0.01","5909.9","1.4","293","","293","","","","","","","","?","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H68 N2 O7 S4 -","- C60 H68 N2 O7 S4 -","- C240 H272 N8 O28 S16 -","4","1","","Miroslav Dudič; Pavel Lhoták; Ivan Stibor; Hana Petříčková; Kamil Lang","(Thia)calix[4]arene‒porphyrin conjugates: novel receptors for fullerene complexation with C70 over C60 selectivity","New J. Chem.","2004","28","1","85","90","10.1039/b307988k","","","1.5418","CuKα","","0.3075","0.1133","","0.2003","0.1011","0.101","","","","","","1.1699","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050168","15.777","0.003","10.409","0.002","15.932","0.003","90","","114.05","0.03","90","","2389.3","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H20 Cl2 N4 Zn -","- C26 H20 Cl2 N4 Zn -","- C104 H80 Cl8 N16 Zn4 -","4","1","","Drew, Michael G. B.; Tocher, Derek A.; Chowdhury, Kiranmoy; Chowdhury, Shubhamoy; Datta, Dipankar","Zinc(ii) mediated synthesis of an N-substituted 2-(2-pyridyl)imidazole from a 1,2-diketone and 2-(aminomethyl)pyridine and its ligational behaviour","New Journal of Chemistry","2004","28","2","323","","10.1039/b308294f","","","0.71073","MoKα","","0.1102","0.0464","","0.3237","0.1135","","","","1.025","0.974","0.974","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050169","16.513","0.018","16.513","0.018","39.02","0.04","90","","90","","90","","10640","2","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C52.5 H42 Cl3 N8 O8.5 Zn -","- C52.5 H40 Cl3.02 N8 O8.5 Zn -","- C420 H320 Cl24.16 N64 O68 Zn8 -","8","1","","Drew, Michael G. B.; Tocher, Derek A.; Chowdhury, Kiranmoy; Chowdhury, Shubhamoy; Datta, Dipankar","Zinc(ii) mediated synthesis of an N-substituted 2-(2-pyridyl)imidazole from a 1,2-diketone and 2-(aminomethyl)pyridine and its ligational behaviour","New Journal of Chemistry","2004","28","2","323","","10.1039/b308294f","","","0.71073","MoKα","","0.1336","0.1177","","","0.2299","0.2402","","","","","","1.243","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050170","15.7601","0.0002","8.9331","0.0001","22.1109","0.0003","90","","90","","90","","3112.92","0.07","295","2","295","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C17 H12 Mn N2 O5 -","- C17 H12 Mn N2 O5 -","- C136 H96 Mn8 N16 O40 -","8","1","","Wang, Chih-Chieh; Lin, Hui-Wen; Yang, Cheng-Han; Liao, Chen-Hui; Lan, Ia-Ting; Lee, Gene-Hsiang","Synthesis and structure of a novel two-dimensional bilayer framework of a [M(C5O5)(dpe)] coordination polymer","New Journal of Chemistry","2004","28","2","180","","10.1039/b308379a","","","0.71073","MoKα","","0.0686","0.0393","","","0.0921","0.1114","","","","","","1.148","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050171","15.6685","0.0011","8.8628","0.0005","21.9418","0.0013","90","","90","","90","","3047","0.3","295","2","295","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C17 H12 Fe N2 O5 -","- C17 H12 Fe N2 O5 -","- C136 H96 Fe8 N16 O40 -","8","1","","Wang, Chih-Chieh; Lin, Hui-Wen; Yang, Cheng-Han; Liao, Chen-Hui; Lan, Ia-Ting; Lee, Gene-Hsiang","Synthesis and structure of a novel two-dimensional bilayer framework of a [M(C5O5)(dpe)] coordination polymer","New Journal of Chemistry","2004","28","2","180","","10.1039/b308379a","","","0.71073","MoKα","","0.0664","0.0481","","","0.1115","0.1202","","","","","","1.074","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050172","15.9401","0.0008","9.0137","0.0004","22.0831","0.0011","90","","90","","90","","3172.9","0.3","295","2","295","2","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C17 H12 Cd N2 O5 -","- C17 H12 Cd N2 O5 -","- C136 H96 Cd8 N16 O40 -","8","1","","Wang, Chih-Chieh; Lin, Hui-Wen; Yang, Cheng-Han; Liao, Chen-Hui; Lan, Ia-Ting; Lee, Gene-Hsiang","Synthesis and structure of a novel two-dimensional bilayer framework of a [M(C5O5)(dpe)] coordination polymer","New Journal of Chemistry","2004","28","2","180","","10.1039/b308379a","","","0.71073","MoKα","","0.0341","0.0272","","","0.0636","0.0668","","","","","","1.044","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050173","14.449","0.004","14.449","0.004","17.537","0.005","90","0.005","90","0.005","90","0.005","3661.3","1.8","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 O20 S8 Tb -","- C64 H68 Cl3 O20 S8 Tb -","- C128 H136 Cl6 O40 S16 Tb2 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0797","0.0651","","","0.1577","0.1709","","","","","","1.002","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050174","14.488","0.002","14.488","0.002","17.49","0.004","90","","90","","90","","3671.2","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 Eu O20 S8 -","- C64 H72 Cl3 Eu O20 S8 -","- C128 H144 Cl6 Eu2 O40 S16 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0712","0.0674","","","0.1685","0.1745","","","","","","1.001","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050175","14.469","0.002","14.469","0.002","17.509","0.004","90","","90","","90","","3665.5","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 Gd O20 S8 -","- C64 H72 Cl3 Gd O20 S8 -","- C128 H144 Cl6 Gd2 O40 S16 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0769","0.0707","","","0.1806","0.1902","","","","","","0.989","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050176","14.508","0.002","14.508","0.002","17.559","0.004","90","","90","","90","","3695.9","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 La O20 S8 -","- C64 H72 Cl3 La O20 S8 -","- C128 H144 Cl6 La2 O40 S16 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.1099","0.0873","","","0.2195","0.2432","","","","","","1.002","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050177","14.426","0.002","14.426","0.002","17.487","0.004","90","","90","","90","","3639.2","1.1","293","2","293","2","","","","","","","","6","I -4","I -4","82","","","","- C64 H72 Cl3 O20 S8 Yb -","- C64 H72 Cl3 O20 S8 Yb -","- C128 H144 Cl6 O40 S16 Yb2 -","2","0.25","","Li, Jian-Rong; Bu, Xian-He; Zhang, Ruo-Hua; Duan, Chun-Ying; Man-Chung Wong, Keith; Wing-Wah Yam, Vivian","Lanthanide perchlorate complexes with 1,4-bis(phenylsulfinyl)butane: structures and luminescent properties","New Journal of Chemistry","2004","28","2","261","","10.1039/b308473f","","","0.71073","MoKα","","0.0671","0.0669","","","0.1647","0.1651","","","","","","1.002","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050178","10.612","0.003","11.147","0.003","13.521","0.004","85.155","0.007","74.476","0.007","77.999","0.007","1506.7","0.7","566","2","566","2","","","","","","","","6","P -1","-P 1","2","","","","- C32 H31 F6 Fe2 N2 P -","- C32 H31 F6 Fe2 N2 P -","- C64 H62 F12 Fe4 N4 P2 -","2","1","","Carolina Manzur; César Zúñiga; Lorena Millán; Mauricio Fuentealba; Jose A. Mata; Jean-René Hamon; David Carrillo","Preparation, characterization and electrochemical and X-ray structural studies of new conjugated 1,1'-ferrocenediyl-ended [CpFe-arylhydrazone]+ salts","New J. Chem.","2004","28","1","134","144","10.1039/b308626g","","","0.71073","MoKα","","0.0949","0.0651","","","0.1192","0.1271","","","","","","1.174","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050179","12.573","0.0011","16.5448","0.0014","19.0521","0.0016","90","","90","","90","","3963.2","0.6","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","(1,1'-ferrocenedicarboxaldehyde-di((eta$5!-cyclopentadienyl) (eta$6!-4-methoxiphenylhydrazone)iron(ii)))hexaflurophosphate","{1,1'-ferrocenedicarboxaldehyde-di[(η^5^-cyclopentadienyl) (η^6^-4-methoxiphenylhydrazone)iron(II)]}hexaflurophosphate","","- C18 H18 F6 Fe1.5 N2 O P -","- C18 H18 F6 Fe1.5 N2 O P -","- C144 H144 F48 Fe12 N16 O8 P8 -","8","1","","Carolina Manzur; César Zúñiga; Lorena Millán; Mauricio Fuentealba; Jose A. Mata; Jean-René Hamon; David Carrillo","Preparation, characterization and electrochemical and X-ray structural studies of new conjugated 1,1'-ferrocenediyl-ended [CpFe-arylhydrazone]+ salts","New J. Chem.","2004","28","1","134","144","10.1039/b308626g","","","0.71073","MoKα","","0.1291","0.0442","","","0.0951","0.0991","","","","","","0.606","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050180","12.064","0.005","19.817","0.005","11.242","0.005","90.268","0.005","114.159","0.005","88.532","0.005","2451.4","1.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C54 H71 N O6 -","- C54 H47 N O6 -","- C108 H94 N2 O12 -","2","1","","Arena, Giuseppe; Contino, Annalinda; Longo, Elisa; Spoto, Giuseppe; Arduini, Arturo; Pochini, Andrea; Secchi, Andrea; Massera, Chiara; Ugozzoli, Franco","An integrated approach to the study of the recognition of guests containing CH3 and CH2 acidic groups by differently rigidified cone p-tert-butylcalix[4]arene derivativesElectronic supplementary information (ESI) available: experimental conditions used for calorimetric measurements. See http://www.rsc.org/suppdata/nj/b3/b308996g/","New Journal of Chemistry","2004","28","1","56","","10.1039/b308996g","","","0.71069","MoKα","","0.2354","0.0765","","","0.1853","0.198","","","","","","0.832","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050181","11.237","0.005","19.743","0.005","12.286","0.005","90","0.005","113.688","0.005","90","0.005","2496","1.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C54 H70 Cl N O6 -","- C54 H59 Cl0.99 N O6 -","- C108 H118 Cl1.98 N2 O12 -","2","1","","Arena, Giuseppe; Contino, Annalinda; Longo, Elisa; Spoto, Giuseppe; Arduini, Arturo; Pochini, Andrea; Secchi, Andrea; Massera, Chiara; Ugozzoli, Franco","An integrated approach to the study of the recognition of guests containing CH3 and CH2 acidic groups by differently rigidified cone p-tert-butylcalix[4]arene derivativesElectronic supplementary information (ESI) available: experimental conditions used for calorimetric measurements. See http://www.rsc.org/suppdata/nj/b3/b308996g/","New Journal of Chemistry","2004","28","1","56","","10.1039/b308996g","","","0.71069","MoKα","","0.1478","0.0977","","","0.283","0.3275","","","","","","1.116","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050182","19.892","0.005","19.296","0.005","12.102","0.005","90","0.005","90.69","0.005","90","0.005","4645","3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C52 H71 N O4 -","- C52 H71 N O4 -","- C208 H284 N4 O16 -","4","1","","Arena, Giuseppe; Contino, Annalinda; Longo, Elisa; Spoto, Giuseppe; Arduini, Arturo; Pochini, Andrea; Secchi, Andrea; Massera, Chiara; Ugozzoli, Franco","An integrated approach to the study of the recognition of guests containing CH3 and CH2 acidic groups by differently rigidified cone p-tert-butylcalix[4]arene derivativesElectronic supplementary information (ESI) available: experimental conditions used for calorimetric measurements. See http://www.rsc.org/suppdata/nj/b3/b308996g/","New Journal of Chemistry","2004","28","1","56","","10.1039/b308996g","","","1.54178","CuKα","","0.0581","0.0505","","","0.1735","0.1818","","","","","","1.472","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050183","13.644","0.003","14.574","0.005","17.816","0.004","90","","106.64","0.012","90","","3394.3","1.6","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 N4 O2 -","- C17.5 H22 N4 O2 -","- C140 H176 N32 O16 -","8","2","","Isabel Iriepa; F. Javier Villasante; Enrique Gálvez; Juana Bellanato; Avelino Martín; Pilar Gómez-Sal","Synthesis, spectroscopic and crystallographic study of some carbamates from an azabicyclic chloroformate and primary heterocyclic amines","New J. Chem.","2004","28","5","618","624","10.1039/b309065e","","","0.71069","MoKα","","0.227","0.0846","","","0.2287","0.3129","","","","","","0.971","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050184","21.8166","0.0004","7.3939","0.0001","21.5138","0.0003","90","","118.016","0.0007","90","","3063.72","0.08","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","Bis(2,6-bis(hydrazonomethyl)pyridine)copper(ii) diperchlorate bis-acetone solvate","Bis[2,6-bis{hydrazonomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H30 Cl2 Cu N10 O10 -","- C20 H30 Cl2 Cu N10 O10 -","- C80 H120 Cl8 Cu4 N40 O40 -","4","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0569","0.049","","","0.1317","0.1382","","","","","","1.061","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050185","7.1602","0.0001","13.2144","0.0003","17.3567","0.0003","107.677","0.0012","95.9665","0.0013","103.691","0.0008","1492.58","0.05","300","2","300","2","","","","","","","","6","P -1","-P 1","2","Bis(2,6-bis(oximomethyl)pyridine)copper(ii) diperchlorate bis- acetone solvate","Bis[2,6-bis{oximomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H26 Cl2 Cu N6 O14 -","- C20 H26 Cl2 Cu N6 O14 -","- C40 H52 Cl4 Cu2 N12 O28 -","2","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0852","0.0633","","","0.1782","0.1979","","","","","","1.039","","","","has coordinates,has disorder","180055","2020-10-21","18:00:00",""
"7050186","6.9012","0.0002","13.1087","0.0003","17.5759","0.0004","107.264","0.0016","94.6164","0.0016","105.298","0.001","1442.65","0.07","150","2","150","2","","","","","","","","6","P -1","-P 1","2","Bis(2,6-bis(oximomethyl)pyridine)copper(ii) diperchlorate bis- acetone solvate","Bis[2,6-bis{oximomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H26 Cl2 Cu N6 O14 -","- C20 H26 Cl2 Cu N6 O14 -","- C40 H52 Cl4 Cu2 N12 O28 -","2","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0457","0.037","","","0.0943","0.1003","","","","","","1.024","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050187","6.858","0.0002","13.063","0.0003","17.5689","0.0005","107.265","0.0014","94.1119","0.0011","105.66","0.001","1427.36","0.07","100","2","100","2","","","","","","","","6","P -1","-P 1","2","Bis(2,6-bis(oximomethyl)pyridine)copper(ii) diperchlorate bis- acetone solvate","Bis[2,6-bis{oximomethyl}pyridine]copper(II) diperchlorate bis-acetone solvate","","- C20 H26 Cl2 Cu N6 O14 -","- C20 H26 Cl2 Cu N6 O14 -","- C40 H52 Cl4 Cu2 N12 O28 -","2","1","","Halcrow, Malcolm A.; Kilner, Colin A.; Wolowska, Joanna; McInnes, Eric J. L.; Bridgeman, Adam J.","Temperature dependence of the electronic ground states of two mononuclear, six-coordinate copper(ii) centres","New Journal of Chemistry","2004","28","2","228","","10.1039/b309071j","","","0.71073","MoKα","","0.0504","0.0393","","","0.1066","0.114","","","","","","1.037","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050188","11.168","0.003","17.158","0.002","23.129","0.006","90","","96.68","0.02","90","","4401.9","1.7","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C52 H46 Cl0 N2 O4 P2 Rh -","- C52 H46 N2 O4 P2 Rh -","- C208 H184 N8 O16 P8 Rh4 -","4","1","","Acharyya, Rama; Basuli, Falguni; Rosair, Georgina; Bhattacharya, Samaresh","Synthesis, structure and electrochemical properties of some oxime complexes of rhodium","New Journal of Chemistry","2004","28","1","115","","10.1039/b309412j","","","0.71073","MoKα","","0.12","0.0578","","","0.1113","0.1347","","","","","","1.014","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050189","6.7072","0.0005","16.0387","0.0011","8.1083","0.0005","90","","91.16","0.004","90","","872.07","0.1","295","2","295","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C7 H7 N3 O4 -","- C7 H7 N3 O4 -","- C28 H28 N12 O16 -","4","1","","Graham, Duncan; Kennedy, Alan R.; McHugh, Callum J.; Smith, W. Ewen; David, William I. F.; Shankland, Kenneth; Shankland, Norman","The crystal structures of three primary products from the selective reduction of 2,4,6-trinitrotoluene","New Journal of Chemistry","2004","28","1","161","","10.1039/b309792g","","","0.71073","MoKα","","0.0859","0.0645","","","0.1689","0.1835","","","","","","1.1","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050190","8.0136","0.0003","8.0502","0.0003","14.2752","0.0005","75.097","0.002","74.059","0.002","78.453","0.002","847.35","0.05","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H7 N3 O4 -","- C7 H7 N3 O4 -","- C28 H28 N12 O16 -","4","2","","Graham, Duncan; Kennedy, Alan R.; McHugh, Callum J.; Smith, W. Ewen; David, William I. F.; Shankland, Kenneth; Shankland, Norman","The crystal structures of three primary products from the selective reduction of 2,4,6-trinitrotoluene","New Journal of Chemistry","2004","28","1","161","","10.1039/b309792g","","","0.71073","MoKα","","0.0711","0.0611","","","0.1794","0.1852","","","","","","1.122","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050191","15.098","0.0004","3.9219","0.0001","16.4446","0.0005","90","","116.586","0.002","90","","870.77","0.04","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H7 N3 O5 -","- C7 H7 N3 O5 -","- C28 H28 N12 O20 -","4","1","","Graham, Duncan; Kennedy, Alan R.; McHugh, Callum J.; Smith, W. Ewen; David, William I. F.; Shankland, Kenneth; Shankland, Norman","The crystal structures of three primary products from the selective reduction of 2,4,6-trinitrotoluene","New Journal of Chemistry","2004","28","1","161","","10.1039/b309792g","","","0.71073","MoKα","","0.0642","0.0417","","","0.1019","0.112","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050192","18.591","0.002","10.9955","0.0015","21.767","0.003","90","","100.15","0.014","90","","4379.9","1","273","2","273","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C28 H36 O12 -","- C28 H36 O12 -","- C168 H216 O72 -","6","0.75","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.1291","0.0697","","","0.2529","0.305","","","","","","0.934","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050193","10.5028","0.0015","12.5327","0.0014","12.1758","0.0015","90","","92.081","0.016","90","","1601.6","0.4","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H18 O4 S2 -","- C14 H18 O4 S2 -","- C56 H72 O16 S8 -","4","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.0513","0.0351","","","0.0894","0.0959","","","","","","0.993","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050194","6.7348","0.0015","7.0518","0.0015","11.256","0.002","75.3","0.03","73.98","0.03","71.04","0.03","478","0.2","213","2","213","2","","","","","","","","3","P -1","-P 1","2","","","","- C10 H10 O6 -","- C10 H10 O6 -","- C20 H20 O12 -","2","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.039","0.0311","","","0.0763","0.079","","","","","","0.956","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050195","19.461","0.003","5.7894","0.0007","32.412","0.006","90","","94.33","0.02","90","","3641.4","1","213","2","213","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H26 O6 -","- C18 H26 O6 -","- C144 H208 O48 -","8","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.075","0.0535","","","0.1245","0.1393","","","","","","1.058","","","","has coordinates","213973","2020-10-21","18:00:00",""
"7050196","8.694","0.002","9.24","0.003","9.899","0.003","110.1","0.03","98.04","0.03","98.76","0.03","722.1","0.4","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 Br2 O6 -","- C12 H12 Br2 O6 -","- C24 H24 Br4 O12 -","2","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.0715","0.058","","","0.1413","0.1481","","","","","","0.962","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050197","11.234","0.0013","7.4699","0.0011","20.184","0.002","90","","96.541","0.013","90","","1682.8","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H16 Br2 O6 -","- C14 H16 Br2 O6 -","- C56 H64 Br8 O24 -","4","1","","Bickley, Jamie; Bonar-Law, Richard; McGrath, Thomas; Singh, Nirmal; Steiner, Alexander","Dirhodium (ii) carboxylate complexes as building blocks. cis-Chelating dicarboxylic acids designed to bridge the dinuclear coreElectronic supplementary information (ESI) available: Tables S1 and S2. See http://www.rsc.org/suppdata/nj/b3/b310008a/","New Journal of Chemistry","2004","28","3","425","","10.1039/b310008a","","","0.71073","MoKα","","0.0424","0.0281","","","0.0598","0.0615","","","","","","0.797","","","","has coordinates,has disorder","213973","2020-10-21","18:00:00",""
"7050198","24.9759","0.0007","24.9758","0.0007","16.2578","0.00029","90","0.0005","90","0.0005","90","0.0005","10141.5","0.4","","","293","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","","- C20 H30 Br2 N4 O1.75 -","- C20 H30 Br2 N4 O1.75 -","- C320 H480 Br32 N64 O28 -","16","1","","Raphaël Tripier; Stéphanie Develay; Michel Le Baccon; Françoise Chuburu; François Michaud; Henri Handel","Self-assembly route from a bis-aminal derivative to a new cyclam based macropentacycle","New J. Chem.","2004","28","2","173","176","10.1039/b310074j","","","0.71073","MoK-alpha","","0.1022","0.0695","","0.2348","0.1947","","","","1.069","1.129","1.129","","","","","has coordinates","180055","2020-10-21","18:00:00",""
"7050199","9.369","0.002","16.409","0.002","16.632","0.002","90","","90","","90","","2556.9","0.7","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H10 Co4 O12 -","- C22 H10 Co4 O12 -","- C88 H40 Co16 O48 -","4","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0594","0.0439","","","0.0789","0.086","","","","","","1.043","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7050200","9.9757","0.0002","35.2755","0.0008","17.6562","0.0004","90","","106.167","0.009","90","","5967.5","0.4","180","2","180","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C68 H54 Co4 O8 P4 -","- C68 H54 Co4 O8 P4 -","- C272 H216 Co16 O32 P16 -","4","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71073","MoKα","","0.0595","0.0458","","0.271","0.0997","","","","1.131","1.148","1.148","","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050201","39.7446","0.0005","15.4562","0.0002","16.7757","0.0003","90","","91.171","0.001","90","","10303.2","0.3","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H32 Co4 O10 P2 -","- C45 H32 Co4 O10 P2 -","- C360 H256 Co32 O80 P16 -","8","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0842","0.0585","","","0.1882","0.2091","","","","","","1.048","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050202","40.5806","0.0005","11.9801","0.0002","36.1936","0.0005","90","","118.245","0.008","90","","15500.8","1.2","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C79.5 H70 Cl4 Co4 O10 P4 -","- C79.5 H68.5 Cl4 Co4 O10 P4 -","- C636 H548 Cl32 Co32 O80 P32 -","8","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0817","0.0578","","","0.1521","0.18","","","","","","1.044","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050203","12.465","0.0004","12.9587","0.0005","13.8733","0.0004","69.498","0.002","73.291","0.002","81.816","0.002","2008.22","0.12","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H28 Cl1.5 Co4 O13 S2 -","- C34 H28 Cl1.5 Co4 O13 S2 -","- C68 H56 Cl3 Co8 O26 S4 -","2","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.1009","0.0549","","","0.1278","0.1477","","","","","","1.046","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050204","11.3551","0.0001","13.8087","0.0002","23.8944","0.0003","73.855","0.002","80.77","0.002","82.12","0.002","3535.32","0.08","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C75 H70 Cl2 Co4 O8 P4 -","- C75 H70 Cl2 Co4 O8 P4 -","- C150 H140 Cl4 Co8 O16 P8 -","2","1","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0797","0.0564","","","0.1402","0.1543","","","","","","1.019","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050205","12.48","0.003","12.706","0.003","13.148","0.003","70.68","0.03","77.02","0.03","81.03","0.03","1909.6","0.9","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H40 Ga I2 N2 -","- C39 H47 Ga I2 N2 -","- C78 H94 Ga2 I4 N4 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0616","0.0512","","","0.1182","0.1252","","","","","","1.028","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050206","28.873","0.006","14.539","0.003","29.261","0.006","90","","101.29","0.03","90","","12046","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C96 H92 Ga6 I12 N24 O4 -","- C96 H88 Ga6 I12 N24 O4 -","- C384 H352 Ga24 I48 N96 O16 -","4","0.5","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0898","0.0569","","","0.1194","0.1319","","","","","","1.059","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050207","11","0.002","12.525","0.003","21.899","0.004","105.18","0.03","94.44","0.03","99.69","0.03","2846.8","1.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C50 H49 Ga2 I4 N13 O2 -","- C50 H47 Ga2 I4 N13 O2 -","- C100 H94 Ga4 I8 N26 O4 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0926","0.0553","","","0.1264","0.1446","","","","","","1.007","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050208","7.357","0.0015","13.306","0.003","13.759","0.003","99.44","0.03","97.59","0.03","102.53","0.03","1277.2","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H18 Ga I3 N4 -","- C23 H18 Ga I3 N4 -","- C46 H36 Ga2 I6 N8 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0801","0.045","","","0.0857","0.097","","","","","","1.04","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050209","22.813","0.005","14.364","0.003","17.672","0.004","90","","124.81","0.03","90","","4755","2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H44 Ga2 I4 N4 -","- C36 H44 Ga2 I4 N4 -","- C144 H176 Ga8 I16 N16 -","4","0.5","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0445","0.0325","","","0.0696","0.0736","","","","","","1.046","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050210","9.617","0.0019","14.831","0.003","10.14","0.002","90","","107.11","0.03","90","","1382.3","0.5","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 Ga2 I4 N4 -","- C20 H28 Ga2 I4 N4 -","- C40 H56 Ga4 I8 N8 -","2","0.5","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0326","0.029","","","0.0669","0.0683","","","","","","1.071","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050211","17.008","0.003","16.621","0.003","17.465","0.004","90","","90","","90","","4937.2","1.7","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C22 H30 Cl3 In N2 O -","- C22 H30 Cl3 In N2 O -","- C176 H240 Cl24 In8 N16 O8 -","8","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0795","0.0463","","","0.0884","0.0995","","","","","","1.022","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050212","10.285","0.002","13.001","0.003","16.458","0.003","76.95","0.03","86.76","0.03","81.91","0.03","2121.8","0.8","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H43 Ga2 I6 N3 -","- C33 H43 Ga2 I6 N3 -","- C66 H86 Ga4 I12 N6 -","2","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0807","0.0655","","","0.1652","0.1757","","","","","","1.083","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050213","21.246","0.004","17.803","0.004","11.048","0.002","90","","90","","90","","4178.8","1.4","150","2","150","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C38 H36 Ga I3 N10 -","- C38 H36 Ga I3 N10 -","- C152 H144 Ga4 I12 N40 -","4","1","","Baker, Robert J.; Jones, Cameron; Kloth, Marc; Mills, David P.","The reactivity of gallium(i) and indium(i) halides towards bipyridines, terpyridines, imino-substituted pyridines and bis(imino)acenaphthenes","New Journal of Chemistry","2004","28","2","207","","10.1039/b310592j","","","0.71073","MoKα","","0.0595","0.0484","","","0.1109","0.1174","","","","","","1.035","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050214","23.869","0.002","23.869","0.002","6.4684","0.0005","90","","90","","120","","3191.5","0.5","253","2","253","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C21 H12 Br3 N3 O3 -","- C21 H12 Br3 N3 O3 -","- C126 H72 Br18 N18 O18 -","6","0.333333","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0539","0.0343","","","0.056","0.0595","","","","","","0.9","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050215","5.9681","0.0004","13.6038","0.0012","16.0136","0.0013","111.029","0.009","91.527","0.009","96.39","0.01","1202.89","0.18","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C24.5 H3.5 Cl0.5 F15 N3 O3 -","- C24.502 H3.506 Cl0.498 F15 N3 O3 -","- C49.004 H7.012 Cl0.996 F30 N6 O6 -","2","1","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0612","0.0352","","","0.0824","0.0898","","","","","","0.87","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050216","5.9555","0.0005","13.5912","0.0012","16.1207","0.0014","111.055","0.01","91.871","0.01","95.776","0.01","1208.2","0.2","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H5 F15 N3 O3 -","- C25 H5 F15 N3 O3 -","- C50 H10 F30 N6 O6 -","2","1","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0665","0.0382","","","0.0904","0.098","","","","","","0.845","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050217","6.2648","0.0006","17.8465","0.0017","20.782","0.002","86.114","0.012","84.699","0.012","88.033","0.011","2307.3","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 Br3 F12 N3 O3 -","- C21 Br3 F12 N3 O3 -","- C84 Br12 F48 N12 O12 -","4","2","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0658","0.0406","","","0.0936","0.1004","","","","","","0.972","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050218","5.996","0.0005","26.565","0.0015","13.533","0.001","90","","99.315","0.009","90","","2127.2","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H0 F15 N3 O3 -","- C21 F15 N3 O3 -","- C84 F60 N12 O12 -","4","2","","Katharina Reichenbächer; Heike I. Süss; Helen Stoeckli-Evans; Silvia Bracco; Piero Sozzani; Edwin Weber; Jürg Hulliger","Modification of channel structures by fluorination","New J. Chem.","2004","28","3","393","397","10.1039/b311028a","","","0.71073","MoKα","","0.0457","0.0353","","","0.0813","0.085","","","","","","0.94","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050219","9.828","0.002","15.632","0.003","20.084","0.004","90","","90","","90","","3085.5","1.1","180","2","180","2","","","","","","","synthesis as described","6","P n m a","-P 2ac 2n","62","","Hexa(3-thienyl)cyclotriphosphazene","","- C25 H19 Cl3 N3 P3 S6 -","- C12.5 H9 Cl1.5 N1.5 P1.5 S3 -","- C100 H72 Cl12 N12 P12 S24 -","8","1","","Virginie Vicente; Alain Fruchier; Marc Taillefer; Corinne Combes-Chamalet; Ian J. Scowen; Françoise Plénat; Henri-Jean Cristau","Synthesis and structural studies (1H, 13C, 31P NMR and X-ray) of new C-bonded cyclotriphosphazenes with heterocyclic substituents from novel phosphinic acid derivatives","New J. Chem.","2004","28","3","418","424","10.1039/b311046j","","","0.71073","MoKα","","0.0479","0.0407","","","0.1031","0.1078","","","","","","1.051","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050220","11.277","0.0016","9.1335","0.001","13.561","0.002","90","","101.044","0.017","90","","1370.9","0.3","160","2","160","2","","","","","","","","5","P 1 21 1","P 2yb","4","","Hexa-2-thienylcyclotrphosphazene","","- C24 H18 N3 P3 S6 -","- C24 H18 N3 P3 S6 -","- C48 H36 N6 P6 S12 -","2","1","","Virginie Vicente; Alain Fruchier; Marc Taillefer; Corinne Combes-Chamalet; Ian J. Scowen; Françoise Plénat; Henri-Jean Cristau","Synthesis and structural studies (1H, 13C, 31P NMR and X-ray) of new C-bonded cyclotriphosphazenes with heterocyclic substituents from novel phosphinic acid derivatives","New J. Chem.","2004","28","3","418","424","10.1039/b311046j","","","0.71073","MoKα","","0.0284","0.0268","","","0.0712","0.0722","","","","","","1.045","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050221","19.42","0.002","15.7094","0.0016","20.428","0.004","90","","96.673","0.007","90","","6189.9","1.5","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C25 H13 Cl3 N3 P3 S6 -","- C25 H13 Cl3 N3 P3 S6 -","- C200 H104 Cl24 N24 P24 S48 -","8","1","","Virginie Vicente; Alain Fruchier; Marc Taillefer; Corinne Combes-Chamalet; Ian J. Scowen; Françoise Plénat; Henri-Jean Cristau","Synthesis and structural studies (1H, 13C, 31P NMR and X-ray) of new C-bonded cyclotriphosphazenes with heterocyclic substituents from novel phosphinic acid derivatives","New J. Chem.","2004","28","3","418","424","10.1039/b311046j","","","0.71073","MoKα","","0.122","0.0593","","","0.1099","0.1338","","","","","","0.994","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050222","12.487","0.004","17.799","0.005","20.803","0.006","113.601","0.004","91.155","0.005","91.297","0.005","4234","2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","Yb[6]PyNO","","","- C67 H95 N5 O49 S6 Yb2 -","- C67 H55 N5 O49 S6 Yb2 -","- C134 H110 N10 O98 S12 Yb4 -","2","1","","Atwood, Jerry L.; Dalgarno, Scott J.; Hardie, Michaele J.; Raston, Colin L.","Hydrogen-bonded arrays of a ytterbium(iii) p-sulfonatocalix[6]arene complex","New Journal of Chemistry","2004","28","2","326","","10.1039/b311288h","","","0.71073","MoKα","","0.0659","0.044","","","0.0999","0.1089","","","","","","1.028","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050223","10.7371","0.0017","14.083","0.003","17.183","0.003","90","","90","","90","","2598.3","0.8","293","2","293","2","","","","","","","","8","P c c n","-P 2ab 2ac","56","","","","- C20 H20 Cl4 F6 Fe N4 O2 P -","- C20 H18 Cl4 F6 Fe N4 O2 P -","- C80 H72 Cl16 F24 Fe4 N16 O8 P4 -","4","0.5","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.2513","0.0816","","","0.1574","0.2337","","","","","","0.933","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050224","10.4143","0.0019","13.959","0.003","16.933","0.005","90","","90","","90","","2461.6","1","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C20 H20 Cl5 Fe N4 O6 -","- C20 H20 Cl5 Fe N4 O6 -","- C80 H80 Cl20 Fe4 N16 O24 -","4","0.5","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.0737","0.0458","","","0.113","0.1248","","","","","","1.018","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050225","11.837","0.004","17.134","0.005","13.764","0.005","90","","113.08","0.02","90","","2568.1","1.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C22 H29 F6 Fe N4 O4.5 P -","- C22 F6 Fe N4 O4.5 P -","- C88 F24 Fe4 N16 O18 P4 -","4","1","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.2157","0.0954","","","0.2205","0.2952","","","","","","0.995","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050226","12.934","0.0004","16.76","0.0005","24.609","0.0009","89.859","0.0015","89.597","0.0017","83.111","0.0017","5295.9","0.3","110","2","110","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H42 Mn N5 O13 S -","- C52 H36.5 Mn N4.5 O11.5 S0.5 -","- C208 H146 Mn4 N18 O46 S2 -","4","2","","Shmilovits, Michaela; Vinodu, Mikki; Goldberg, Israel","Self-assembly patterns of porphyrins in crystals. Structures of hydrogen-bonding and coordination polymers of manganese tetra(carboxyphenyl)porphyrin","New Journal of Chemistry","2004","28","2","223","","10.1039/b312183f","","","0.71073","MoKα","","0.1329","0.0691","","","0.1652","0.1864","","","","","","1.045","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050227","13.691","0.0005","8.744","0.0003","20.593","0.0006","90","","91.695","0.002","90","","2464.19","0.14","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C51 H39.1 Mn N5 O11.55 -","- C48 H24 Mn N4 O10.55 -","- C96 H48 Mn2 N8 O21.1 -","2","0.5","","Shmilovits, Michaela; Vinodu, Mikki; Goldberg, Israel","Self-assembly patterns of porphyrins in crystals. Structures of hydrogen-bonding and coordination polymers of manganese tetra(carboxyphenyl)porphyrin","New Journal of Chemistry","2004","28","2","223","","10.1039/b312183f","","","0.71073","MoKα","","0.0796","0.0621","","","0.1773","0.1909","","","","","","1.046","","","","has coordinates,has disorder","180056","2020-10-21","18:00:00",""
"7050228","7.893","0.002","7.901","0.002","15.805","0.005","85.564","0.005","84.968","0.005","62.449","0.005","869.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 N2 O2 Se2 -","- C18 H16 N2 O2 Se2 -","- C36 H32 N4 O4 Se4 -","2","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.0904","0.0708","","","0.1774","0.187","","","","","","0.973","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050229","7.7728","0.0007","7.7691","0.0006","15.5568","0.0013","85.376","0.005","85.84","0.007","63.251","0.007","835.48","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 N2 O2 S2 -","- C18 H16 N2 O2 S2 -","- C36 H32 N4 O4 S4 -","2","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","1.54178","CuKα","","0.0323","0.0318","","","0.0825","0.0827","","","","","","1.18","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050230","5.6512","0.001","7.9702","0.0014","30.441","0.005","90","","90","","90","","1371.1","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N O S -","- C16 H15 N O S -","- C64 H60 N4 O4 S4 -","4","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.0314","0.0306","","","0.0807","0.0819","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050231","7.3118","0.0006","15.2642","0.0012","17.2559","0.0014","90","","90","","90","","1925.9","0.3","93","2","93","2","","","","","","","","6","P b n a","-P 2ac 2b","60","","","","- C9 H8 Br N O Se -","- C9 H8 Br N O Se -","- C72 H64 Br8 N8 O8 Se8 -","8","1","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazolineElectronic supplementary information (ESI) available: 77Se NMR spectrum of 14, molecular structure of 16 and packing diagram of 15. See http://www.rsc.org/suppdata/nj/b3/b312364b/","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.0605","0.0282","","","0.0515","0.0592","","","","","","0.967","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050232","15.416","0.003","17.917","0.003","7.8119","0.0012","90","","102.816","0.004","90","","2104","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 I N O Se -","- C9 H8 I N O Se -","- C72 H64 I8 N8 O8 Se8 -","8","2","","Kumar, Sangit; Kandasamy, Karuppasamy; Singh, Harkesh B.; Butcher, Ray J.","Synthesis of organochalcogens stabilized by intramolecular non-bonded interactions of sterically unhindered 2-phenyl-2-oxazoline","New Journal of Chemistry","2004","28","5","640","","10.1039/b312364b","","","0.71073","MoKα","","0.1363","0.0342","","","0.037","0.0456","","","","","","0.783","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050233","12.0601","0.0008","13.733","0.001","20.595","0.002","105.244","0.006","91.599","0.007","108.298","0.006","3101.8","0.5","173","","173","","","","","","","","Synthetic","4","P -1","-P 1","2","lid-shaped heptatitanate","(μ2-1,3-propanediolato(O,O'))-bis(μ4-oxo)-bis(μ3-oxo)-octakis(μ2-ethoxo)-decakis(ethoxy)-hepta-titanium","","- C39 H96 O24 Ti7 -","- C39 H96 O24 Ti7 -","- C78 H192 O48 Ti14 -","2","1","","Frédérique Biechel; Julien Dubuc; Marc Henry","General principles driving the chemical reactivity of titanium(IV) alkoxides","New J. Chem.","2004","28","6","764","769","10.1039/b312486j","","","0.71073","Mo-Kα","","0.148","0.051","","0.171","0.074","","","","3.45","1.39","1.39","","","","","has coordinates","194606","2020-10-21","18:00:00",""
"7050234","9.5168","0.0003","13.4861","0.0007","17.8842","0.0009","99.008","0.009","90.923","0.009","105.676","0.009","2178.6","0.2","173","","173","","","","","","","","Synthetic","4","P -1","-P 1","2","tentacular tetratitanate","(μ4-2,2-bis(hydroxymethyl)-1,3-propanediolato(O,O',O'',O'''))-tetrakis(μ2-ethoxo)-octakis(ethoxy)-tetra-titanium","","- C29 H68 O16 Ti4 -","- C29 H68 O16 Ti4 -","- C58 H136 O32 Ti8 -","2","1","","Frédérique Biechel; Julien Dubuc; Marc Henry","General principles driving the chemical reactivity of titanium(IV) alkoxides","New J. Chem.","2004","28","6","764","769","10.1039/b312486j","","","0.71073","Mo-Kα","","0.103","0.053","","0.119","","0.08","","","2.265","","","1.518","","","","has coordinates","194606","2020-10-21","18:00:00",""
"7050235","11.17","0.004","11.937","0.004","16.536","0.005","74.2","0.03","80.21","0.04","62.56","0.02","1880.3","1.2","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H39 Cl N3 O10 Re -","- C33 H39 Cl N3 O10 Re -","- C66 H78 Cl2 N6 O20 Re2 -","2","1","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0472","0.0371","","","0.0716","0.0743","","","","","","0.975","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050236","12.1864","0.0013","13.9338","0.0015","14.076","0.002","61.504","0.012","85.83","0.008","79.965","0.009","2068.3","0.5","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H15 Cl N3 O3 Re -","- C23 H15 Cl N3 O3 Re -","- C92 H60 Cl4 N12 O12 Re4 -","4","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0322","0.0259","","","0.0542","0.0561","","","","","","1.042","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050237","10.975","0.002","13.661","0.002","14.578","0.003","107.544","0.015","111.036","0.013","102.713","0.017","1808","0.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H12 Cl N4 O3 Re -","- C18 H12 Cl N4 O3 Re -","- C72 H48 Cl4 N16 O12 Re4 -","4","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.046","0.0322","","","0.0607","0.065","","","","","","0.999","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050238","11.125","0.004","14.259","0.004","14.454","0.006","98.149","0.015","111.39","0.02","112.669","0.015","1860.6","1.3","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H12 Cl N4 O3 Re -","- C18 H12 Cl N4 O3 Re -","- C72 H48 Cl4 N16 O12 Re4 -","4","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0702","0.0481","","","0.1067","0.1146","","","","","","0.951","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050239","9.1998","0.0015","21.486","0.004","21.451","0.004","90","","93.7","0.004","90","","4231.3","1.3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 Cl N4 O3 Re -","- C21 H18 Cl N4 O3 Re -","- C168 H144 Cl8 N32 O24 Re8 -","8","2","","Nail M. Shavaleev; Andrea Barbieri; Zöe R. Bell; Michael D. Ward; Francesco Barigelletti","New ligands in the 2,2'-dipyridylamine series and their Re(I) complexes; synthesis, structures and luminescence properties","New J. Chem.","2004","28","3","398","405","10.1039/b312647a","","","0.71073","MoKα","","0.0443","0.0274","","","0.0494","0.0534","","","","","","1.016","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050240","10.1741","0.0008","10.6139","0.0009","11.3542","0.0009","97.425","0.001","90.136","0.001","110.437","0.001","1137.81","0.16","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H28 N2 -","- C32 H28 N2 -","- C64 H56 N4 -","2","1","","Mateo Alajarín; Angel Vidal; María-Mar Ortín; Delia Bautista","Persistent radical effect in the intramolecular addition of benzylic radicals onto ketenimines: selective cross-coupling of α-(indol-2-yl)benzyl radicals with the 1-cyano-1-methylethyl radical","New J. Chem.","2004","28","5","570","577","10.1039/b312930f","","","0.71073","MoKα","","0.0442","0.0402","","","0.1033","0.1065","","","","","","1.021","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050241","7.646","0.001","21.303","0.002","12.505","0.001","90","","104.87","0.01","90","","1968.6","0.4","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 N2 -","- C26 H24 N2 -","- C104 H96 N8 -","4","1","","Mateo Alajarín; Angel Vidal; María-Mar Ortín; Delia Bautista","Persistent radical effect in the intramolecular addition of benzylic radicals onto ketenimines: selective cross-coupling of α-(indol-2-yl)benzyl radicals with the 1-cyano-1-methylethyl radical","New J. Chem.","2004","28","5","570","577","10.1039/b312930f","","","0.71073","MoKα","","0.0748","0.04","","0.0882","0.0804","","","","0.858","1.01","1.01","","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050242","18.3759","0.0004","25.4454","0.0008","8.74","0.0002","90","","97.257","0.002","90","","4053.93","0.18","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,7-bis-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-fluoren-9-one pyridine solvate","","- C53 H38 N2 O3 -","- C53 H38 N2 O3 -","- C212 H152 N8 O12 -","4","1","","Scott, Janet L.; Yamada, Tomohiko; Tanaka, Koichi","Guest specific solid-state fluorescence rationalised by reference to solid-state structures and specific intermolecular interactions","New Journal of Chemistry","2004","28","4","447","","10.1039/b312931d","","","0.71073","MoKα","","0.1746","0.0687","","","0.1377","0.1723","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050243","16.9301","0.0004","8.5045","0.0002","25.5885","0.0006","90","","92.569","0.001","90","","3680.58","0.15","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,7-bis-(3-hydroxy-3,3-diphenyl-prop-1-ynyl)-fluoren-9-one 3-acetylpyridine solvate","","- C50 H35 N O4 -","- C50 H35 N O4 -","- C200 H140 N4 O16 -","4","1","","Scott, Janet L.; Yamada, Tomohiko; Tanaka, Koichi","Guest specific solid-state fluorescence rationalised by reference to solid-state structures and specific intermolecular interactions","New Journal of Chemistry","2004","28","4","447","","10.1039/b312931d","","","0.71073","MoKα","","0.1821","0.0606","","","0.0974","0.1266","","","","","","0.962","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050246","9.3614","0.0012","9.8737","0.0012","24.449","0.004","90","","90.81","0.03","90","","2259.6","0.5","150","","150","","","","","","","","see text","7","P 1 21 1","P 2yb","4","","","","- C38 H60 Cl2 N8 O8 Ru S2 -","- C38 H60 Cl2 N8 O8 Ru S2 -","- C76 H120 Cl4 N16 O16 Ru2 S4 -","2","1","","Hotze, Anna C. G.; Kooijman, Huub; Spek, Anthony L.; Haasnoot, Jaap G.; Reedijk, Jan","Synthesis and characterization of ruthenium(ii) complexes with the new ligand 2-phenylazopyridine-5-sulfonic acid (Hsazpy): in search for new anticancer agents","New Journal of Chemistry","2004","28","5","565","","10.1039/b313746e","","x-ray","0.71073","MoKα","","0.0706","0.0577","","","0.1253","0.1348","","","","","","1.057","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050247","8.043","0.0003","11.427","0.0004","10.502","0.0005","90","","108.089","0.0017","90","","917.51","0.06","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","amidinium (2-hydroxyethoxy)acetate","","- C6 H14 N2 O4 -","- C6 H14 N2 O4 -","- C24 H56 N8 O16 -","4","1","","Ferretti, Valeria; Bertolasi, Valerio; Pretto, Loretta","Supramolecular aggregation by means of charge-assisted hydrogen bonds in acid-base adducts containing amidinium cations","New Journal of Chemistry","2004","28","5","646","","10.1039/b314143h","","","0.7107","MoKα","","0.0885","0.0476","","","0.1077","0.1388","","","","","","1.123","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050248","10.429","0.0004","7.727","0.0003","11.884","0.0006","90","","101.789","0.0014","90","","937.47","0.07","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","amidinium (2-hydroxyethoxy)acetate","","- C6 H14 N2 O4 -","- C6 H14 N2 O4 -","- C24 H56 N8 O16 -","4","1","","Ferretti, Valeria; Bertolasi, Valerio; Pretto, Loretta","Supramolecular aggregation by means of charge-assisted hydrogen bonds in acid-base adducts containing amidinium cations","New Journal of Chemistry","2004","28","5","646","","10.1039/b314143h","","","0.7107","MoKα","","0.0924","0.0465","","","0.1042","0.1343","","","","","","1.084","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050249","10.0507","0.0004","9.2132","0.0005","7.7953","0.0006","90","","90","","90","","721.84","0.07","293","","293","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Amidinium acetate","","- C4 H10 N2 O2 -","- C4 H10 N2 O2 -","- C16 H40 N8 O8 -","4","0.5","","Ferretti, Valeria; Bertolasi, Valerio; Pretto, Loretta","Supramolecular aggregation by means of charge-assisted hydrogen bonds in acid-base adducts containing amidinium cations","New Journal of Chemistry","2004","28","5","646","","10.1039/b314143h","","","0.7107","MoKα","","0.0745","0.0516","","","0.1486","0.171","","","","","","1.02","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050250","9.9117","0.0002","14.1651","0.0003","18.1568","0.0005","90","","90","","90","","2549.22","0.1","203","2","203","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","2,3-bis-fluoren-9-ylidene-succinic acid acetone solvate (1:1)","2,3-bis-fluoren-9-ylidene-succinic acid acetone solvate (1:1)","","- C33 H24 O5 -","- C33 H24 O5 -","- C132 H96 O20 -","4","1","","Tanaka, Koichi; Iwamoto, Toshimasa; Caira, Mino R.","Conglomerate and racemate formation of 2,3-bisfluoren-9-ylidenesuccinic acid by inclusion complexation with achiral guest molecules","New Journal of Chemistry","2004","28","3","329","","10.1039/b314192f","","","0.71073","MoKα","","0.0944","0.0545","","","0.122","0.1392","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050251","15.8893","0.0003","9.7361","0.0002","13.328","0.0002","90","","90","","90","","2061.84","0.07","203","2","203","2","","","","","","","","3","P b c n","-P 2n 2ab","60","2,3-bis-fluoren-9-ylidene-succinic acid","2,3-bis-fluoren-9-ylidene-succinic acid","","- C30 H18 O4 -","- C30 H18 O4 -","- C120 H72 O16 -","4","0.5","","Tanaka, Koichi; Iwamoto, Toshimasa; Caira, Mino R.","Conglomerate and racemate formation of 2,3-bisfluoren-9-ylidenesuccinic acid by inclusion complexation with achiral guest molecules","New Journal of Chemistry","2004","28","3","329","","10.1039/b314192f","","","0.71073","MoKα","","0.0518","0.0376","","","0.089","0.0949","","","","","","1.043","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050252","12.173","0.0001","12.3379","0.0002","17.7792","0.0002","90","","94.282","0.001","90","","2662.79","0.06","203","2","203","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,3-bis-fluoren-9-ylidene-succinic acid ethyl acetate solvate (1:1)","2,3-bis-fluoren-9-ylidene-succinic acid ethyl acetate solvate (1:1)","","- C34 H26 O6 -","- C34 H26 O6 -","- C136 H104 O24 -","4","1","","Tanaka, Koichi; Iwamoto, Toshimasa; Caira, Mino R.","Conglomerate and racemate formation of 2,3-bisfluoren-9-ylidenesuccinic acid by inclusion complexation with achiral guest molecules","New Journal of Chemistry","2004","28","3","329","","10.1039/b314192f","","","0.71073","MoKα","","0.06","0.039","","","0.0897","0.0978","","","","","","1.037","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050253","33.77","0.04","8.9","0.014","21.83","0.03","90","","128.805","0.01","90","","5113","12","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 La N6 O14.5 -","- C19 H11 La N6 O14.5 -","- C152 H88 La8 N48 O116 -","8","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.1242","0.0784","","","0.2119","0.2361","","","","","","1.069","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050254","9.094","0.013","9.561","0.013","15.038","0.017","98.736","0.01","100.343","0.01","93.335","0.01","1266","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 N7 Nd O11 -","- C21 H14 N7 Nd O11 -","- C42 H28 N14 Nd2 O22 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.1796","0.0851","","","0.2113","0.2579","","","","","","0.977","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050255","8.769","0.012","9.483","0.012","15.525","0.017","99.735","0.01","98.239","0.01","93.805","0.01","1254","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 N7 O11 Pr -","- C21 H14 N7 O11 Pr -","- C42 H28 N14 O22 Pr2 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.0531","0.0458","","","0.1487","0.1644","","","","","","0.961","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050256","8.618","0.009","9.458","0.012","15.445","0.017","100.457","0.01","97.727","0.01","94.181","0.01","1221","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H14 Er N7 O11 -","- C21 H14 Er N7 O11 -","- C42 H28 Er2 N14 O22 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.0577","0.0454","","","0.1281","0.1392","","","","","","0.966","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050257","10.533","0.014","10.68","0.014","17.12","0.02","86.069","0.01","79.225","0.01","82.233","0.01","1873","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H24 Eu N9 O13 -","- C39 H22 Eu N9 O13 -","- C78 H44 Eu2 N18 O26 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.1679","0.1076","","","0.3053","0.3331","","","","","","1.086","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050258","10.527","0.014","10.643","0.014","17.09","0.02","86.191","0.01","79.141","0.01","82.187","0.01","1861","4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H24 Gd N9 O13 -","- C39 H22 Gd N9 O13 -","- C78 H44 Gd2 N18 O26 -","2","1","","Drew, Michael G. B.; Hill, Clement; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Vaillant, Ludovic; Youngs, Tristan G. A.","Separation of lanthanides and actinides(iii) using tridentate benzimidazole, benzoxazole and benzothiazole ligands","New Journal of Chemistry","2004","28","4","462","","10.1039/b314321j","","","0.71073","MoKα","","0.0972","0.0706","","","0.1961","0.2218","","","","","","0.94","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050259","7.536","0.002","12.597","0.003","14.629","0.004","90","","99.77","0.02","90","","1368.6","0.6","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Cu(Medpt)(N3)](ClO4)","","","- C7 H19 Cl Cu N6 O4 -","- C7 H19 Cl Cu N6 O4 -","- C28 H76 Cl4 Cu4 N24 O16 -","4","1","","Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente","Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour","New J. Chem.","2004","28","6","681","686","10.1039/b314526c","","","0.71069","MoKα","","0.0508","0.0387","","0.1014","0.0916","","","","1.08","1.099","1.099","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050260","8.524","0.006","8.78","0.004","11.32","0.006","71.79","0.05","68.88","0.06","63.2","0.05","693.9","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H30 Cl2 Cu2 N12 O8 -","- C10 H30 Cl2 Cu2 N12 O8 -","- C10 H30 Cl2 Cu2 N12 O8 -","1","0.5","","Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente","Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour","New J. Chem.","2004","28","6","681","686","10.1039/b314526c","","","0.71069","MoKα","","0.0788","0.0654","","0.1907","0.1587","","","","1.076","1.089","1.089","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050261","23.638","0.002","11.011","0.002","13.924","0.002","90","","104.65","0.02","90","","3506.3","0.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H50 Cl2 Cu2 N12 O8 -","- C20 H50 Cl2 Cu2 N12 O8 -","- C80 H200 Cl8 Cu8 N48 O32 -","4","0.5","","Albert Escuer; Mercè Font-Bardía; Salah S. Massoud; Franz A. Mautner; Evaristo Peñalba; Xavier Solans; Ramon Vicente","Three new dinuclear copper(II) complexes with [Cu(μ1,3-N3)2Cu]2+ and [Cu(μ1,1-N3)2Cu]2+ asymmetrical cores: syntheses, structures and magnetic behaviour","New J. Chem.","2004","28","6","681","686","10.1039/b314526c","","","0.71069","MoKα","","0.0587","0.0455","","0.2011","0.1186","","","","0.915","0.912","0.912","","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050268","14.6951","0.0012","14.6951","0.0012","12.813","0.002","90","","90","","120","","2396.2","0.5","120","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","catena-(octakis(μ ~3~-hydroxo)-tris((μ ~2~-oxalato-O,O') -(piperazine-N,N'))-hepta-nickel)","","- C18 H38 N6 Ni7 O20 -","- C18 H38 N6 Ni7 O20 -","- C54 H114 N18 Ni21 O60 -","3","0.166667","","Keene, Tony D.; Hursthouse, Michael B.; Price, Daniel J.","Ferromagnetic coupling in a heptanuclear nickel cluster with a vertex-shared dicubane structure","New Journal of Chemistry","2004","28","5","558","","10.1039/b315323a","","","0.71073","MoKα","","0.1032","0.0575","","","0.1164","0.1318","","","","","","1.033","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050269","7.4613","0.0003","8.9753","0.0004","17.5018","0.0009","90","","90","","90","","1172.05","0.09","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.03","0.0274","","","0.0781","0.0807","","","","","","1.085","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050270","7.4667","0.0003","8.9827","0.0003","17.5438","0.0006","90","","90","","90","","1176.68","0.07","200","2","200","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0306","0.0277","","","0.0797","0.0829","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050271","23.052","0.007","8.9826","0.0008","12.684","0.003","90","","107.504","0.012","90","","2504.8","1","298","2","298","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C30 H26 Mn N2 O4 -","- C30 H26 Mn N2 O4 -","- C120 H104 Mn4 N8 O16 -","4","1","","Pradeep, Chullikkattil P.; Htwe, Tin; Zacharias, Panthapally S.; Das, Samar K.","First structurally characterized optically active mononuclear Mn(iv) complex: synthesis, crystal structure and properties of [MnivL2] {H2L?=?S-(?)-2-[(2-hydroxy-1-phenylethylimino)methyl]phenol}Electronic supplementary information (ESI) available: GC analysis of the styrene epoxidation; 1H NMR spectrum of (E)-stilbene oxide produced by the epoxidation of (E)-stilbene. See http://www.rsc.org/suppdata/nj/b3/b315658c/","New Journal of Chemistry","2004","28","6","735","","10.1039/b315658c","","","0.71073","MoKα","","0.0253","0.0236","","","0.0622","0.0633","","","","","","1.073","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050272","27.863","0.0005","11.4857","0.0002","7.5182","0.0001","90","","93.915","0.001","90","","2400.41","0.07","200","2","200","2","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H26 N8 O5 -","- C24 H26 N8 O5 -","- C96 H104 N32 O20 -","4","1","","Carmen Alvarez-Rua; Santiago García-Granda; Shyamaprosad Goswami; Reshmi Mukherjee; Swapan Dey; Rosa M. Claramunt; M. Dolores Santa María; Isabel Rozas; Nadine Jagerovic; Ibon Alkorta; José Elguero","Multiple hydrogen bonds and tautomerism in naphthyridine derivatives","New J. Chem.","2004","28","6","700","707","10.1039/b315692c","","","1.5418","CuKα","","0.0697","0.0461","","","0.1221","0.1647","","","","","","0.962","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050273","19.001","0.003","25.829","0.008","7.844","0.002","90","","90","","90","","3849.7","1.7","293","2","293","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C10 H10 N4 O -","- C10 H10 N4 O -","- C160 H160 N64 O16 -","16","1","","Carmen Alvarez-Rua; Santiago García-Granda; Shyamaprosad Goswami; Reshmi Mukherjee; Swapan Dey; Rosa M. Claramunt; M. Dolores Santa María; Isabel Rozas; Nadine Jagerovic; Ibon Alkorta; José Elguero","Multiple hydrogen bonds and tautomerism in naphthyridine derivatives","New J. Chem.","2004","28","6","700","707","10.1039/b315692c","","","1.5418","CuKα","","0.085","0.0482","","","0.0994","0.1184","","","","","","0.95","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050284","38.6254","0.0007","12.3153","0.0002","21.5662","0.0005","90","","101.392","0.0007","90","","10056.6","0.3","173","","173","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C60 H144 Cl8 O4 Si8 Sn8 -","- C60 H144 Cl8 O4 Si8 Sn8 -","- C240 H576 Cl32 O16 Si32 Sn32 -","4","0.5","","Jens Beckmann; Dainis Dakternieks; Andrew Duthie; Fong Sheen Kuan; Klaus Jurkschat; Markus Schürman; Edward R. T. Tiekink","Synthesis and structures of new oligomethylene-bridged double ladders. How far can the layers be separated?","New J.Chem.(Nouv.J.Chim.)","2004","28","","1268","1276","10.1039/b316009b","","","0.71073","MoKα","","0.128","0.046","","","0.051","0.063","","","","","","0.88","","","","has coordinates","180056","2020-10-21","18:00:00",""
"7050300","10.5172","0.0005","13.5574","0.0006","14.6025","0.0007","117.086","0.001","95.729","0.001","103.286","0.001","1753.19","0.14","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C39 H33 N6 O6 Ru -","- C39 H33 N6 O6 Ru -","- C78 H66 N12 O12 Ru2 -","2","1","","Das, Anindya; Peng, Shie-Ming; Lee, Gene-Hsiang; Bhattacharya, Samaresh","Synthesis, structure and electrochemical properties of a group of ruthenium(iii) complexes of N-(aryl)picolinamide","New Journal of Chemistry","2004","28","6","712","","10.1039/b317018g","","","0.71073","MoKα","","0.0368","0.0323","","","0.082","0.0844","","","","","","1.086","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050301","8.043","0.001","15.116","0.0012","8.934","0.0011","90","","96.65","0.012","90","","1078.9","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5-dimethylpyrazole 1:1 adduct with phenol","","- C11 H14 N2 O -","- C11 H14 N2 O -","- C44 H56 N8 O4 -","4","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0787","0.036","","","0.09","0.1033","","","","","","1","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050302","11.901","0.002","9.9022","0.0019","18.667","0.004","90","","90","","90","","2199.8","0.7","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,5-dimetylpyrazole 1:1 adduct with hydroquinone","","- C11 H14 N2 O2 -","- C11 H14 N2 O2 -","- C88 H112 N16 O16 -","8","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0444","0.0362","","","0.0912","0.096","","","","","","1.023","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050303","19.065","0.002","14.725","0.002","8.583","0.001","90","","114.8","0.02","90","","2187.3","0.6","223","2","223","2","","","","","","","","4","C 1 c 1","C -2yc","9","","3,3',5,5'-tetramethyl-4,4'-bipyrazole 1:2 adduct with phenol","","- C22 H26 N4 O2 -","- C22 H26 N4 O2 -","- C88 H104 N16 O8 -","4","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0481","0.0426","","","0.1196","0.1258","","","","","","1.036","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050304","7.3717","0.0007","14.1921","0.0014","16.4357","0.0016","98.782","0.002","94.46","0.002","103.055","0.002","1644.1","0.3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","3,3',5,5'-tetramethyl-4,4'-bipyrazole 1:1 adduct with hydroquinone","","- C16 H20 N4 O2 -","- C16 H20 N4 O2 -","- C64 H80 N16 O8 -","4","2","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0891","0.0512","","","0.1345","0.1514","","","","","","0.946","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050305","18.27","0.003","8.5281","0.0011","21.054","0.004","90","","90","","90","","3280.4","0.9","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3,3',5,5'-Tetramethyl-4,4'-bipyrazolyl 1:1 complex with Resorcinol","","- C16 H20 N4 O2 -","- C16 H20 N4 O2 -","- C128 H160 N32 O16 -","8","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0724","0.0492","","","0.1277","0.1405","","","","","","1.086","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050306","29.564","0.003","46.197","0.006","8.5541","0.001","90","","90","","90","","11683","2","223","2","223","2","","","","","","","","4","F d d 2","F 2 -2d","43","","3,3',5,5'-Tetramethyl-4,4'-bipyrazolyl 2:1 adduct with Floroglucine, Monohydrate","","- C26 H36 N8 O4 -","- C26 H36 N8 O4 -","- C416 H576 N128 O64 -","16","1","","Boldog, Ishtvan; Rusanov, Eduard B.; Sieler, Joachim; Domasevitch, Konstantin V.","Cooperative association of pyrazoles and phenols: A versatile binary systemElectronic supplementary information (ESI) available: Details for crystal structure determination and refinement and geometry of hydrogen bonding in structures. See http://www.rsc.org/suppdata/nj/b3/b317104c/","New Journal of Chemistry","2004","28","6","756","","10.1039/b317104c","","","0.71073","MoKα","","0.0549","0.0432","","","0.1057","0.111","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050307","20.736","0.004","15.807","0.003","16.385","0.003","90","","116.93","0.03","90","","4788","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C52 H64 N16 O4 -","- C52 H60 N16 O4 -","- C208 H240 N64 O16 -","4","0.5","","Liu, Simin; Wu, Xiaojun; Zhang, Shiwei; Yao, Junhua; Liang, Feng; Wu, Chengtai","Facile synthesis of novel macrocyclic polyamines derived from diphenylglycolurilElectronic supplementary information (ESI) available: ESI mass spectra of 5a, 6, alone and with added Ni(CH3COO)2, and 7. See http://www.rsc.org/suppdata/nj/b4/b400123k/","New Journal of Chemistry","2004","28","5","562","","10.1039/b400123k","","","0.71073","MoKα","","0.1268","0.0579","","","0.1435","0.1615","","","","","","0.835","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050308","10.4525","0.0004","13.0911","0.0005","17.7535","0.0006","81.517","0.001","78.849","0.002","70.818","0.001","2241.84","0.14","120","2","120","2","","","","","","","","7","P -1","-P 1","2","[Br(PPh3)(Py)Pd]2","Bromo(triphenylposphine)(2-pyridine)Paladium dimer","","- C51.5 H41.5 Br2 F N2.5 P2 Pd2 -","- C51.5 H41.5 Br2 F N2.5 P2 Pd2 -","- C103 H83 Br4 F2 N5 P4 Pd4 -","2","1","","Andrew Beeby; Sylvia Bettington; Ian J. S. Fairlamb; Andrés E. Goeta; Anant R. Kapdi; Elina H. Niemelä; Amber L. Thompson","A new precatalyst for the Suzuki reaction—a pyridyl-bridged dinuclear palladium complex as a source of mono-ligated palladium(0)","New J. Chem.","2004","28","5","600","605","10.1039/b401077a","","","0.71073","MoKα","","0.068","0.0431","","","0.0898","0.1002","","","","","","1.035","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050309","11.571","0.002","11.724","0.002","14.461","0.002","90","","90","","90","","1961.8","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-Methyl-2,4-dibromo-piridinium iodide","","- C6 H6 Br2 I N -","- C6 H6 Br2 I N -","- C48 H48 Br16 I8 N8 -","8","1","","Logothetis, Thomas A.; Meyer, Franck; Metrangolo, Pierangelo; Pilati, Tullio; Resnati, Giuseppe","Crystal engineering of brominated tectons: N-methyl-3,5-dibromo-pyridinium iodide gives particularly short C?Br?I halogen bondingElectronic supplementary information (ESI) available: rotatable 3D versions of Fig. 1 and Fig. 3. See http://www.rsc.org/suppdata/nj/b4/b401421a/","New Journal of Chemistry","2004","28","6","760","","10.1039/b401421a","","","0.71073","MoKα","","0.0399","0.027","","","0.0679","0.0736","","","","","","1.039","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050310","12.4208","0.0009","12.684","0.0012","14.2246","0.0015","97.844","0.005","115.241","0.005","104.18","0.005","1889.7","0.3","120","2","120","2","","","","","","","","6","P -1","-P 1","2","gyefebh","","","- C86 H96 B2 Fe2 O4 P6 -","- C96.5 H84 B Fe2 P6 -","- C96.5 H84 B Fe2 P6 -","1","0.5","","Guilera, Gemma; Sean McGrady, G.; Steed, Jonathan W.; Kaltsoyannis, Nikolas","Expanding metallaborane chemistry: an octahedral BH6 moiety supported through M?H?B bridges","New Journal of Chemistry","2004","28","4","444","","10.1039/b401442c","","","0.71073","MoKα","","0.1704","0.1341","","","0.2043","0.2147","","","","","","1.318","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050315","7.5335","0.0011","7.5335","0.0011","71.976","0.014","90","","90","","90","","4084.9","1.2","173","2","173","2","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C21 H26 Cl N O6 -","- C21 H26 Cl N O6 -","- C168 H208 Cl8 N8 O48 -","8","1","","John Smith; Elizabeth Balchin; Mike Bearpark; Anthony J. Horsewill; D. Malcolme-Lawes; M.Rowe; Jonathan Steed; David Stephenson; Weimin Wu","The Unusual Solid State Structure of Heroin Hydrochloride Monohydrate and its Selective Detection Using NQR Spectroscopy.","New J.Chem.(Nouv.J.Chim.)","2004","28","","1309","1314","10.1039/b401797h","","","0.71073","MoKα","","0.2057","0.0778","","","0.0943","0.1267","","","","","","1","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050316","7.1111","0.0012","7.8561","0.0013","9.031","0.0016","75.614","0.003","68.57","0.004","76.107","0.004","448.63","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H9 Co N O7 -","- C7 H5 Co N O7 -","- C14 H10 Co2 N2 O14 -","2","1","","Jingyang Niu; Dong-jie Guo; Jingping Wang; Jun-wei Zhao","Controlled assembly of polyoxometalate-based composite materials containing zero- and one-dimensional structures","New J.Chem.(Nouv.J.Chim.)","2004","28","","980","987","10.1039/b401769b","","","0.71073","MoKα","","0.118","0.0889","","","0.2229","0.2615","","","","","","1.022","","","","has coordinates","130149","2020-10-21","18:00:00",""
"7050317","16.9596","0.0004","8.8949","0.0002","11.6793","0.0003","90","","94.87","0.03","90","","1755.51","0.07","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,4,7,10-tetraazacyclododecane-dihydrogenbromide-dihydrate","1,4,7,10-tetraazacyclododecane-dihydrogenbromide-dihydrate","","- C8 H28 Br4 N4 O2 -","- C8 H26 Br4 N4 O2 -","- C32 H104 Br16 N16 O8 -","4","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0724","0.0447","","","0.1029","0.1134","","","","","","0.98","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050318","25.4408","0.0004","8.0708","0.0003","16.7769","0.0002","90","","103.915","0.001","90","","3343.67","0.14","123","2","123","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,4,7,10-tetraazacyclododecane-dihydrogentriiodide-diiodine-diacetonitrile","1,4,7,10-tetraazacyclododecane-dihydrogentriiodide-diiodine-diacetonitrile","","- C12 H28 I10 N6 -","- C12 H28 I10 N6 -","- C48 H112 I40 N24 -","4","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0672","0.0428","","","0.0927","0.1032","","","","","","1.019","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050319","7.2793","0.0002","8.0716","0.0003","11.4099","0.0003","87.859","0.002","77.59","0.002","88.234","0.001","654.1","0.03","123","2","123","2","","","","","","","","5","P -1","-P 1","2","1,4,7,10,13,16-hexaazacyclooctadecane-hexahydrogenchloride- tetrahydrate","1,4,7,10,13,16-hexaazacyclooctadecane-hexahydrogenchloride-tetrahydrate","","- C12 H44 Cl6 N6 O4 -","- C12 H44 Cl6 N6 O4 -","- C12 H44 Cl6 N6 O4 -","1","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0855","0.0472","","","0.0873","0.1005","","","","","","0.973","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050320","21.5782","0.0001","6.2908","0.0005","17.4204","0.0006","90","","90","","90","","2364.7","0.2","123","2","123","2","","","","","","","","5","P n a 21","P 2c -2n","33","1,4,7,10,13,16-hexaazacyclooctadecane-tetrahydrogenbromide- dihydrate","1,4,7,10,13,16-hexaazacyclooctadecane-tetrahydrogenbromide-dihydrate","","- C12 H38 Br4 N6 O2 -","- C12 H33 Br4 N6 O2 -","- C48 H132 Br16 N24 O8 -","4","1","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0881","0.0628","","","0.1499","0.1631","","","","","","1.015","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050321","8.1626","0.0002","22.7532","0.0005","8.2545","0.0002","90","","92.97","0.001","90","","1531.01","0.06","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,4,7,10,13,16-hexaazacyclooctadecane-dihydrogentriiodide- dihydrogeniodide","1,4,7,10,13,16-hexaazacyclooctadecane-dihydrogentriiodide-dihydrogeniodide","","- C12 H34 I8 N6 -","- C12 H34 I8 N6 -","- C24 H68 I16 N12 -","2","0.5","","Warden, Andrew C.; Warren, Mark; Spiccia, Leone; Hearn, Milton T. W.","Anion Binding to Azamacrocycles: Synthesis and X-ray Crystal Structures of Halide Adducts of [12]aneN~4~ and [18]aneN~6~","New Journal of Chemistry","2004","28","9","1160","1167","10.1039/B401841A","","","0.71073","MoKα","","0.0602","0.0452","","","0.1092","0.1177","","","","","","1.03","","","","has coordinates","190835","2020-10-21","18:00:00",""
"7050322","9.059","0.001","7.515","0.001","12.102","0.004","90","","92.33","0.01","90","","823.2","0.3","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,5-dimethyl-3,6-bis-phenylethynylpyrazine","","","- C22 H16 N2 -","- C22 H16 N2 -","- C44 H32 N4 -","2","0.5","","Zhao, Liang; Perepichka, Igor F.; Türksoy, Figen; Batsanov, Andrei S.; Beeby, Andrew; Findlay, Karen S.; Bryce, Martin R.","2,5-Di(aryleneethynyl)pyrazine derivatives: synthesis, structural and optoelectronic properties, and light-emitting device","New Journal of Chemistry","2004","28","8","912","918","10.1039/B401867M","","","0.71073","MoKα","","0.0514","0.0383","","","0.1049","0.1145","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7050356","8.7294","0.0007","12.1861","0.001","15.3426","0.0012","72.435","0.001","79.668","0.001","89.855","0.002","1528.5","0.2","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H27 Cu N11 O S2 -","- C25 H27 Cu N11 O S2 -","- C50 H54 Cu2 N22 O2 S4 -","2","1","","Ray, Umasankar; Banerjee, Debasis; Mostafa, Golam; Lu, Tian-Huey; Sinha, Chittaranjan","Copper coordination compounds of chelating imidazole-azo-aryl ligand. The molecular structures of bis[1-ethyl-2-(p-tolylazo)imidazole]-bis-(azido)copper(ii) and bis[1-methyl-2-(phenylazo)imidazole]-bis(thiocyanato)copper(ii)","New Journal of Chemistry","2004","28","12","1437","","10.1039/b406445c","","","0.71073","MoK\α","","0.0839","0.0474","","","0.1369","0.1529","","","","","","0.892","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050357","11.8632","0.0008","17.6782","0.0013","26.703","0.002","90","","90","","90","","5600.2","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C24 H28 Cu N14 -","- C24 H28 Cu N14 -","- C192 H224 Cu8 N112 -","8","1","","Ray, Umasankar; Banerjee, Debasis; Mostafa, Golam; Lu, Tian-Huey; Sinha, Chittaranjan","Copper coordination compounds of chelating imidazole-azo-aryl ligand. The molecular structures of bis[1-ethyl-2-(p-tolylazo)imidazole]-bis-(azido)copper(ii) and bis[1-methyl-2-(phenylazo)imidazole]-bis(thiocyanato)copper(ii)","New Journal of Chemistry","2004","28","12","1437","","10.1039/b406445c","","","0.71073","MoK\α","","0.1149","0.0546","","","0.1076","0.1249","","","","","","0.992","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050370","9.63","0.002","21.727","0.004","17.275","0.003","90","","96.69","0.001","90","","3589.9","1.2","120","","120","","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H44 N3 O21 P4 Sm -","- C18 H44 N3 O21 P4 Sm -","- C72 H176 N12 O84 P16 Sm4 -","4","0.5","","Lees, Anthony M. J.; Kresinski, Roman A.; Platt, Andrew W. G.","Complexes of (EtO)2P(O)CH2P(O)(OEt)2 with lanthanide nitrates","New Journal of Chemistry","2004","28","12","1457","","10.1039/b408536a","","x-ray","0.71073","MoKα","","0.0448","0.0429","","","0.1153","0.1159","","","","","","1.352","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7050371","8.8205","0.0011","20.0885","0.0006","20.63","0.0014","90","","91.716","0.016","90","","3653.8","0.5","0","","293","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H44 La N3 O21 P4 -","- C18 H44 La N3 O21 P4 -","- C72 H176 La4 N12 O84 P16 -","4","1","","Lees, Anthony M. J.; Kresinski, Roman A.; Platt, Andrew W. G.","Complexes of (EtO)2P(O)CH2P(O)(OEt)2 with lanthanide nitrates","New Journal of Chemistry","2004","28","12","1457","","10.1039/b408536a","","x-ray","0.71069","MoKα","","0.0464","0.0365","","","0.0833","0.0853","","","","","","0.984","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7050382","5.3858","0.0003","13.3905","0.0009","13.4835","0.0006","90","","96.434","0.009","90","","966.29","0.1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H15 N O2 S -","- C7 H15 N O2 S -","- C28 H60 N4 O8 S4 -","4","1","","Lech Kozerski; Brunon Kwiecień; Robert Kawęcki; Zofia Urbańczyk-Lipkowska; Wojciech Bocian; Elżbieta Bednarek; Jerzy Sitkowski; Jan Maurin; Leszek Pazderski; Poul E. Hansen","Hydrogen bonds in “push-pull” enamines","New J. Chem.","2004","28","12","1562","1567","10.1039/b409254f","","","1.54178","CuKα","","0.0643","0.0634","","","0.1447","0.1474","","","","","","1.034","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7050383","5.764","0.005","16.888","0.012","6.447","0.004","90","","115.2","0.07","90","","567.8","0.8","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C9 H17 N O2 S -","- C9 H17 N O2 S -","- C18 H34 N2 O4 S2 -","2","1","","Lech Kozerski; Brunon Kwiecień; Robert Kawęcki; Zofia Urbańczyk-Lipkowska; Wojciech Bocian; Elżbieta Bednarek; Jerzy Sitkowski; Jan Maurin; Leszek Pazderski; Poul E. Hansen","Hydrogen bonds in “push-pull” enamines","New J. Chem.","2004","28","12","1562","1567","10.1039/b409254f","","","0.71073","MoKα","","0.1155","0.0531","","","0.1334","0.1522","","","","","","0.965","","","","has coordinates,has disorder","180057","2020-10-21","18:00:00",""
"7050384","20.7206","0.0006","20.5047","0.0005","11.9981","0.0003","90","","93.101","0.001","90","","5090.2","0.2","173","2","173","2","","","","","","","synthesis as described","6","P 1 21/c 1","-P 2ybc","14","[CL3Ti{(CyN)2CC6H4C(NCySiMe3)(NHCy)}]{Ti2Cl9]","","","- C35 H58 Cl12 N4 Si Ti3 -","- C35 H58 Cl12 N4 Si Ti3 -","- C140 H232 Cl48 N16 Si4 Ti12 -","4","1","","Grundy, Joanna; Coles, Martyn P.; Hitchcock, Peter B.","Ambiphilic ligands from the 1,4-benzenebis(amidine) framework","New Journal of Chemistry","2004","28","10","1195","1197","10.1039/b409256b","","x-ray","0.71073","MoKα","","0.0866","0.0508","","","0.0888","0.0996","","","","","","1.029","","","","has coordinates","218968","2020-10-21","18:00:00",""
"7050385","7.2878","0.0005","14.4364","0.0008","17.4246","0.001","72.557","0.005","85.278","0.005","82.046","0.005","1730.49","0.19","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[8-(3'-(3,5-dibenzyloxy-benzyloxy)-2'-hydroxyphenyl)- (5,6)-benzo-4,7-diazaocta-2,7-dien-1-onato(2-)]nickel(II)","","- C44 H36 N2 Ni O5 -","- C44 H36 N2 Ni O5 -","- C88 H72 N4 Ni2 O10 -","2","1","","Dariusz Pawlica; Marek Marszałek; Grzegorz Mynarczuk; Lesław Sieroń; Julita Eilmes","New unsymmetrical Schiff base Ni(II) complexes as scaffolds for dendritic and amino acid superstructures","New J. Chem.","2004","28","12","1615","1621","10.1039/b409298h","","x-ray","0.71073","MoKα","","0.0817","0.0334","","","0.0524","0.0612","","","","","","0.675","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050386","23.2759","0.0003","8.4381","0.0001","25.9355","0.0003","90","","96.476","0.001","90","","5061.34","0.11","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[8-(3'-Ac-(D,L)-alanyloxy)-2'-hydroxyphenyl)-(5,6)-benzo -4,7-diazaocta-2,7-dien-1-onato(2-)]nickel(II)","","- C28 H25 N3 Ni O5 -","- C28 H25 N3 Ni O5 -","- C224 H200 N24 Ni8 O40 -","8","1","","Dariusz Pawlica; Marek Marszałek; Grzegorz Mynarczuk; Lesław Sieroń; Julita Eilmes","New unsymmetrical Schiff base Ni(II) complexes as scaffolds for dendritic and amino acid superstructures","New J. Chem.","2004","28","12","1615","1621","10.1039/b409298h","","","1.54178","CuKα","","0.0368","0.0342","","","0.0992","0.1016","","","","","","1.05","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050387","21.8152","0.0003","7.5781","0.0001","22.956","0.0004","90","","114.209","0.0007","90","","3461.28","0.09","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","[8-(3'-Boc-(L)-phenylalanyloxy-2'-hydroxyphenyl)-(5,6) -benzo-3-methyl-1-phenyl-4,7-diazaocta-2,7-dien-1 -onato(2-)]nickel(II) dihydrate","","- C37 H39 N3 Ni O8 -","- C37 H39 N3 Ni O8 -","- C148 H156 N12 Ni4 O32 -","4","2","","Dariusz Pawlica; Marek Marszałek; Grzegorz Mynarczuk; Lesław Sieroń; Julita Eilmes","New unsymmetrical Schiff base Ni(II) complexes as scaffolds for dendritic and amino acid superstructures","New J. Chem.","2004","28","12","1615","1621","10.1039/b409298h","","","1.54178","CuKα","","0.0606","0.0437","","","0.1121","0.1205","","","","","","1.03","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050392","8.3873","0.0006","8.3873","0.0006","10.5853","0.0012","90","","90","","90","","744.64","0.11","150","2","150","2","","","","","","","","5","P 4/n m m :2","-P 4a 2a","129","caesium penta-bromo-monocarbadecaborane","","","- C H5 B9 Br5 Cs -","- C H5 B9 Br5 Cs -","- C2 H10 B18 Br10 Cs2 -","2","0.125","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.6883","synchrotron","","0.0617","0.0613","","","0.1211","0.1222","","","","","","1.241","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050393","15.0967","0.0003","9.246","0.0002","12.5568","0.0003","90","","97.112","0.001","90","","1739.24","0.07","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","caesium hexa-bromo-monocarbadodecaborane","","","- C H6 B11 Br6 Cs -","- C H6 B11 Br6 Cs -","- C4 H24 B44 Br24 Cs4 -","4","1","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.71073","MoKα","","0.0448","0.0376","","","0.0917","0.0958","","","","","","1.034","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7050395","35.96","0.03","24.41","0.02","25.89","0.02","90","","126.99","0.05","90","","18152","3","173","2","173","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C228 H218 O13 -","- C228 H218 O13 -","- C912 H872 O52 -","4","0.5","","Nicola Armaroli; Gianluca Accorsi; Yannick Rio; Paola Ceroni; Veronica Vicinelli; Richard Welter; Tao Gu; Mohamed Saddik; Michel Holler; Jean-François Nierengarten","Electronic properties of oligophenylenevinylene and oligophenyleneethynylene arrays constructed on the upper rim of a calix[4]arene core","New J. Chem.","2004","28","12","1627","1637","10.1039/b415063p","","","0.71069","MoKα","","0.1941","0.1119","","","0.2164","0.2534","","","","","","1.046","","","","has coordinates","180057","2020-10-21","18:00:00",""
"7052502","9.0167","0.0006","10.6153","0.0008","14.1165","0.0012","80.777","0.003","72.91","0.005","89.329","0.004","1273.91","0.17","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H44 Co2 O8 P4 -","- C56 H44 Co2 O8 P4 -","- C56 H44 Co2 O8 P4 -","1","0.5","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.1118","0.0535","","","0.0951","0.1162","","","","","","0.996","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052503","7.9541","0.0006","8.0955","0.0006","12.4315","0.0012","86.127","0.005","85.621","0.004","77.462","0.005","778.05","0.11","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H18 Co4 O14 -","- C28 H18 Co4 O14 -","- C28 H18 Co4 O14 -","1","0.5","","Golovko, Vladimir B.; Hope-Weeks, Louisa J.; Mays, Martin J.; McPartlin, Mary; Sloan, Anna M.; Woods, Anthony D.","Synthesis of cobalt-containing cyclophanes, and the formation of an unprecedented seven-membered cyclic diyneElectronic supplementary information (ESI) available: crystallographic data for complexes 8 and 11. See http://www.rsc.org/suppdata/nj/b3/b310515f/","New Journal of Chemistry","2004","28","4","527","","10.1039/b310515f","","","0.71069","MoKα","","0.0638","0.0473","","","0.1192","0.1288","","","","","","1.128","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052504","13.084","0.0015","18.5298","0.0019","10.169","0.0013","90","","97.236","0.009","90","","2445.8","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H28 Cl Fe N4 O8 -","- C22 H28 Cl Fe N4 O8 -","- C88 H112 Cl4 Fe4 N16 O32 -","4","0.5","","Sébastien Floquet; M. Carmen Muñoz; Eric Rivière; René Clément; Jean-Paul Audière; Marie-Laure Boillot","Structural effects on the magnetic properties of ferric complexes in molecular materials or a lamellar CdPS3 host matrix","New J. Chem.","2004","28","4","535","541","10.1039/b311371j","","","0.71073","MoKα","","0.1013","0.0715","","","0.2035","0.2358","","","","","","0.909","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052508","7.472","0.0005","8.9926","0.0006","17.5962","0.0014","90","","90","","90","","1182.34","0.15","250","2","250","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0334","0.0294","","","0.0817","0.0861","","","","","","1.069","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052509","7.4858","0.0004","9.0041","0.0005","17.6597","0.001","90","","90","","90","","1190.31","0.11","300","2","300","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0375","0.0325","","","0.0867","0.0912","","","","","","1.116","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052510","7.4904","0.0006","9.0176","0.0007","17.7254","0.0016","90","","90","","90","","1197.27","0.17","350","2","350","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1:1 co-crystal of urea:phosphoric acid","","","- C H7 N2 O5 P -","- C H7 N2 O5 P -","- C8 H56 N16 O40 P8 -","8","1","","Andrew Parkin; Suzanne M. Harte; Andrés E. Goeta; Chick C. Wilson","Imaging proton migration from X-rays and neutrons","New J. Chem.","2004","28","6","718","721","10.1039/b315515c","","","0.71073","MoKα","","0.0413","0.0348","","","0.0955","0.1017","","","","","","1.126","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7052511","7.1111","0.0012","7.8561","0.0013","9.031","0.0016","75.614","0.003","68.57","0.004","76.107","0.004","448.63","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H9 Co N O7 -","- C7 H5 Co N O7 -","- C14 H10 Co2 N2 O14 -","2","1","","Zhou, You-Fu; Yuan, Da-Qiang; Wu, Ben-Lai; Wang, Rui-Hu; Hong, Mao-Chun","Design of metal-organic NLO materials: complexes derived from pyridine-3,4-dicarboxylate","New Journal of Chemistry","2004","28","12","1590","","10.1039/b401802h","","","0.71073","MoKα","","0.118","0.0889","","","0.2229","0.2615","","","","","","1.022","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7052512","14.5462","0.0002","8.8913","0.0002","12.2784","0.0003","90","","97.01","0.001","90","","1576.15","0.06","150","2","150","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","caesium hexa-chloro-monocarbadodecaborane","","","- C H6 B11 Cl6 Cs -","- C H6 B11 Cl6 Cs -","- C4 H24 B44 Cl24 Cs4 -","4","1","","Andreas Franken; Neil J. Bullen; Tomáš Jelínek; Mark Thornton-Pett; Simon J. Teat; William Clegg; John D. Kennedy; Michaele J. Hardie","Structural chemistry of halogenated monocarbaboranes: the extended structures of Cs[1-HCB9H4Br5], Cs[1-HCB11H5Cl6] and Cs[1-HCB11H5Br6]","New J. Chem.","2004","28","12","1499","1505","10.1039/b410929e","","","0.71073","MoKα","","0.0413","0.0377","","","0.0983","0.1019","","","","","","1.086","","","","has coordinates","180079","2020-10-21","18:00:00",""
"7053689","21.7465","0.001","21.7465","0.001","16.8412","0.0015","90","","90","","120","","6897.4","0.8","295","2","295","2","","","","","","","","3","R -3 :H","-R 3","148","","","","- C30 H24 O3 -","- C30 H24 O3 -","- C360 H288 O36 -","12","0.666667","","Kumar, V. S. Senthil; Pigge, F. Christopher; Rath, Nigam P.","Interpenetration of distinct 2D and 3D organic networks in the crystal structure of 1,3,5-tris(4-methylbenzoyl)benzene","New Journal of Chemistry","2004","28","10","1192","","10.1039/b408481k","","","0.71073","MoKα","","0.0945","0.0544","","","0.1394","0.1591","","","","","","1.038","","","","has coordinates","180090","2020-10-21","18:00:00",""